A0A3Q0KPZ0_SCHMA Loading...

Crossover junction endonuclease EME1

AlphaFold DB , UniProt , Accession A0A3Q0KPZ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 442 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	36.3	Very low	34.1	Very low	244 Å²	244	142.2 Å²	142.2	100%	1.202	78%	0.782	S	S	*	*				0	115.9	0	-50.1	177.6	-167.8	0	0	105.9
2	A	29.6	Very low	34.9	Very low	90 Å²	90	137.3 Å²	137.3	74%	0.744	77%	0.766	S	S	*	*			trans	88.7	155.9	179.7	0	0	0	0	0	120.5
3	E	33.1	Very low	34.8	Very low	144 Å²	144	130.9 Å²	130.9	67%	0.673	73%	0.732	S	S	*	*				-165.7	129.7	-80.1	-85.8	-7.5	-69.6	0	0	116.7
4	Q	31.1	Very low	34.1	Very low	163 Å²	163	129.3 Å²	129.3	76%	0.762	73%	0.727	S	S	*	*				68.4	0	129.9	-51.6	173.7	18.5	0	0	127.6
5	L	31	Very low	33.6	Very low	172 Å²	172	125.5 Å²	125.5	90%	0.901	71%	0.71	S	S	*	*				0	0	0	-64.4	172.5	0	0	0	126.8
6	N	31	Very low	33.2	Very low	120 Å²	120	124.3 Å²	124.3	64%	0.642	71%	0.71	S	S	*	*				0	0	0	-164.2	10.8	0	0	0	123.3
7	V	32.1	Very low	32.5	Very low	93 Å²	93	128.2 Å²	128.2	56%	0.564	72%	0.717	S	S	*	*				0	0	0	159.6	0	0	0	0	126	L414	V7-L414 VanDerWaalsContact N-CD2 3.29Å; V7-L414 WeakPolarHBondContact O-CD1 3.47Å; V7-L414 WeakPolarHBondContact O-CD2 3.32Å
8	L	32.6	Very low	32	Very low	148 Å²	148	126.2 Å²	126.2	78%	0.775	70%	0.7	S	S	*	*				0	0	0	-87.4	174.6	0	0	0	118.2
9	T	37.5	Very low	31.5	Very low	126 Å²	126	131.9 Å²	131.9	77%	0.773	71%	0.709	S	S	*	*				0	0	0	56.1	0	0	0	0	123.9
10	D	37.4	Very low	31.2	Very low	166 Å²	166	131.5 Å²	131.5	89%	0.888	70%	0.701	S	S	*	*				0	0	0	-167.4	26.9	0	0	0	123.9
11	S	43.4	Very low	31.1	Very low	98 Å²	98	129.4 Å²	129.4	69%	0.685	69%	0.687	S	S	*	*				0	0	0	73.5	0	0	0	0	125.8
12	S	43.2	Very low	30.8	Very low	84 Å²	84	122.2 Å²	122.2	59%	0.587	66%	0.657	S	S	*	*				0	0	0	44.2	0	0	0	0	119.7	S298	S12-S298 VanDerWaalsContact CA-OG 3.28Å; S12-S298 WeakPolarHBondContact CA-OG 3.35Å; S12-S298 PolarHBondContact N-OG 3.04Å; S12-S298 WeakPolarHBondContact O-CB 3.42Å; S12-S298 PolarHBondContact O-OG 3.24Å; S12-S298 PolarHBondContact OG-OG 3.33Å; S12-S298 VanDerWaalsContact OG-OG 3.09Å
13	V	33.9	Very low	31.1	Very low	54 Å²	54	119.9 Å²	119.9	33%	0.327	64%	0.642	S	S	.	*				0	0	0	-141.9	0	0	0	0	116.9	K295	V13-K295 WeakPolarHBondContact O-CD 3.38Å; V13-K295 WeakPolarHBondContact O-CE 3.34Å; V13-K295 PolarHBondContact O-NZ 3.15Å
14	V	24.8	Very low	31.7	Very low	108 Å²	108	120.7 Å²	120.7	66%	0.655	64%	0.643	S	S	*	*				0	0	0	-172.3	0	0	0	0	123.4	R303	V14-R303 CarbonylContact C-O 3.37Å; V14-R303 CarbonylContact O-C 3.59Å
15	P	27.5	Very low	32.3	Very low	73 Å²	73	116.5 Å²	116.5	47%	0.474	63%	0.63	S	S	.	*				0	0	0	42.1	-41.1	0	0	0	131.7	R305	P15-R305 HydrophobicContact CB-CG 3.88Å; P15-R305 PolarHBondContact O-NE 3.19Å; P15-R305 PolarHBondContact O-NH2 3.42Å
16	C	26.9	Very low	33.3	Very low	105 Å²	105	114.5 Å²	114.5	71%	0.709	62%	0.616	S	S	*	*				0	0	0	-149.7	0	0	0	0	125.9	R305	C16-R305 VanDerWaalsContact SG-CZ 3.58Å
17	K	20.5	Very low	34.5	Very low	192 Å²	192	111.7 Å²	111.7	84%	0.835	60%	0.601	S	S	*	*				0	-137.6	0	-142.5	175.1	-175.9	178	0	125
18	K	24.8	Very low	35.8	Very low	92 Å²	92	111.9 Å²	111.9	40%	0.4	60%	0.595	S	S	.	*			trans	-129.3	168.3	-152.4	-146.6	-149.6	-167.9	-169	0	121.1	K43 T79	K18-K43 VanDerWaalsContact CE-CB 3.49Å; K18-K43 HydrophobicContact CG-CB 4.29Å; K18-K43 HydrophobicContact CG-CD 3.63Å; K18-K43 HydrophobicContact CG-CG 4.39Å; K18-T79 PolarHBondContact NZ-OG1 2.68Å
19	R	22	Very low	37.5	Very low	234 Å²	234	108.3 Å²	108.3	88%	0.883	58%	0.58	S	S	*	*			trans	-160.1	-161.4	165	-141.9	-171.2	-177.8	-168.7	1.5	116.4
20	K	25.9	Very low	39	Very low	124 Å²	124	105.6 Å²	105.6	54%	0.539	56%	0.557	S	S	.	*			trans	-142.1	169.9	-164.1	-169.4	-105.3	179.6	-171.7	0	116.9	T22 Y82	K20-T22 PolarHBondContact NZ-OG1 3.37Å; K20-Y82 WeakPolarHBondContact CE-OH 3.36Å; K20-Y82 HydrophobicContact CG-CE2 4.45Å; K20-Y82 PolarHBondContact NZ-OH 3.25Å
21	Q	28.2	Very low	40.7	Very low	87 Å²	87	100.3 Å²	100.3	41%	0.407	53%	0.526	S	S	.	.			trans	-150.3	165.6	-176.9	155.9	-84.6	21.1	0	0	115
22	T	29.9	Very low	41.9	Very low	93 Å²	93	95.8 Å²	95.8	57%	0.571	49%	0.494	S	S	*	.			trans	179	150.7	165.9	23	0	0	0	0	116.4	K20	K20-T22 PolarHBondContact NZ-OG1 3.37Å
23	G	36.9	Very low	43.4	Very low	42 Å²	42	95 Å²	95	43%	0.433	48%	0.482	S	S	.	.			trans	127.9	157.3	154.2	0	0	0	0	0	117.9	Q34	G23-Q34 VanDerWaalsContact N-OE1 3.15Å; G23-Q34 PolarHBondContact O-NE2 3.2Å; G23-Q34 PolarHBondContact O-OE1 2.86Å
24	K	45.5	Very low	45.5	Very low	161 Å²	161	94.1 Å²	94.1	70%	0.7	47%	0.474	S	S	*	.			cis	-158.5	-25.1	-0.6	-169.7	-94.6	151.2	-179.4	0	119.1	N27	K24-N27 WeakPolarHBondContact CA-OD1 3.36Å; K24-N27 PolarHBondContact O-ND2 2.76Å; K24-N27 PolarHBondContact O-OD1 3.15Å
25	P	42.5	Very low	47.8	Very low	74 Å²	74	89.1 Å²	89.1	48%	0.481	44%	0.444	S	S	.	.	S	Bend	trans	-90.3	-106.9	-163.7	32.6	-31.8	0	0	0	117.9	N27 K30	P25-N27 VanDerWaalsContact C-N 3.25Å; P25-N27 VanDerWaalsContact O-CA 3.24Å; P25-N27 WeakPolarHBondContact O-CA 3.15Å; P25-N27 WeakPolarHBondContact O-CB 3.49Å; P25-N27 VanDerWaalsContact O-CG 3.31Å; P25-N27 PolarHBondContact O-N 3.23Å; P25-K30 HydrophobicContact CG-CD 3.69Å
26	Q	53.6	Low	50.2	Low	131 Å²	131	86.9 Å²	86.9	61%	0.612	43%	0.427	S	S	*	.	S	Bend	trans	-58.7	85	173.3	-73.2	92.9	-23.8	0	0	110	K30	Q26-K30 HydrophobicContact CB-CD 4.22Å; Q26-K30 VanDerWaalsContact O-CB 3.26Å; Q26-K30 WeakPolarHBondContact O-CB 3.24Å; Q26-K30 WeakPolarHBondContact O-CG 3.05Å; Q26-K30 PolarHBondContact O-N 2.82Å; Q26-K30 VanDerWaalsContact O-N 3.1Å
27	N	56.4	Low	52.6	Low	60 Å²	60	87.4 Å²	87.4	32%	0.321	42%	0.417	S	S	.	.	H	α-helix	trans	-85.1	-31.4	-140.6	-120.4	-6.5	0	0	0	113.4	K24 P25 K31	K24-N27 WeakPolarHBondContact CA-OD1 3.36Å; K24-N27 PolarHBondContact O-ND2 2.76Å; K24-N27 PolarHBondContact O-OD1 3.15Å; P25-N27 VanDerWaalsContact C-N 3.25Å; P25-N27 VanDerWaalsContact O-CA 3.24Å; P25-N27 WeakPolarHBondContact O-CA 3.15Å; P25-N27 WeakPolarHBondContact O-CB 3.49Å; P25-N27 VanDerWaalsContact O-CG 3.31Å; P25-N27 PolarHBondContact O-N 3.23Å; N27-K31 WeakPolarHBondContact O-CA 3.41Å; N27-K31 WeakPolarHBondContact O-CB 3.01Å; N27-K31 WeakPolarHBondContact O-CG 3.38Å; N27-K31 PolarHBondContact O-N 2.84Å
28	H	59.6	Low	55.2	Low	97 Å²	97	80 Å²	80	45%	0.449	39%	0.385	S	S	.	.	H	α-helix	trans	-70.4	-50.2	-179.3	-92.6	-101.3	0	0	0	111.7	K30 K31 T32	H28-K30 PolarHBondContact O-N 2.91Å; H28-K31 PolarHBondContact O-N 3.28Å; H28-T32 WeakPolarHBondContact O-CB 3.44Å; H28-T32 PolarHBondContact O-N 2.61Å; H28-T32 PolarHBondContact O-OG1 2.91Å; H28-T32 VanDerWaalsContact O-OG1 3.12Å
29	V	66.4	Low	57.5	Low	73 Å²	73	75.8 Å²	75.8	44%	0.442	37%	0.367	S	S	.	.	H	α-helix	trans	-55.7	-50.1	171.4	-171.1	0	0	0	0	111.2	K31 T32 E33 L148	V29-K31 PolarHBondContact O-N 3.2Å; V29-T32 PolarHBondContact O-N 2.84Å; V29-E33 WeakPolarHBondContact O-CB 3.16Å; V29-E33 PolarHBondContact O-N 3.45Å; V29-L148 HydrophobicContact CB-CD1 4.35Å; V29-L148 HydrophobicContact CG1-CD1 4.06Å; V29-L148 HydrophobicContact CG2-CD1 3.97Å
30	K	70	Confident	60.1	Low	70 Å²	70	69 Å²	69	30%	0.304	35%	0.346	S	S	.	.	H	α-helix	trans	-69	-29.6	-178.5	-69.5	173.2	178.2	176.1	0	113.2	P25 Q26 H28 Q34	P25-K30 HydrophobicContact CG-CD 3.69Å; Q26-K30 HydrophobicContact CB-CD 4.22Å; Q26-K30 VanDerWaalsContact O-CB 3.26Å; Q26-K30 WeakPolarHBondContact O-CB 3.24Å; Q26-K30 WeakPolarHBondContact O-CG 3.05Å; Q26-K30 PolarHBondContact O-N 2.82Å; Q26-K30 VanDerWaalsContact O-N 3.1Å; H28-K30 PolarHBondContact O-N 2.91Å; K30-Q34 WeakPolarHBondContact O-CB 3.22Å; K30-Q34 WeakPolarHBondContact O-CG 3.41Å; K30-Q34 PolarHBondContact O-N 3.25Å; K30-Q34 PolarHBondContact O-NE2 3.3Å
31	K	72.2	Confident	62.4	Low	54 Å²	54	66 Å²	66	24%	0.235	34%	0.335	C	S	.	.	H	α-helix	trans	-70.5	-44.8	170.9	-82.9	174.3	170.9	-157.5	0	110.9	N27 H28 V29 Q34 L35 D88	N27-K31 WeakPolarHBondContact O-CA 3.41Å; N27-K31 WeakPolarHBondContact O-CB 3.01Å; N27-K31 WeakPolarHBondContact O-CG 3.38Å; N27-K31 PolarHBondContact O-N 2.84Å; H28-K31 PolarHBondContact O-N 3.28Å; V29-K31 PolarHBondContact O-N 3.2Å; K31-Q34 CarbonylContact O-C 3.51Å; K31-Q34 PolarHBondContact O-N 3.12Å; K31-L35 VanDerWaalsContact O-CB 3.28Å; K31-L35 WeakPolarHBondContact O-CB 3.48Å; K31-L35 PolarHBondContact O-N 2.82Å; K31-D88 VanDerWaalsContact CE-OD2 3.22Å; K31-D88 WeakPolarHBondContact CE-OD2 3.44Å; K31-D88 IonicContact NZ-OD1 3.64Å; K31-D88 IonicContact NZ-OD2 2.71Å; K31-D88 PolarHBondContact NZ-OD2 3.39Å
32	T	69.6	Low	64.6	Low	3 Å²	3	64.8 Å²	64.8	2%	0.018	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-47.4	177.9	-64.8	0	0	0	0	109.8	H28 V29 Q34 L35 L36 L90 I131 L148 I150	H28-T32 WeakPolarHBondContact O-CB 3.44Å; H28-T32 PolarHBondContact O-N 2.61Å; H28-T32 PolarHBondContact O-OG1 2.91Å; H28-T32 VanDerWaalsContact O-OG1 3.12Å; V29-T32 PolarHBondContact O-N 2.84Å; T32-Q34 PolarHBondContact O-N 2.83Å; T32-L35 PolarHBondContact O-N 3.1Å; T32-L36 WeakPolarHBondContact O-CB 3.36Å; T32-L36 PolarHBondContact O-N 2.74Å; T32-L90 WeakPolarHBondContact OG1-CD2 3.45Å; T32-I131 HydrophobicContact CG2-CD1 4.08Å; T32-I131 HydrophobicContact CG2-CG1 4.04Å; T32-L148 HydrophobicContact CG2-CB 4.23Å; T32-L148 PolarHBondContact OG1-O 3.18Å; T32-I150 HydrophobicContact CG2-CD1 4.23Å; T32-I150 HydrophobicContact CG2-CG1 3.8Å
33	E	75.2	Confident	66.7	Low	69 Å²	69	65.3 Å²	65.3	32%	0.322	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-44.1	169.5	-79.5	-172.7	-125.6	0	0	113.2	V29 L35 L36 K37	V29-E33 WeakPolarHBondContact O-CB 3.16Å; V29-E33 PolarHBondContact O-N 3.45Å; E33-L35 VanDerWaalsContact C-N 3.28Å; E33-L35 PolarHBondContact O-N 2.86Å; E33-L36 PolarHBondContact O-N 2.7Å; E33-K37 VanDerWaalsContact O-CB 3.29Å; E33-K37 WeakPolarHBondContact O-CB 3.28Å; E33-K37 WeakPolarHBondContact O-CD 3.26Å; E33-K37 VanDerWaalsContact O-CG 3.22Å; E33-K37 WeakPolarHBondContact O-CG 3.33Å; E33-K37 PolarHBondContact O-N 3.4Å; E33-K37 IonicContact OE2-NZ 2.64Å; E33-K37 PolarHBondContact OE2-NZ 3.26Å
34	Q	76.9	Confident	68.5	Low	34 Å²	34	64.3 Å²	64.3	16%	0.159	31%	0.314	C	S	.	.	H	α-helix	trans	-68.6	-28.8	179.3	-78.4	165.8	32.1	0	0	112.1	G23 K30 K31 T32 K38	G23-Q34 VanDerWaalsContact N-OE1 3.15Å; G23-Q34 PolarHBondContact O-NE2 3.2Å; G23-Q34 PolarHBondContact O-OE1 2.86Å; K30-Q34 WeakPolarHBondContact O-CB 3.22Å; K30-Q34 WeakPolarHBondContact O-CG 3.41Å; K30-Q34 PolarHBondContact O-N 3.25Å; K30-Q34 PolarHBondContact O-NE2 3.3Å; K31-Q34 CarbonylContact O-C 3.51Å; K31-Q34 PolarHBondContact O-N 3.12Å; T32-Q34 PolarHBondContact O-N 2.83Å; Q34-K38 WeakPolarHBondContact O-CB 3.37Å; Q34-K38 WeakPolarHBondContact O-CG 3.29Å; Q34-K38 PolarHBondContact O-N 3.13Å
35	L	74.5	Confident	70	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-77.7	-41	174.5	-176.6	55.9	0	0	0	110.5	K31 T32 E33 K38 L39 L90 E91 V94 I150	K31-L35 VanDerWaalsContact O-CB 3.28Å; K31-L35 WeakPolarHBondContact O-CB 3.48Å; K31-L35 PolarHBondContact O-N 2.82Å; T32-L35 PolarHBondContact O-N 3.1Å; E33-L35 VanDerWaalsContact C-N 3.28Å; E33-L35 PolarHBondContact O-N 2.86Å; L35-K38 HydrophobicContact CD1-CB 4.32Å; L35-K38 HydrophobicContact CD1-CD 4.01Å; L35-K38 CarbonylContact O-C 3.53Å; L35-K38 WeakPolarHBondContact O-CA 2.87Å; L35-K38 WeakPolarHBondContact O-CB 3.37Å; L35-K38 PolarHBondContact O-N 3.38Å; L35-K38 VanDerWaalsContact O-N 3.09Å; L35-L39 HydrophobicContact CD1-CD1 4.36Å; L35-L39 HydrophobicContact CD1-CG 4.14Å; L35-L39 HydrophobicContact CG-CD1 4.03Å; L35-L39 HydrophobicContact CG-CG 4.32Å; L35-L39 WeakPolarHBondContact O-CB 3.49Å; L35-L39 WeakPolarHBondContact O-CG 3.27Å; L35-L39 PolarHBondContact O-N 2.98Å; L35-L90 HydrophobicContact CB-CD2 4.34Å; L35-L90 HydrophobicContact CD2-CB 4.22Å; L35-L90 HydrophobicContact CD2-CD2 3.7Å; L35-L90 HydrophobicContact CD2-CG 3.7Å; L35-E91 HydrophobicContact CD1-CG 3.7Å; L35-E91 HydrophobicContact CD2-CG 3.78Å; L35-E91 HydrophobicContact CG-CG 4.37Å; L35-V94 HydrophobicContact CD2-CG2 4.18Å; L35-I150 HydrophobicContact CB-CD1 3.96Å; L35-I150 HydrophobicContact CD2-CD1 3.87Å; L35-I150 HydrophobicContact CG-CD1 3.82Å
36	L	77.2	Confident	71.7	Confident	25 Å²	25	54.3 Å²	54.3	13%	0.131	26%	0.263	C	S	.	.	H	α-helix	trans	-53.3	-56	167.9	-177	63.9	0	0	0	110.2	T32 E33 K38 L39 E40 P129 I131	T32-L36 WeakPolarHBondContact O-CB 3.36Å; T32-L36 PolarHBondContact O-N 2.74Å; E33-L36 PolarHBondContact O-N 2.7Å; L36-K38 PolarHBondContact O-N 3.43Å; L36-K38 VanDerWaalsContact O-N 3.13Å; L36-L39 PolarHBondContact O-N 3.13Å; L36-E40 HydrophobicContact CD1-CG 4.26Å; L36-E40 HydrophobicContact CG-CG 4.36Å; L36-E40 WeakPolarHBondContact O-CB 2.97Å; L36-E40 VanDerWaalsContact O-CG 3.26Å; L36-E40 WeakPolarHBondContact O-CG 3.11Å; L36-E40 PolarHBondContact O-N 3.45Å; L36-P129 HydrophobicContact CD1-CB 3.74Å; L36-P129 HydrophobicContact CD1-CG 3.74Å; L36-P129 WeakPolarHBondContact CD1-O 3.34Å; L36-I131 HydrophobicContact CD2-CD1 4.08Å; L36-I131 HydrophobicContact CD2-CG1 4.18Å
37	K	76.7	Confident	72.8	Confident	116 Å²	116	48.6 Å²	48.6	50%	0.504	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-18.7	176.4	-67.1	161.3	-175.9	168.5	0	114.2	E33 E40	E33-K37 VanDerWaalsContact O-CB 3.29Å; E33-K37 WeakPolarHBondContact O-CB 3.28Å; E33-K37 WeakPolarHBondContact O-CD 3.26Å; E33-K37 VanDerWaalsContact O-CG 3.22Å; E33-K37 WeakPolarHBondContact O-CG 3.33Å; E33-K37 PolarHBondContact O-N 3.4Å; E33-K37 IonicContact OE2-NZ 2.64Å; E33-K37 PolarHBondContact OE2-NZ 3.26Å; K37-E40 WeakPolarHBondContact CA-OE2 3.28Å
38	K	75.3	Confident	74	Confident	37 Å²	37	46.3 Å²	46.3	16%	0.161	22%	0.224	C	C	.	.	H	α-helix	trans	-80.9	-43	167.3	-78.6	167	-160.5	161.8	0	111.2	Q34 L35 L36 N41 N44 E91	Q34-K38 WeakPolarHBondContact O-CB 3.37Å; Q34-K38 WeakPolarHBondContact O-CG 3.29Å; Q34-K38 PolarHBondContact O-N 3.13Å; L35-K38 HydrophobicContact CD1-CB 4.32Å; L35-K38 HydrophobicContact CD1-CD 4.01Å; L35-K38 CarbonylContact O-C 3.53Å; L35-K38 WeakPolarHBondContact O-CA 2.87Å; L35-K38 WeakPolarHBondContact O-CB 3.37Å; L35-K38 PolarHBondContact O-N 3.38Å; L35-K38 VanDerWaalsContact O-N 3.09Å; L36-K38 PolarHBondContact O-N 3.43Å; L36-K38 VanDerWaalsContact O-N 3.13Å; K38-N41 WeakPolarHBondContact O-CB 3.41Å; K38-N41 PolarHBondContact O-N 3.02Å; K38-N41 VanDerWaalsContact O-N 3.16Å; K38-N44 PolarHBondContact O-ND2 3.34Å; K38-E91 IonicContact NZ-OE1 2.66Å; K38-E91 PolarHBondContact NZ-OE1 3.05Å
39	L	73.5	Confident	75.3	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-45	-178.1	-68.8	166.9	0	0	0	110.2	L35 L36 N41 L48 V94 P129 I150	L35-L39 HydrophobicContact CD1-CD1 4.36Å; L35-L39 HydrophobicContact CD1-CG 4.14Å; L35-L39 HydrophobicContact CG-CD1 4.03Å; L35-L39 HydrophobicContact CG-CG 4.32Å; L35-L39 WeakPolarHBondContact O-CB 3.49Å; L35-L39 WeakPolarHBondContact O-CG 3.27Å; L35-L39 PolarHBondContact O-N 2.98Å; L36-L39 PolarHBondContact O-N 3.13Å; L39-N41 PolarHBondContact O-N 2.9Å; L39-L48 HydrophobicContact CB-CD1 4.3Å; L39-L48 HydrophobicContact CD2-CD2 4.36Å; L39-L48 WeakPolarHBondContact O-CD1 3.3Å; L39-V94 HydrophobicContact CD1-CG1 3.95Å; L39-V94 HydrophobicContact CD1-CG2 4.42Å; L39-V94 HydrophobicContact CD2-CG1 4.02Å; L39-P129 HydrophobicContact CB-CB 4.46Å; L39-P129 HydrophobicContact CB-CG 4.03Å; L39-P129 HydrophobicContact CD1-CB 4Å; L39-P129 HydrophobicContact CD1-CG 4.48Å; L39-I150 HydrophobicContact CD1-CD1 4.16Å; L39-I150 HydrophobicContact CD1-CG2 4.33Å
40	E	75.7	Confident	76.3	Confident	92 Å²	92	38.3 Å²	38.3	43%	0.43	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-2.2	168.1	-65.5	171.5	155.7	0	0	113.9	L36 K37 F275	L36-E40 HydrophobicContact CD1-CG 4.26Å; L36-E40 HydrophobicContact CG-CG 4.36Å; L36-E40 WeakPolarHBondContact O-CB 2.97Å; L36-E40 VanDerWaalsContact O-CG 3.26Å; L36-E40 WeakPolarHBondContact O-CG 3.11Å; L36-E40 PolarHBondContact O-N 3.45Å; K37-E40 WeakPolarHBondContact CA-OE2 3.28Å; E40-F275 WeakPolarHBondContact O-CE1 3.48Å; E40-F275 VanDerWaalsContact O-CZ 3.22Å; E40-F275 WeakPolarHBondContact O-CZ 3.36Å
41	N	75.1	Confident	77.3	Confident	61 Å²	61	35.1 Å²	35.1	33%	0.326	17%	0.168	S	C	.	.	S	Bend	trans	-73.9	134.7	177.3	-159.7	-88.4	0	0	0	110.2	K38 L39 K43 N44 A45	K38-N41 WeakPolarHBondContact O-CB 3.41Å; K38-N41 PolarHBondContact O-N 3.02Å; K38-N41 VanDerWaalsContact O-N 3.16Å; L39-N41 PolarHBondContact O-N 2.9Å; N41-K43 PolarHBondContact O-N 3.42Å; N41-K43 WeakPolarHBondContact OD1-CB 3.33Å; N41-K43 VanDerWaalsContact OD1-CG 3.3Å; N41-K43 WeakPolarHBondContact OD1-CG 3.41Å; N41-K43 PolarHBondContact OD1-N 2.71Å; N41-N44 WeakPolarHBondContact O-CA 3.45Å; N41-N44 PolarHBondContact O-N 2.98Å; N41-A45 PolarHBondContact O-N 3.01Å
42	P	74	Confident	78.2	Confident	62 Å²	62	32.6 Å²	32.6	40%	0.403	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.4	177.7	19.8	-32.7	0	0	0	113.6	N44 F275	P42-N44 VanDerWaalsContact C-N 3.25Å; P42-N44 PolarHBondContact O-N 3.44Å; P42-F275 HydrophobicContact CB-CB 4.27Å; P42-F275 HydrophobicContact CB-CD1 3.79Å; P42-F275 HydrophobicContact CB-CD2 4.11Å; P42-F275 HydrophobicContact CB-CE1 4.22Å; P42-F275 HydrophobicContact CB-CG 3.73Å; P42-F275 HydrophobicContact CG-CD1 4.19Å
43	K	74.5	Confident	79.2	Confident	104 Å²	104	32.7 Å²	32.7	45%	0.452	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-0.7	177.4	-48.9	177.8	-164.1	-177.3	0	113.7	K18 N41	K18-K43 VanDerWaalsContact CE-CB 3.49Å; K18-K43 HydrophobicContact CG-CB 4.29Å; K18-K43 HydrophobicContact CG-CD 3.63Å; K18-K43 HydrophobicContact CG-CG 4.39Å; N41-K43 PolarHBondContact O-N 3.42Å; N41-K43 WeakPolarHBondContact OD1-CB 3.33Å; N41-K43 VanDerWaalsContact OD1-CG 3.3Å; N41-K43 WeakPolarHBondContact OD1-CG 3.41Å; N41-K43 PolarHBondContact OD1-N 2.71Å
44	N	73.2	Confident	79.9	Confident	21 Å²	21	29.9 Å²	29.9	11%	0.112	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-13.1	177.5	-69.2	2.4	0	0	0	112.3	K38 N41 P42 Y46 R47	K38-N44 PolarHBondContact O-ND2 3.34Å; N41-N44 WeakPolarHBondContact O-CA 3.45Å; N41-N44 PolarHBondContact O-N 2.98Å; P42-N44 VanDerWaalsContact C-N 3.25Å; P42-N44 PolarHBondContact O-N 3.44Å; N44-Y46 PolarHBondContact O-N 3Å; N44-Y46 VanDerWaalsContact O-N 3.09Å; N44-R47 VanDerWaalsContact CG-NH2 3.34Å; N44-R47 PolarHBondContact ND2-NH1 2.93Å; N44-R47 VanDerWaalsContact ND2-NH1 3.18Å; N44-R47 WeakPolarHBondContact O-CB 3.32Å; N44-R47 PolarHBondContact O-N 3.18Å; N44-R47 PolarHBondContact OD1-NH1 2.87Å; N44-R47 PolarHBondContact OD1-NH2 3.19Å
45	A	77.7	Confident	80.4	Confident	3 Å²	3	32 Å²	32	3%	0.025	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-48.9	-36	179.3	0	0	0	0	0	115.2	N41 R47 L48 A271 F275	N41-A45 PolarHBondContact O-N 3.01Å; A45-R47 VanDerWaalsContact C-N 3.25Å; A45-R47 PolarHBondContact O-N 2.66Å; A45-L48 PolarHBondContact O-N 2.82Å; A45-L48 VanDerWaalsContact O-N 3.12Å; A45-A271 HydrophobicContact CB-CB 4.34Å; A45-A271 WeakPolarHBondContact CB-O 3Å; A45-F275 HydrophobicContact CB-CD2 4.09Å; A45-F275 HydrophobicContact CB-CE2 3.46Å; A45-F275 VanDerWaalsContact CB-CE2 3.46Å; A45-F275 HydrophobicContact CB-CZ 4.29Å
46	Y	78.2	Confident	80.9	Confident	21 Å²	21	33.5 Å²	33.5	8%	0.082	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-70.9	-14.7	178	-163.7	-86.8	0	0	0	113.6	N44 L71 N74 W75 N264 T267 R268 A271	N44-Y46 PolarHBondContact O-N 3Å; N44-Y46 VanDerWaalsContact O-N 3.09Å; Y46-L71 WeakPolarHBondContact OH-CD2 3.36Å; Y46-N74 HydrophobicContact CE1-CB 3.87Å; Y46-N74 HydrophobicContact CE2-CB 4.39Å; Y46-W75 HydrophobicContact CD1-CB 4.47Å; Y46-W75 HydrophobicContact CE1-CB 4.16Å; Y46-N264 PolarHBondContact OH-OD1 2.87Å; Y46-T267 HydrophobicContact CD2-CG2 4.36Å; Y46-T267 HydrophobicContact CE2-CG2 3.64Å; Y46-R268 HydrophobicContact CD2-CB 4.43Å; Y46-R268 HydrophobicContact CE2-CB 4.2Å; Y46-A271 HydrophobicContact CD2-CB 3.98Å; Y46-A271 HydrophobicContact CG-CB 4.48Å
47	R	76.9	Confident	81.3	Confident	12 Å²	12	32.3 Å²	32.3	5%	0.045	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-81.1	-24.2	169	-60.7	-164.5	-150.2	94.7	36.2	112.9	N44 A45 I49 S78 I80 L98	N44-R47 VanDerWaalsContact CG-NH2 3.34Å; N44-R47 PolarHBondContact ND2-NH1 2.93Å; N44-R47 VanDerWaalsContact ND2-NH1 3.18Å; N44-R47 WeakPolarHBondContact O-CB 3.32Å; N44-R47 PolarHBondContact O-N 3.18Å; N44-R47 PolarHBondContact OD1-NH1 2.87Å; N44-R47 PolarHBondContact OD1-NH2 3.19Å; A45-R47 VanDerWaalsContact C-N 3.25Å; A45-R47 PolarHBondContact O-N 2.66Å; R47-I49 PolarHBondContact O-N 3.41Å; R47-S78 PolarHBondContact NE-O 3.4Å; R47-S78 PolarHBondContact NH2-O 3.48Å; R47-I80 HydrophobicContact CG-CD1 4.28Å; R47-L98 WeakPolarHBondContact O-CD2 3.46Å
48	L	82.4	Confident	81.6	Confident	11 Å²	11	28.2 Å²	28.2	6%	0.058	14%	0.143	C	C	.	.	S	Bend	trans	-88.6	22	-178.4	-63.4	178.3	0	0	0	111.7	L39 A45 L98 R126 Y127 P129 L152	L39-L48 HydrophobicContact CB-CD1 4.3Å; L39-L48 HydrophobicContact CD2-CD2 4.36Å; L39-L48 WeakPolarHBondContact O-CD1 3.3Å; A45-L48 PolarHBondContact O-N 2.82Å; A45-L48 VanDerWaalsContact O-N 3.12Å; L48-L98 HydrophobicContact CD2-CD2 4.42Å; L48-R126 CarbonylContact O-C 3.55Å; L48-R126 WeakPolarHBondContact O-CA 3.24Å; L48-R126 WeakPolarHBondContact O-CG 3.3Å; L48-Y127 PolarHBondContact O-N 3.39Å; L48-P129 HydrophobicContact CD1-CG 4.36Å; L48-L152 HydrophobicContact CD2-CD2 4.3Å
49	I	87	Confident	81.9	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.6	175.7	-72.9	-172.8	0	0	0	108.8	R47 L101 W124 T125 R126 T267 L270 A271	R47-I49 PolarHBondContact O-N 3.41Å; I49-L101 WeakPolarHBondContact O-CD1 3.09Å; I49-W124 HydrophobicContact CG2-CB 4.19Å; I49-W124 HydrophobicContact CG2-CG 4.26Å; I49-T125 WeakPolarHBondContact CA-O 3.3Å; I49-R126 HydrophobicContact CG1-CB 4.15Å; I49-R126 HydrophobicContact CG1-CG 4.13Å; I49-T267 HydrophobicContact CG2-CG2 4.33Å; I49-L270 HydrophobicContact CD1-CB 4.19Å; I49-A271 VanDerWaalsContact CD1-CA 3.49Å; I49-A271 HydrophobicContact CD1-CB 4.01Å
50	T	87.4	Confident	82.3	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144.6	162.9	59.1	0	0	0	0	110	P99 P100 Q103 W124 T125 Y127	T50-P99 HydrophobicContact CG2-CG 4.11Å; T50-P99 WeakPolarHBondContact CG2-O 3.46Å; T50-P100 WeakPolarHBondContact CB-O 3.43Å; T50-P100 WeakPolarHBondContact CG2-O 3.44Å; T50-Q103 PolarHBondContact OG1-NE2 3.28Å; T50-Q103 VanDerWaalsContact OG1-NE2 3.1Å; T50-W124 WeakPolarHBondContact O-CA 3.43Å; T50-T125 PolarHBondContact N-O 3.41Å; T50-T125 PolarHBondContact O-N 3.18Å; T50-Y127 HydrophobicContact CG2-CE2 3.82Å
51	C	90.2	Very high	82.6	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.014	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.8	178.1	-53.8	0	0	0	0	108.3	F53 L101 I102 Q103 W124 T267	C51-F53 HydrophobicContact CB-CD2 4.31Å; C51-F53 HydrophobicContact CB-CE2 3.44Å; C51-F53 VanDerWaalsContact CB-CE2 3.44Å; C51-F53 HydrophobicContact CB-CZ 4.07Å; C51-F53 WeakPolarHBondContact O-CD2 3.31Å; C51-L101 WeakPolarHBondContact CA-O 2.97Å; C51-L101 VanDerWaalsContact CB-O 3.32Å; C51-L101 WeakPolarHBondContact CB-O 3.48Å; C51-L101 PolarHBondContact N-O 3.49Å; C51-I102 WeakPolarHBondContact O-CA 3.26Å; C51-Q103 PolarHBondContact O-N 3.16Å; C51-W124 PolarHBondContact SG-NE1 3.01Å; C51-T267 VanDerWaalsContact SG-CG2 3.55Å
52	E	90.4	Very high	82.9	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.4	-174.7	-57.5	164.3	141.1	0	0	108.4	Q103 K105 S115 V116 F122 T123 T125	E52-Q103 WeakPolarHBondContact CA-O 3.07Å; E52-K105 HydrophobicContact CB-CD 4.33Å; E52-K105 HydrophobicContact CG-CD 4.34Å; E52-K105 IonicContact OE1-NZ 3.12Å; E52-K105 PolarHBondContact OE1-NZ 3.41Å; E52-S115 WeakPolarHBondContact OE1-CB 3.5Å; E52-S115 WeakPolarHBondContact OE2-CB 3.39Å; E52-V116 HydrophobicContact CB-CG2 3.94Å; E52-F122 VanDerWaalsContact O-CA 3.29Å; E52-F122 WeakPolarHBondContact O-CA 3.42Å; E52-T123 PolarHBondContact N-O 3.08Å; E52-T123 PolarHBondContact O-N 3.49Å; E52-T123 WeakPolarHBondContact OE2-CB 3.49Å; E52-T123 PolarHBondContact OE2-OG1 3.27Å; E52-T125 VanDerWaalsContact CD-OG1 3.29Å; E52-T125 WeakPolarHBondContact OE1-CB 3.41Å; E52-T125 PolarHBondContact OE1-OG1 2.98Å; E52-T125 PolarHBondContact OE2-OG1 3.32Å
53	F	90.5	Very high	83.3	Confident	5 Å²	5	32.8 Å²	32.8	2%	0.022	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.1	-172.3	-65.3	-106.6	0	0	0	109.3	C51 E55 L58 L67 L71 I102 Q103 K105 F122	C51-F53 HydrophobicContact CB-CD2 4.31Å; C51-F53 HydrophobicContact CB-CE2 3.44Å; C51-F53 VanDerWaalsContact CB-CE2 3.44Å; C51-F53 HydrophobicContact CB-CZ 4.07Å; C51-F53 WeakPolarHBondContact O-CD2 3.31Å; F53-E55 PolarHBondContact O-N 2.76Å; F53-L58 HydrophobicContact CB-CD1 3.93Å; F53-L58 HydrophobicContact CB-CD2 3.83Å; F53-L58 HydrophobicContact CB-CG 3.74Å; F53-L58 HydrophobicContact CD1-CD2 3.69Å; F53-L58 HydrophobicContact CD2-CD2 4.34Å; F53-L58 HydrophobicContact CE1-CD2 4.4Å; F53-L58 HydrophobicContact CG-CD1 4.45Å; F53-L58 HydrophobicContact CG-CD2 3.71Å; F53-L58 HydrophobicContact CG-CG 4.21Å; F53-L67 HydrophobicContact CD1-CD1 4.1Å; F53-L67 HydrophobicContact CE1-CD1 3.4Å; F53-L67 HydrophobicContact CE1-CD2 4.11Å; F53-L67 HydrophobicContact CE1-CG 4.38Å; F53-L67 HydrophobicContact CZ-CD1 3.9Å; F53-L67 HydrophobicContact CZ-CD2 4.2Å; F53-L71 HydrophobicContact CZ-CD1 4.25Å; F53-I102 HydrophobicContact CD2-CG2 3.78Å; F53-I102 HydrophobicContact CE2-CB 4.31Å; F53-I102 HydrophobicContact CE2-CG1 4.09Å; F53-I102 HydrophobicContact CE2-CG2 3.85Å; F53-Q103 PolarHBondContact N-O 3.32Å; F53-K105 PolarHBondContact O-N 3.37Å; F53-F122 AromaticContact CD1-CD1 3.22Å; F53-F122 HydrophobicContact CD1-CD1 3.22Å; F53-F122 AromaticContact CD1-CE1 3.46Å; F53-F122 HydrophobicContact CD1-CE1 3.46Å; F53-F122 VanDerWaalsContact CD1-CE1 3.46Å; F53-F122 HydrophobicContact CD1-CG 4.44Å; F53-F122 AromaticContact CE1-CD1 3.5Å; F53-F122 HydrophobicContact CE1-CD1 3.5Å; F53-F122 AromaticContact CE1-CE1 3.68Å; F53-F122 HydrophobicContact CE1-CE1 3.68Å; F53-F122 HydrophobicContact CG-CD1 4.04Å
54	D	90.7	Very high	83.8	Confident	11 Å²	11	31.5 Å²	31.5	6%	0.059	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	128.2	159.3	172.2	8.5	0	0	0	109.4	S56 I57 L58 V107 V116 S119 F120 S121	D54-S56 PolarHBondContact O-N 3.33Å; D54-S56 VanDerWaalsContact O-N 3.16Å; D54-S56 WeakPolarHBondContact OD1-CB 3.34Å; D54-S56 PolarHBondContact OD1-N 3.01Å; D54-S56 PolarHBondContact OD1-OG 2.95Å; D54-S56 PolarHBondContact OD2-OG 2.68Å; D54-I57 HydrophobicContact CB-CD1 3.86Å; D54-I57 HydrophobicContact CB-CG1 3.96Å; D54-I57 WeakPolarHBondContact O-CB 3.46Å; D54-I57 PolarHBondContact O-N 2.71Å; D54-L58 PolarHBondContact O-N 3.08Å; D54-V107 HydrophobicContact CB-CG2 4.06Å; D54-V107 VanDerWaalsContact CG-CG2 3.47Å; D54-V116 HydrophobicContact CB-CG1 3.62Å; D54-S119 VanDerWaalsContact OD2-CA 3.3Å; D54-S119 WeakPolarHBondContact OD2-CA 3.49Å; D54-F120 PolarHBondContact OD2-N 3.23Å; D54-S121 PolarHBondContact N-O 3.43Å
55	E	87.1	Confident	84.3	Confident	77 Å²	77	33.7 Å²	33.7	36%	0.36	20%	0.2	S	C	.	.	H	α-helix	trans	-49.3	-36	175.2	-77.6	166.5	-153.4	0	0	112.8	F53 I57 L58 Q59 P104 K105 T106	F53-E55 PolarHBondContact O-N 2.76Å; E55-I57 PolarHBondContact O-N 3.38Å; E55-L58 PolarHBondContact O-N 3.21Å; E55-Q59 WeakPolarHBondContact O-CG 3.26Å; E55-Q59 PolarHBondContact O-N 3.43Å; E55-P104 HydrophobicContact CG-CB 3.53Å; E55-K105 PolarHBondContact N-O 2.73Å; E55-T106 WeakPolarHBondContact OE1-CG2 3.33Å; E55-T106 PolarHBondContact OE1-N 2.76Å; E55-T106 WeakPolarHBondContact OE2-CG2 3.21Å
56	S	85.7	Confident	84.6	Confident	37 Å²	37	34.6 Å²	34.6	26%	0.259	21%	0.207	S	C	.	.	H	α-helix	trans	-62.1	-29.6	178	83.1	0	0	0	0	113.1	D54	D54-S56 PolarHBondContact O-N 3.33Å; D54-S56 VanDerWaalsContact O-N 3.16Å; D54-S56 WeakPolarHBondContact OD1-CB 3.34Å; D54-S56 PolarHBondContact OD1-N 3.01Å; D54-S56 PolarHBondContact OD1-OG 2.95Å; D54-S56 PolarHBondContact OD2-OG 2.68Å
57	I	84.9	Confident	84.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-78.8	-38	179.9	-48.8	168.7	0	0	0	111	D54 E55 Q59 M60 L63 F120 S121 F122 L163	D54-I57 HydrophobicContact CB-CD1 3.86Å; D54-I57 HydrophobicContact CB-CG1 3.96Å; D54-I57 WeakPolarHBondContact O-CB 3.46Å; D54-I57 PolarHBondContact O-N 2.71Å; E55-I57 PolarHBondContact O-N 3.38Å; I57-Q59 PolarHBondContact O-N 2.98Å; I57-M60 HydrophobicContact CG2-SD 4.08Å; I57-M60 VanDerWaalsContact O-CB 3.23Å; I57-M60 WeakPolarHBondContact O-CB 3.49Å; I57-M60 WeakPolarHBondContact O-CG 3.46Å; I57-M60 PolarHBondContact O-N 3.44Å; I57-L63 HydrophobicContact CG2-CD2 3.4Å; I57-F120 HydrophobicContact CG1-CB 4.38Å; I57-F120 HydrophobicContact CG1-CD1 4.05Å; I57-F120 HydrophobicContact CG1-CG 4.42Å; I57-S121 VanDerWaalsContact CD1-O 3.3Å; I57-S121 WeakPolarHBondContact CD1-O 3.01Å; I57-F122 HydrophobicContact CB-CE1 4.32Å; I57-F122 HydrophobicContact CD1-CD1 3.69Å; I57-F122 HydrophobicContact CD1-CE1 3.36Å; I57-F122 HydrophobicContact CD1-CG 4.46Å; I57-F122 HydrophobicContact CD1-CZ 3.87Å; I57-F122 HydrophobicContact CG1-CE1 4.39Å; I57-F122 HydrophobicContact CG2-CE1 3.66Å; I57-F122 HydrophobicContact CG2-CZ 3.99Å; I57-L163 HydrophobicContact CG2-CD2 4.03Å
58	L	82.3	Confident	85.1	Confident	29 Å²	29	35.1 Å²	35.1	15%	0.152	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-20.4	179.9	-63.5	-175.5	0	0	0	112.3	F53 D54 E55 M60 L64 L67 I102 P104	F53-L58 HydrophobicContact CB-CD1 3.93Å; F53-L58 HydrophobicContact CB-CD2 3.83Å; F53-L58 HydrophobicContact CB-CG 3.74Å; F53-L58 HydrophobicContact CD1-CD2 3.69Å; F53-L58 HydrophobicContact CD2-CD2 4.34Å; F53-L58 HydrophobicContact CE1-CD2 4.4Å; F53-L58 HydrophobicContact CG-CD1 4.45Å; F53-L58 HydrophobicContact CG-CD2 3.71Å; F53-L58 HydrophobicContact CG-CG 4.21Å; D54-L58 PolarHBondContact O-N 3.08Å; E55-L58 PolarHBondContact O-N 3.21Å; L58-M60 VanDerWaalsContact C-N 3.28Å; L58-L64 HydrophobicContact CD2-CD1 4.3Å; L58-L67 HydrophobicContact CD2-CD1 4.29Å; L58-I102 HydrophobicContact CD1-CG2 4.02Å; L58-I102 HydrophobicContact CD2-CG2 4.19Å; L58-P104 HydrophobicContact CD1-CB 4.02Å
59	Q	83.3	Confident	85.1	Confident	157 Å²	157	37.9 Å²	37.9	73%	0.734	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-12.3	170	-64.5	172	21.9	0	0	113.5	E55 I57 S61	E55-Q59 WeakPolarHBondContact O-CG 3.26Å; E55-Q59 PolarHBondContact O-N 3.43Å; I57-Q59 PolarHBondContact O-N 2.98Å; Q59-S61 PolarHBondContact O-N 2.94Å
60	M	81.6	Confident	84.8	Confident	42 Å²	42	40.2 Å²	40.2	21%	0.207	24%	0.243	C	C	.	.	S	Bend	trans	-66.2	122.5	176.7	-65.6	-176.4	68.5	0	0	111.3	I57 L58 G62 L63 F120 L163 T165 L209 L256	I57-M60 HydrophobicContact CG2-SD 4.08Å; I57-M60 VanDerWaalsContact O-CB 3.23Å; I57-M60 WeakPolarHBondContact O-CB 3.49Å; I57-M60 WeakPolarHBondContact O-CG 3.46Å; I57-M60 PolarHBondContact O-N 3.44Å; L58-M60 VanDerWaalsContact C-N 3.28Å; M60-G62 PolarHBondContact O-N 3.2Å; M60-L63 HydrophobicContact CB-CB 3.95Å; M60-L63 HydrophobicContact CB-CD2 4.12Å; M60-L63 WeakPolarHBondContact O-CB 3.18Å; M60-L63 PolarHBondContact O-N 3.31Å; M60-L63 HydrophobicContact SD-CD2 3.99Å; M60-F120 HydrophobicContact SD-CE1 4.38Å; M60-L163 HydrophobicContact CE-CD2 4.28Å; M60-L163 HydrophobicContact SD-CD2 3.78Å; M60-T165 HydrophobicContact CE-CG2 3.92Å; M60-T165 HydrophobicContact SD-CG2 4.3Å; M60-L209 HydrophobicContact CE-CD2 3.78Å; M60-L256 HydrophobicContact CE-CD2 4.47Å
61	S	80.5	Confident	84.4	Confident	110 Å²	110	40.2 Å²	40.2	77%	0.769	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	124	-173.2	52	0	0	0	0	112.6	Q59 L63 L256	Q59-S61 PolarHBondContact O-N 2.94Å; S61-L63 PolarHBondContact O-N 3.45Å; S61-L256 WeakPolarHBondContact O-CD1 3.43Å
62	G	81.4	Confident	83.6	Confident	43 Å²	43	43.5 Å²	43.5	44%	0.443	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-8.5	-179	0	0	0	0	0	116	M60 S66	M60-G62 PolarHBondContact O-N 3.2Å; G62-S66 WeakPolarHBondContact O-CB 3.39Å; G62-S66 PolarHBondContact O-N 3.47Å; G62-S66 PolarHBondContact O-OG 2.78Å
63	L	83.9	Confident	82.6	Confident	0 Å²	0	46 Å²	46	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-70.4	-47.9	178.5	179.3	52.9	0	0	0	111.1	I57 M60 S61 A65 S66 L67 L163 L256 V259	I57-L63 HydrophobicContact CG2-CD2 3.4Å; M60-L63 HydrophobicContact CB-CB 3.95Å; M60-L63 HydrophobicContact CB-CD2 4.12Å; M60-L63 WeakPolarHBondContact O-CB 3.18Å; M60-L63 PolarHBondContact O-N 3.31Å; M60-L63 HydrophobicContact SD-CD2 3.99Å; S61-L63 PolarHBondContact O-N 3.45Å; L63-A65 PolarHBondContact O-N 3.44Å; L63-S66 WeakPolarHBondContact O-CB 3.46Å; L63-S66 PolarHBondContact O-N 3.32Å; L63-S66 VanDerWaalsContact O-N 3.13Å; L63-L67 HydrophobicContact CD1-CD1 3.92Å; L63-L67 HydrophobicContact CD1-CD2 4.46Å; L63-L67 HydrophobicContact CD1-CG 3.89Å; L63-L67 HydrophobicContact CG-CD1 3.83Å; L63-L67 HydrophobicContact CG-CG 4.31Å; L63-L67 WeakPolarHBondContact O-CB 3.22Å; L63-L67 VanDerWaalsContact O-CG 3.31Å; L63-L67 WeakPolarHBondContact O-CG 3.29Å; L63-L67 PolarHBondContact O-N 2.75Å; L63-L163 HydrophobicContact CD2-CD2 3.75Å; L63-L256 HydrophobicContact CB-CD1 4.24Å; L63-L256 HydrophobicContact CB-CD2 4.27Å; L63-L256 HydrophobicContact CD1-CD2 4.21Å; L63-V259 HydrophobicContact CD1-CG1 4.41Å
64	L	84.2	Confident	81.3	Confident	76 Å²	76	48.2 Å²	48.2	40%	0.398	29%	0.291	S	S	.	.	H	α-helix	trans	-54.9	-50.5	174.9	176.7	60	0	0	0	111.3	L58 S66 L67 T68 I102	L58-L64 HydrophobicContact CD2-CD1 4.3Å; L64-S66 VanDerWaalsContact C-N 3.31Å; L64-S66 PolarHBondContact O-N 2.89Å; L64-L67 PolarHBondContact O-N 2.97Å; L64-L67 VanDerWaalsContact O-N 3.16Å; L64-T68 WeakPolarHBondContact O-CB 3.38Å; L64-T68 PolarHBondContact O-N 2.84Å; L64-T68 PolarHBondContact O-OG1 2.69Å; L64-T68 VanDerWaalsContact O-OG1 3.04Å; L64-I102 HydrophobicContact CD1-CD1 4.19Å; L64-I102 HydrophobicContact CD1-CG2 4.44Å
65	A	83.2	Confident	80	Confident	67 Å²	67	51.2 Å²	51.2	55%	0.554	30%	0.302	S	S	*	.	H	α-helix	trans	-58.9	-40.5	177.1	0	0	0	0	0	112.7	L63 S69	L63-A65 PolarHBondContact O-N 3.44Å; A65-S69 WeakPolarHBondContact O-CB 3.43Å; A65-S69 PolarHBondContact O-N 3.48Å; A65-S69 PolarHBondContact O-OG 3.06Å
66	S	84.6	Confident	78.5	Confident	23 Å²	23	53.1 Å²	53.1	16%	0.161	31%	0.311	C	S	.	.	H	α-helix	trans	-64.2	-44.9	175.5	-60.6	0	0	0	0	111.8	G62 L63 L64 S69 K70	G62-S66 WeakPolarHBondContact O-CB 3.39Å; G62-S66 PolarHBondContact O-N 3.47Å; G62-S66 PolarHBondContact O-OG 2.78Å; L63-S66 WeakPolarHBondContact O-CB 3.46Å; L63-S66 PolarHBondContact O-N 3.32Å; L63-S66 VanDerWaalsContact O-N 3.13Å; L64-S66 VanDerWaalsContact C-N 3.31Å; L64-S66 PolarHBondContact O-N 2.89Å; S66-S69 PolarHBondContact O-OG 2.7Å; S66-K70 WeakPolarHBondContact O-CG 3.48Å; S66-K70 PolarHBondContact O-N 3.27Å
67	L	84.5	Confident	76.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.6	-54.4	176.9	-72.1	166.3	0	0	0	111.3	F53 L58 L63 L64 S69 K70 L71 I102 A260 L263	F53-L67 HydrophobicContact CD1-CD1 4.1Å; F53-L67 HydrophobicContact CE1-CD1 3.4Å; F53-L67 HydrophobicContact CE1-CD2 4.11Å; F53-L67 HydrophobicContact CE1-CG 4.38Å; F53-L67 HydrophobicContact CZ-CD1 3.9Å; F53-L67 HydrophobicContact CZ-CD2 4.2Å; L58-L67 HydrophobicContact CD2-CD1 4.29Å; L63-L67 HydrophobicContact CD1-CD1 3.92Å; L63-L67 HydrophobicContact CD1-CD2 4.46Å; L63-L67 HydrophobicContact CD1-CG 3.89Å; L63-L67 HydrophobicContact CG-CD1 3.83Å; L63-L67 HydrophobicContact CG-CG 4.31Å; L63-L67 WeakPolarHBondContact O-CB 3.22Å; L63-L67 VanDerWaalsContact O-CG 3.31Å; L63-L67 WeakPolarHBondContact O-CG 3.29Å; L63-L67 PolarHBondContact O-N 2.75Å; L64-L67 PolarHBondContact O-N 2.97Å; L64-L67 VanDerWaalsContact O-N 3.16Å; L67-S69 VanDerWaalsContact C-N 3.31Å; L67-S69 PolarHBondContact O-N 3.25Å; L67-K70 PolarHBondContact O-N 2.9Å; L67-L71 HydrophobicContact CB-CD1 4.23Å; L67-L71 HydrophobicContact CD2-CD1 4.22Å; L67-L71 WeakPolarHBondContact O-CB 3.45Å; L67-L71 WeakPolarHBondContact O-CG 3.44Å; L67-L71 PolarHBondContact O-N 2.84Å; L67-I102 HydrophobicContact CB-CD1 4.28Å; L67-A260 HydrophobicContact CD2-CB 4.28Å; L67-L263 HydrophobicContact CD2-CB 4.36Å; L67-L263 HydrophobicContact CD2-CD1 3.8Å
68	T	81.3	Confident	75.4	Confident	44 Å²	44	56 Å²	56	27%	0.27	33%	0.331	S	S	.	.	H	α-helix	trans	-50.4	-50.6	175.7	-62.2	0	0	0	0	110.6	L64 K70 E72	L64-T68 WeakPolarHBondContact O-CB 3.38Å; L64-T68 PolarHBondContact O-N 2.84Å; L64-T68 PolarHBondContact O-OG1 2.69Å; L64-T68 VanDerWaalsContact O-OG1 3.04Å; T68-K70 PolarHBondContact O-N 2.79Å; T68-E72 HydrophobicContact CG2-CG 3.98Å; T68-E72 WeakPolarHBondContact O-CB 3.21Å; T68-E72 PolarHBondContact O-N 2.83Å
69	S	81.3	Confident	73.9	Confident	68 Å²	68	56.8 Å²	56.8	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-21.2	-179.7	78.6	0	0	0	0	115.3	A65 S66 L67 A73	A65-S69 WeakPolarHBondContact O-CB 3.43Å; A65-S69 PolarHBondContact O-N 3.48Å; A65-S69 PolarHBondContact O-OG 3.06Å; S66-S69 PolarHBondContact O-OG 2.7Å; L67-S69 VanDerWaalsContact C-N 3.31Å; L67-S69 PolarHBondContact O-N 3.25Å; S69-A73 WeakPolarHBondContact O-CB 3.13Å
70	K	82	Confident	72.4	Confident	50 Å²	50	50.4 Å²	50.4	22%	0.217	31%	0.308	C	S	.	.	H	α-helix	trans	-105.2	-44	-177.7	-64	-66.5	-176	170.7	0	112.7	S66 L67 T68 N74 H257 A260 M261 N264	S66-K70 WeakPolarHBondContact O-CG 3.48Å; S66-K70 PolarHBondContact O-N 3.27Å; L67-K70 PolarHBondContact O-N 2.9Å; T68-K70 PolarHBondContact O-N 2.79Å; K70-N74 PolarHBondContact O-ND2 3.36Å; K70-H257 WeakPolarHBondContact CE-CE1 3.22Å; K70-H257 VanDerWaalsContact CE-NE2 3.26Å; K70-H257 WeakPolarHBondContact CE-NE2 3.46Å; K70-H257 PolarHBondContact NZ-CE1 3.39Å; K70-H257 VanDerWaalsContact NZ-CE1 3.32Å; K70-H257 PolarHBondContact NZ-NE2 3.45Å; K70-A260 HydrophobicContact CG-CB 4.05Å; K70-M261 HydrophobicContact CD-CG 4.43Å; K70-N264 HydrophobicContact CB-CB 4.28Å; K70-N264 PolarHBondContact O-OD1 2.95Å
71	L	79.5	Confident	71.1	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-72.4	-48.4	179.2	-63	177.1	0	0	0	110.3	Y46 F53 L67 A73 N74 W75 L101 I102 N264	Y46-L71 WeakPolarHBondContact OH-CD2 3.36Å; F53-L71 HydrophobicContact CZ-CD1 4.25Å; L67-L71 HydrophobicContact CB-CD1 4.23Å; L67-L71 HydrophobicContact CD2-CD1 4.22Å; L67-L71 WeakPolarHBondContact O-CB 3.45Å; L67-L71 WeakPolarHBondContact O-CG 3.44Å; L67-L71 PolarHBondContact O-N 2.84Å; L71-A73 VanDerWaalsContact C-N 3.34Å; L71-A73 PolarHBondContact O-N 3.13Å; L71-N74 PolarHBondContact O-N 3.09Å; L71-N74 VanDerWaalsContact O-N 3.15Å; L71-W75 PolarHBondContact O-N 2.96Å; L71-L101 HydrophobicContact CB-CD2 3.89Å; L71-I102 HydrophobicContact CD1-CD1 4.16Å; L71-I102 HydrophobicContact CD1-CG1 4.14Å; L71-N264 HydrophobicContact CD2-CB 3.95Å
72	E	73	Confident	70	Confident	71 Å²	71	54.8 Å²	54.8	33%	0.332	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-34.6	177.9	-65.8	-162.2	-171.9	0	0	112.6	T68 N74 W75 Q76	T68-E72 HydrophobicContact CG2-CG 3.98Å; T68-E72 WeakPolarHBondContact O-CB 3.21Å; T68-E72 PolarHBondContact O-N 2.83Å; E72-N74 PolarHBondContact O-N 2.78Å; E72-W75 CarbonylContact O-C 3.53Å; E72-W75 PolarHBondContact O-N 3.1Å; E72-W75 VanDerWaalsContact O-N 3.11Å; E72-Q76 HydrophobicContact CB-CG 4.26Å; E72-Q76 VanDerWaalsContact O-CB 3.27Å; E72-Q76 WeakPolarHBondContact O-CB 3.47Å; E72-Q76 VanDerWaalsContact O-CG 3.3Å; E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 2.91Å; E72-Q76 PolarHBondContact OE2-NE2 2.93Å
73	A	68.6	Low	68.9	Low	53 Å²	53	53.1 Å²	53.1	44%	0.438	29%	0.293	S	S	.	.	H	α-helix	trans	-58	-32.9	175.2	0	0	0	0	0	112.3	S69 L71 S77	S69-A73 WeakPolarHBondContact O-CB 3.13Å; L71-A73 VanDerWaalsContact C-N 3.34Å; L71-A73 PolarHBondContact O-N 3.13Å; A73-S77 WeakPolarHBondContact O-CB 3.4Å; A73-S77 PolarHBondContact O-N 2.91Å; A73-S77 PolarHBondContact O-OG 2.66Å
74	N	63.2	Low	67.7	Low	52 Å²	52	56.3 Å²	56.3	28%	0.278	31%	0.312	S	S	.	.	H	α-helix	trans	-84.2	-35	174.5	-71.1	-75.3	0	0	0	112.3	Y46 K70 L71 E72 S77 S78 N264	Y46-N74 HydrophobicContact CE1-CB 3.87Å; Y46-N74 HydrophobicContact CE2-CB 4.39Å; K70-N74 PolarHBondContact O-ND2 3.36Å; L71-N74 PolarHBondContact O-N 3.09Å; L71-N74 VanDerWaalsContact O-N 3.15Å; E72-N74 PolarHBondContact O-N 2.78Å; N74-S77 PolarHBondContact O-OG 2.84Å; N74-S78 VanDerWaalsContact O-CB 3.28Å; N74-S78 WeakPolarHBondContact O-CB 3.32Å; N74-S78 PolarHBondContact O-N 3.39Å; N74-S78 PolarHBondContact O-OG 3.2Å; N74-N264 PolarHBondContact ND2-ND2 3.13Å; N74-N264 PolarHBondContact ND2-OD1 3.06Å
75	W	63.8	Low	66.6	Low	75 Å²	75	58.3 Å²	58.3	28%	0.284	32%	0.324	S	S	.	.	H	α-helix	trans	-65	-63.9	173.7	-164.3	79.4	0	0	0	111.5	Y46 L71 E72 S77 S78 I80 L101	Y46-W75 HydrophobicContact CD1-CB 4.47Å; Y46-W75 HydrophobicContact CE1-CB 4.16Å; L71-W75 PolarHBondContact O-N 2.96Å; E72-W75 CarbonylContact O-C 3.53Å; E72-W75 PolarHBondContact O-N 3.1Å; E72-W75 VanDerWaalsContact O-N 3.11Å; W75-S77 PolarHBondContact O-N 3.3Å; W75-S78 CarbonylContact O-C 3.53Å; W75-S78 WeakPolarHBondContact O-CA 3.4Å; W75-S78 WeakPolarHBondContact O-CB 2.96Å; W75-S78 PolarHBondContact O-N 2.9Å; W75-S78 PolarHBondContact O-OG 2.92Å; W75-I80 VanDerWaalsContact C-CD1 3.48Å; W75-I80 HydrophobicContact CB-CD1 4.49Å; W75-I80 HydrophobicContact CD2-CD1 3.44Å; W75-I80 VanDerWaalsContact CD2-CD1 3.44Å; W75-I80 HydrophobicContact CD2-CG1 3.83Å; W75-I80 HydrophobicContact CE3-CD1 3.74Å; W75-I80 HydrophobicContact CE3-CG1 3.88Å; W75-I80 HydrophobicContact CG-CD1 3.76Å; W75-I80 HydrophobicContact CH2-CB 4.48Å; W75-I80 HydrophobicContact CH2-CD1 4.48Å; W75-I80 HydrophobicContact CH2-CG1 3.78Å; W75-I80 HydrophobicContact CH2-CG2 4.05Å; W75-I80 HydrophobicContact CZ2-CD1 4.23Å; W75-I80 HydrophobicContact CZ2-CG1 3.72Å; W75-I80 HydrophobicContact CZ3-CB 4.35Å; W75-I80 HydrophobicContact CZ3-CD1 4.25Å; W75-I80 HydrophobicContact CZ3-CG1 3.85Å; W75-I80 HydrophobicContact CZ3-CG2 4.17Å; W75-I80 WeakPolarHBondContact O-CD1 3.3Å; W75-L101 HydrophobicContact CB-CD2 3.66Å; W75-L101 HydrophobicContact CD2-CD2 4.49Å; W75-L101 HydrophobicContact CG-CD2 3.78Å
76	Q	55.1	Low	65.6	Low	117 Å²	117	55.6 Å²	55.6	55%	0.547	30%	0.301	S	S	.	.	H	α-helix	trans	-53.5	-46.6	-179.6	-62.6	179.8	12.9	0	0	112.3	E72 S78 T79	E72-Q76 HydrophobicContact CB-CG 4.26Å; E72-Q76 VanDerWaalsContact O-CB 3.27Å; E72-Q76 WeakPolarHBondContact O-CB 3.47Å; E72-Q76 VanDerWaalsContact O-CG 3.3Å; E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 2.91Å; E72-Q76 PolarHBondContact OE2-NE2 2.93Å; Q76-S78 PolarHBondContact O-N 2.87Å; Q76-T79 PolarHBondContact O-N 3.35Å; Q76-T79 VanDerWaalsContact O-N 3.15Å
77	S	53.2	Low	64.6	Low	80 Å²	80	62.1 Å²	62.1	56%	0.559	33%	0.334	S	S	*	.	H	α-helix	trans	-65.9	-18	176.4	70	0	0	0	0	113.4	A73 N74 W75 T79	A73-S77 WeakPolarHBondContact O-CB 3.4Å; A73-S77 PolarHBondContact O-N 2.91Å; A73-S77 PolarHBondContact O-OG 2.66Å; N74-S77 PolarHBondContact O-OG 2.84Å; W75-S77 PolarHBondContact O-N 3.3Å; S77-T79 VanDerWaalsContact C-N 3.29Å; S77-T79 PolarHBondContact O-N 2.91Å
78	S	53.5	Low	63.8	Low	17 Å²	17	63.9 Å²	63.9	12%	0.119	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	41	168.7	84.6	0	0	0	0	113.6	R47 N74 W75 Q76 I80	R47-S78 PolarHBondContact NE-O 3.4Å; R47-S78 PolarHBondContact NH2-O 3.48Å; N74-S78 VanDerWaalsContact O-CB 3.28Å; N74-S78 WeakPolarHBondContact O-CB 3.32Å; N74-S78 PolarHBondContact O-N 3.39Å; N74-S78 PolarHBondContact O-OG 3.2Å; W75-S78 CarbonylContact O-C 3.53Å; W75-S78 WeakPolarHBondContact O-CA 3.4Å; W75-S78 WeakPolarHBondContact O-CB 2.96Å; W75-S78 PolarHBondContact O-N 2.9Å; W75-S78 PolarHBondContact O-OG 2.92Å; Q76-S78 PolarHBondContact O-N 2.87Å; S78-I80 PolarHBondContact O-N 2.8Å
79	T	50.6	Low	63.2	Low	45 Å²	45	66 Å²	66	28%	0.276	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	30	150.7	-26	0	0	0	0	116.5	K18 Q76 S77 Q81 Y82	K18-T79 PolarHBondContact NZ-OG1 2.68Å; Q76-T79 PolarHBondContact O-N 3.35Å; Q76-T79 VanDerWaalsContact O-N 3.15Å; S77-T79 VanDerWaalsContact C-N 3.29Å; S77-T79 PolarHBondContact O-N 2.91Å; T79-Q81 VanDerWaalsContact C-N 3.33Å; T79-Q81 PolarHBondContact O-N 3.19Å; T79-Y82 VanDerWaalsContact CG2-CB 3.48Å; T79-Y82 HydrophobicContact CG2-CG 4.26Å; T79-Y82 WeakPolarHBondContact O-CB 3.48Å; T79-Y82 PolarHBondContact O-N 2.76Å
80	I	52	Low	62.6	Low	24 Å²	24	63.6 Å²	63.6	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-41.6	174.1	-77.4	79.6	0	0	0	111.2	R47 W75 S78 Y82 L83 T84	R47-I80 HydrophobicContact CG-CD1 4.28Å; W75-I80 VanDerWaalsContact C-CD1 3.48Å; W75-I80 HydrophobicContact CB-CD1 4.49Å; W75-I80 HydrophobicContact CD2-CD1 3.44Å; W75-I80 VanDerWaalsContact CD2-CD1 3.44Å; W75-I80 HydrophobicContact CD2-CG1 3.83Å; W75-I80 HydrophobicContact CE3-CD1 3.74Å; W75-I80 HydrophobicContact CE3-CG1 3.88Å; W75-I80 HydrophobicContact CG-CD1 3.76Å; W75-I80 HydrophobicContact CH2-CB 4.48Å; W75-I80 HydrophobicContact CH2-CD1 4.48Å; W75-I80 HydrophobicContact CH2-CG1 3.78Å; W75-I80 HydrophobicContact CH2-CG2 4.05Å; W75-I80 HydrophobicContact CZ2-CD1 4.23Å; W75-I80 HydrophobicContact CZ2-CG1 3.72Å; W75-I80 HydrophobicContact CZ3-CB 4.35Å; W75-I80 HydrophobicContact CZ3-CD1 4.25Å; W75-I80 HydrophobicContact CZ3-CG1 3.85Å; W75-I80 HydrophobicContact CZ3-CG2 4.17Å; W75-I80 WeakPolarHBondContact O-CD1 3.3Å; S78-I80 PolarHBondContact O-N 2.8Å; I80-Y82 PolarHBondContact O-N 2.84Å; I80-L83 PolarHBondContact O-N 2.94Å; I80-T84 HydrophobicContact CG2-CG2 3.63Å; I80-T84 PolarHBondContact O-N 3.46Å; I80-T84 PolarHBondContact O-OG1 3.01Å
81	Q	53.6	Low	62	Low	152 Å²	152	61.6 Å²	61.6	71%	0.71	33%	0.331	S	S	*	.	H	α-helix	trans	-50.2	-23.3	173.7	-73.6	-178.8	-23	0	0	114.4	T79 T84 N85	T79-Q81 VanDerWaalsContact C-N 3.33Å; T79-Q81 PolarHBondContact O-N 3.19Å; Q81-T84 WeakPolarHBondContact CA-OG1 3.22Å; Q81-N85 WeakPolarHBondContact O-CB 3.36Å; Q81-N85 PolarHBondContact O-N 3.5Å; Q81-N85 PolarHBondContact O-OD1 3.32Å
82	Y	57.7	Low	61.7	Low	91 Å²	91	66 Å²	66	36%	0.357	35%	0.35	S	S	.	.	H	α-helix	trans	-81.1	-34.2	176.5	-178.5	-79.8	0	0	0	112.5	K20 T79 I80 S86 E91	K20-Y82 WeakPolarHBondContact CE-OH 3.36Å; K20-Y82 HydrophobicContact CG-CE2 4.45Å; K20-Y82 PolarHBondContact NZ-OH 3.25Å; T79-Y82 VanDerWaalsContact CG2-CB 3.48Å; T79-Y82 HydrophobicContact CG2-CG 4.26Å; T79-Y82 WeakPolarHBondContact O-CB 3.48Å; T79-Y82 PolarHBondContact O-N 2.76Å; I80-Y82 PolarHBondContact O-N 2.84Å; Y82-S86 WeakPolarHBondContact O-CB 3.21Å; Y82-S86 PolarHBondContact O-N 2.92Å; Y82-E91 WeakPolarHBondContact CE1-OE2 3.47Å
83	L	58.3	Low	61.6	Low	8 Å²	8	64.4 Å²	64.4	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-80.9	-44.8	177.7	-69.5	174.4	0	0	0	111.2	I80 N85 S86 E91	I80-L83 PolarHBondContact O-N 2.94Å; L83-N85 VanDerWaalsContact C-N 3.32Å; L83-N85 PolarHBondContact O-N 2.61Å; L83-S86 VanDerWaalsContact O-CB 3.3Å; L83-S86 WeakPolarHBondContact O-CB 3.39Å; L83-S86 PolarHBondContact O-N 3.31Å; L83-S86 PolarHBondContact O-OG 3.02Å; L83-E91 HydrophobicContact CD2-CB 3.88Å; L83-E91 HydrophobicContact CD2-CG 3.93Å
84	T	58.6	Low	61.8	Low	67 Å²	67	61.9 Å²	61.9	41%	0.411	33%	0.326	S	S	.	.	H	α-helix	trans	-64	-38.5	177.7	55.1	0	0	0	0	112.1	I80 Q81 S86	I80-T84 HydrophobicContact CG2-CG2 3.63Å; I80-T84 PolarHBondContact O-N 3.46Å; I80-T84 PolarHBondContact O-OG1 3.01Å; Q81-T84 WeakPolarHBondContact CA-OG1 3.22Å; T84-S86 VanDerWaalsContact C-N 3.32Å
85	N	60.6	Low	62.2	Low	119 Å²	119	61.2 Å²	61.2	64%	0.636	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	16.8	179.9	-44.2	9.1	0	0	0	111.4	Q81 L83	Q81-N85 WeakPolarHBondContact O-CB 3.36Å; Q81-N85 PolarHBondContact O-N 3.5Å; Q81-N85 PolarHBondContact O-OD1 3.32Å; L83-N85 VanDerWaalsContact C-N 3.32Å; L83-N85 PolarHBondContact O-N 2.61Å
86	S	61.9	Low	62.7	Low	10 Å²	10	65.4 Å²	65.4	7%	0.07	35%	0.348	C	S	.	.			trans	-70.1	145.9	170.1	69	0	0	0	0	109.9	Y82 L83 T84 D88 E91 K92	Y82-S86 WeakPolarHBondContact O-CB 3.21Å; Y82-S86 PolarHBondContact O-N 2.92Å; L83-S86 VanDerWaalsContact O-CB 3.3Å; L83-S86 WeakPolarHBondContact O-CB 3.39Å; L83-S86 PolarHBondContact O-N 3.31Å; L83-S86 PolarHBondContact O-OG 3.02Å; T84-S86 VanDerWaalsContact C-N 3.32Å; S86-D88 VanDerWaalsContact C-N 3.34Å; S86-E91 WeakPolarHBondContact CB-OE2 3.08Å; S86-E91 VanDerWaalsContact OG-CB 3.32Å; S86-E91 WeakPolarHBondContact OG-CB 3.29Å; S86-K92 WeakPolarHBondContact O-CE 3.47Å
87	N	63.3	Low	63.7	Low	160 Å²	160	63.2 Å²	63.2	86%	0.856	34%	0.337	S	S	*	.	S	Bend	trans	-95.3	10.3	169	-72.4	-11.8	0	0	0	112
88	D	67.8	Low	64.8	Low	37 Å²	37	61 Å²	61	20%	0.198	32%	0.319	C	S	.	.			trans	-98.8	119.3	179.5	-155.7	-54.3	0	0	0	109.7	K31 S86 L90 E91 K92	K31-D88 VanDerWaalsContact CE-OD2 3.22Å; K31-D88 WeakPolarHBondContact CE-OD2 3.44Å; K31-D88 IonicContact NZ-OD1 3.64Å; K31-D88 IonicContact NZ-OD2 2.71Å; K31-D88 PolarHBondContact NZ-OD2 3.39Å; S86-D88 VanDerWaalsContact C-N 3.34Å; D88-L90 PolarHBondContact O-N 2.83Å; D88-L90 VanDerWaalsContact O-N 3.13Å; D88-L90 PolarHBondContact OD1-N 2.64Å; D88-E91 HydrophobicContact CB-CB 4.36Å; D88-E91 HydrophobicContact CB-CG 4.46Å; D88-E91 PolarHBondContact O-N 2.65Å; D88-E91 VanDerWaalsContact O-N 3.08Å; D88-K92 PolarHBondContact O-N 3.31Å
89	P	70.4	Confident	65.9	Low	89 Å²	89	62.1 Å²	62.1	58%	0.578	33%	0.326	S	S	*	.	H	α-helix	trans	-60.6	-26.7	-175.3	24.1	-34.4	0	0	0	112.8	K92 S93	P89-K92 PolarHBondContact O-N 2.8Å; P89-S93 WeakPolarHBondContact O-CB 3.32Å; P89-S93 PolarHBondContact O-N 2.89Å
90	L	67.2	Low	67.2	Low	17 Å²	17	64.1 Å²	64.1	9%	0.089	34%	0.34	C	S	.	.	H	α-helix	trans	-72.1	-38.3	177.2	-165.7	73.2	0	0	0	112.1	T32 L35 D88 K92 S93 V94 I150	T32-L90 WeakPolarHBondContact OG1-CD2 3.45Å; L35-L90 HydrophobicContact CB-CD2 4.34Å; L35-L90 HydrophobicContact CD2-CB 4.22Å; L35-L90 HydrophobicContact CD2-CD2 3.7Å; L35-L90 HydrophobicContact CD2-CG 3.7Å; D88-L90 PolarHBondContact O-N 2.83Å; D88-L90 VanDerWaalsContact O-N 3.13Å; D88-L90 PolarHBondContact OD1-N 2.64Å; L90-K92 VanDerWaalsContact C-N 3.31Å; L90-S93 PolarHBondContact O-N 2.96Å; L90-V94 WeakPolarHBondContact O-CG2 3.32Å; L90-V94 PolarHBondContact O-N 3.25Å; L90-V94 VanDerWaalsContact O-N 3.13Å; L90-I150 HydrophobicContact CD2-CD1 4.24Å
91	E	70.5	Confident	68.6	Low	8 Å²	8	63.6 Å²	63.6	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-68.8	-31	174.7	-74.5	-171.8	179.3	0	0	111.4	L35 K38 Y82 L83 S86 D88 S95	L35-E91 HydrophobicContact CD1-CG 3.7Å; L35-E91 HydrophobicContact CD2-CG 3.78Å; L35-E91 HydrophobicContact CG-CG 4.37Å; K38-E91 IonicContact NZ-OE1 2.66Å; K38-E91 PolarHBondContact NZ-OE1 3.05Å; Y82-E91 WeakPolarHBondContact CE1-OE2 3.47Å; L83-E91 HydrophobicContact CD2-CB 3.88Å; L83-E91 HydrophobicContact CD2-CG 3.93Å; S86-E91 WeakPolarHBondContact CB-OE2 3.08Å; S86-E91 VanDerWaalsContact OG-CB 3.32Å; S86-E91 WeakPolarHBondContact OG-CB 3.29Å; D88-E91 HydrophobicContact CB-CB 4.36Å; D88-E91 HydrophobicContact CB-CG 4.46Å; D88-E91 PolarHBondContact O-N 2.65Å; D88-E91 VanDerWaalsContact O-N 3.08Å; E91-S95 WeakPolarHBondContact O-CB 3.49Å; E91-S95 PolarHBondContact O-N 3.09Å
92	K	72.5	Confident	69.9	Low	95 Å²	95	57.6 Å²	57.6	41%	0.413	31%	0.31	S	S	.	.	H	α-helix	trans	-70	-47.1	170.1	-66.4	-167.3	-177.4	-174.8	0	113.3	S86 D88 P89 L90 V94 S95 Q96	S86-K92 WeakPolarHBondContact O-CE 3.47Å; D88-K92 PolarHBondContact O-N 3.31Å; P89-K92 PolarHBondContact O-N 2.8Å; L90-K92 VanDerWaalsContact C-N 3.31Å; K92-V94 PolarHBondContact O-N 2.92Å; K92-S95 CarbonylContact O-C 3.59Å; K92-S95 WeakPolarHBondContact O-CA 3.48Å; K92-S95 WeakPolarHBondContact O-CB 3.47Å; K92-S95 PolarHBondContact O-N 3.34Å; K92-Q96 WeakPolarHBondContact O-CG 3.41Å; K92-Q96 PolarHBondContact O-N 2.87Å
93	S	71.4	Confident	71.2	Confident	36 Å²	36	54.5 Å²	54.5	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-57.2	-47.6	178.9	173.7	0	0	0	0	111.8	P89 L90 S95 Q96 Q97	P89-S93 WeakPolarHBondContact O-CB 3.32Å; P89-S93 PolarHBondContact O-N 2.89Å; L90-S93 PolarHBondContact O-N 2.96Å; S93-S95 VanDerWaalsContact C-N 3.27Å; S93-S95 PolarHBondContact O-N 3.16Å; S93-Q96 PolarHBondContact O-N 3.02Å; S93-Q97 PolarHBondContact O-N 3.18Å
94	V	73	Confident	72.5	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-61.8	-36	174.4	174.7	0	0	0	0	111.7	L35 L39 L90 K92 Q96 Q97 L98 I150 L152	L35-V94 HydrophobicContact CD2-CG2 4.18Å; L39-V94 HydrophobicContact CD1-CG1 3.95Å; L39-V94 HydrophobicContact CD1-CG2 4.42Å; L39-V94 HydrophobicContact CD2-CG1 4.02Å; L90-V94 WeakPolarHBondContact O-CG2 3.32Å; L90-V94 PolarHBondContact O-N 3.25Å; L90-V94 VanDerWaalsContact O-N 3.13Å; K92-V94 PolarHBondContact O-N 2.92Å; V94-Q96 VanDerWaalsContact C-N 3.28Å; V94-Q96 PolarHBondContact O-N 2.82Å; V94-Q97 PolarHBondContact O-N 2.8Å; V94-L98 PolarHBondContact O-N 3.12Å; V94-I150 HydrophobicContact CG2-CB 3.92Å; V94-I150 HydrophobicContact CG2-CD1 4.34Å; V94-I150 HydrophobicContact CG2-CG2 4.15Å; V94-L152 HydrophobicContact CG1-CD1 4.31Å; V94-L152 HydrophobicContact CG1-CD2 4.46Å
95	S	72	Confident	73.8	Confident	37 Å²	37	56.6 Å²	56.6	26%	0.259	31%	0.309	S	S	.	.	H	α-helix	trans	-72.2	-17.1	175.8	-165.9	0	0	0	0	114.2	E91 K92 S93	E91-S95 WeakPolarHBondContact O-CB 3.49Å; E91-S95 PolarHBondContact O-N 3.09Å; K92-S95 CarbonylContact O-C 3.59Å; K92-S95 WeakPolarHBondContact O-CA 3.48Å; K92-S95 WeakPolarHBondContact O-CB 3.47Å; K92-S95 PolarHBondContact O-N 3.34Å; S93-S95 VanDerWaalsContact C-N 3.27Å; S93-S95 PolarHBondContact O-N 3.16Å
96	Q	74.3	Confident	75.1	Confident	163 Å²	163	54 Å²	54	76%	0.762	30%	0.298	S	S	*	.	H	α-helix	trans	-90.4	-26.9	173.6	-71.8	172.2	-38.9	0	0	112.3	K92 S93 V94 L98	K92-Q96 WeakPolarHBondContact O-CG 3.41Å; K92-Q96 PolarHBondContact O-N 2.87Å; S93-Q96 PolarHBondContact O-N 3.02Å; V94-Q96 VanDerWaalsContact C-N 3.28Å; V94-Q96 PolarHBondContact O-N 2.82Å; Q96-L98 VanDerWaalsContact C-N 3.32Å
97	Q	74.9	Confident	76.1	Confident	71 Å²	71	56 Å²	56	33%	0.332	31%	0.309	S	S	.	.	H	α-helix	trans	-73.2	-20.6	172.7	-70.9	178.1	45.2	0	0	113.6	S93 V94 P99 I150 L152	S93-Q97 PolarHBondContact O-N 3.18Å; V94-Q97 PolarHBondContact O-N 2.8Å; Q97-P99 VanDerWaalsContact O-CD 3.29Å; Q97-P99 WeakPolarHBondContact O-CD 3.46Å; Q97-I150 PolarHBondContact NE2-O 3.01Å; Q97-I150 PolarHBondContact OE1-O 3.36Å; Q97-L152 HydrophobicContact CB-CD1 3.78Å; Q97-L152 HydrophobicContact CB-CG 4.2Å; Q97-L152 VanDerWaalsContact OE1-N 3.12Å
98	L	75.7	Confident	76.9	Confident	35 Å²	35	49.8 Å²	49.8	18%	0.183	28%	0.283	C	S	.	.			trans	-79	114.8	179.9	-77.5	170.6	0	0	0	111.1	R47 L48 V94 Q96 Y127 L152	R47-L98 WeakPolarHBondContact O-CD2 3.46Å; L48-L98 HydrophobicContact CD2-CD2 4.42Å; V94-L98 PolarHBondContact O-N 3.12Å; Q96-L98 VanDerWaalsContact C-N 3.32Å; L98-Y127 HydrophobicContact CD2-CD2 4.35Å; L98-Y127 HydrophobicContact CD2-CG 4.37Å; L98-L152 HydrophobicContact CD2-CD1 3.56Å; L98-L152 HydrophobicContact CG-CD1 3.66Å
99	P	77.8	Confident	77.5	Confident	40 Å²	40	53.4 Å²	53.4	26%	0.26	30%	0.302	S	S	.	.			trans	-75.8	167.8	175.5	28.5	-25	0	0	0	111.3	T50 Q97 Y127	T50-P99 HydrophobicContact CG2-CG 4.11Å; T50-P99 WeakPolarHBondContact CG2-O 3.46Å; Q97-P99 VanDerWaalsContact O-CD 3.29Å; Q97-P99 WeakPolarHBondContact O-CD 3.46Å; P99-Y127 HydrophobicContact CG-CE1 4.22Å; P99-Y127 HydrophobicContact CG-CE2 3.95Å; P99-Y127 WeakPolarHBondContact CG-OH 3.43Å
100	P	77.9	Confident	77.8	Confident	87 Å²	87	54 Å²	54	57%	0.565	30%	0.301	S	S	*	.			trans	-59.6	148.4	-174.7	22.1	-33.8	0	0	0	113.3	T50 I102 Q103	T50-P100 WeakPolarHBondContact CB-O 3.43Å; T50-P100 WeakPolarHBondContact CG2-O 3.44Å; P100-I102 VanDerWaalsContact C-N 3.25Å; P100-I102 PolarHBondContact O-N 2.95Å; P100-Q103 HydrophobicContact CG-CG 4.08Å; P100-Q103 PolarHBondContact O-NE2 3.27Å
101	L	80.5	Confident	78.5	Confident	12 Å²	12	54.9 Å²	54.9	6%	0.063	31%	0.314	C	S	.	.	S	Bend	trans	-61.7	-30.6	-177.8	179.7	64.9	0	0	0	113.2	I49 C51 L71 W75	I49-L101 WeakPolarHBondContact O-CD1 3.09Å; C51-L101 WeakPolarHBondContact CA-O 2.97Å; C51-L101 VanDerWaalsContact CB-O 3.32Å; C51-L101 WeakPolarHBondContact CB-O 3.48Å; C51-L101 PolarHBondContact N-O 3.49Å; L71-L101 HydrophobicContact CB-CD2 3.89Å; W75-L101 HydrophobicContact CB-CD2 3.66Å; W75-L101 HydrophobicContact CD2-CD2 4.49Å; W75-L101 HydrophobicContact CG-CD2 3.78Å
102	I	82.4	Confident	78.9	Confident	27 Å²	27	58.4 Å²	58.4	14%	0.138	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.6	173	-62.9	177.3	0	0	0	106.5	C51 F53 L58 L64 L67 L71 P100	C51-I102 WeakPolarHBondContact O-CA 3.26Å; F53-I102 HydrophobicContact CD2-CG2 3.78Å; F53-I102 HydrophobicContact CE2-CB 4.31Å; F53-I102 HydrophobicContact CE2-CG1 4.09Å; F53-I102 HydrophobicContact CE2-CG2 3.85Å; L58-I102 HydrophobicContact CD1-CG2 4.02Å; L58-I102 HydrophobicContact CD2-CG2 4.19Å; L64-I102 HydrophobicContact CD1-CD1 4.19Å; L64-I102 HydrophobicContact CD1-CG2 4.44Å; L67-I102 HydrophobicContact CB-CD1 4.28Å; L71-I102 HydrophobicContact CD1-CD1 4.16Å; L71-I102 HydrophobicContact CD1-CG1 4.14Å; P100-I102 VanDerWaalsContact C-N 3.25Å; P100-I102 PolarHBondContact O-N 2.95Å
103	Q	84.2	Confident	79.2	Confident	25 Å²	25	60 Å²	60	12%	0.117	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.8	175.1	-79.4	165.8	49.1	0	0	110	T50 C51 E52 F53 P100	T50-Q103 PolarHBondContact OG1-NE2 3.28Å; T50-Q103 VanDerWaalsContact OG1-NE2 3.1Å; C51-Q103 PolarHBondContact O-N 3.16Å; E52-Q103 WeakPolarHBondContact CA-O 3.07Å; F53-Q103 PolarHBondContact N-O 3.32Å; P100-Q103 HydrophobicContact CG-CG 4.08Å; P100-Q103 PolarHBondContact O-NE2 3.27Å
104	P	86	Confident	79.6	Confident	76 Å²	76	58.3 Å²	58.3	49%	0.494	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	137.3	157	24.7	-30.8	0	0	0	109.5	E55 L58	E55-P104 HydrophobicContact CG-CB 3.53Å; L58-P104 HydrophobicContact CD1-CB 4.02Å
105	K	86.3	Confident	80.1	Confident	44 Å²	44	58.4 Å²	58.4	19%	0.191	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	143.4	166.1	-70.6	-173.6	169.4	-179.5	0	109.4	E52 F53 E55 S115 V116	E52-K105 HydrophobicContact CB-CD 4.33Å; E52-K105 HydrophobicContact CG-CD 4.34Å; E52-K105 IonicContact OE1-NZ 3.12Å; E52-K105 PolarHBondContact OE1-NZ 3.41Å; F53-K105 PolarHBondContact O-N 3.37Å; E55-K105 PolarHBondContact N-O 2.73Å; K105-S115 VanDerWaalsContact CD-OG 3.26Å; K105-S115 WeakPolarHBondContact CD-OG 3.4Å; K105-S115 PolarHBondContact NZ-OG 3.48Å; K105-V116 HydrophobicContact CB-CG2 4.16Å
106	T	86.2	Confident	80.9	Confident	63 Å²	63	56.6 Å²	56.6	39%	0.387	32%	0.322	S	S	.	.			trans	-70.3	146.5	166.8	50.8	0	0	0	0	110.8	E55 L109	E55-T106 WeakPolarHBondContact OE1-CG2 3.33Å; E55-T106 PolarHBondContact OE1-N 2.76Å; E55-T106 WeakPolarHBondContact OE2-CG2 3.21Å; T106-L109 VanDerWaalsContact OG1-CD1 3.28Å; T106-L109 WeakPolarHBondContact OG1-CD1 3.44Å; T106-L109 WeakPolarHBondContact OG1-CD2 3.36Å; T106-L109 VanDerWaalsContact OG1-CG 3.27Å; T106-L109 WeakPolarHBondContact OG1-CG 3.29Å
107	V	84	Confident	81.4	Confident	52 Å²	52	49.1 Å²	49.1	32%	0.315	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	135.1	-173.3	174.8	0	0	0	0	111.5	D54 L109 V116	D54-V107 HydrophobicContact CB-CG2 4.06Å; D54-V107 VanDerWaalsContact CG-CG2 3.47Å; V107-L109 VanDerWaalsContact C-N 3.29Å; V107-L109 PolarHBondContact O-N 3.18Å; V107-V116 HydrophobicContact CG2-CG1 4.21Å
108	G	80	Confident	82	Confident	30 Å²	30	47.2 Å²	47.2	31%	0.309	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	4.2	165.5	0	0	0	0	0	116.4	N110 G111 V116	G108-N110 PolarHBondContact O-N 3.4Å; G108-G111 PolarHBondContact O-N 2.68Å; G108-V116 PolarHBondContact N-O 2.7Å
109	L	80.1	Confident	82.6	Confident	113 Å²	113	49 Å²	49	59%	0.592	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.5	-41.6	178.6	-77.5	175	0	0	0	113.9	T106 V107	T106-L109 VanDerWaalsContact OG1-CD1 3.28Å; T106-L109 WeakPolarHBondContact OG1-CD1 3.44Å; T106-L109 WeakPolarHBondContact OG1-CD2 3.36Å; T106-L109 VanDerWaalsContact OG1-CG 3.27Å; T106-L109 WeakPolarHBondContact OG1-CG 3.29Å; V107-L109 VanDerWaalsContact C-N 3.29Å; V107-L109 PolarHBondContact O-N 3.18Å
110	N	77.7	Confident	83.1	Confident	103 Å²	103	49.3 Å²	49.3	55%	0.551	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	21.2	-177	-67.9	7.5	0	0	0	112.2	G108 G114	G108-N110 PolarHBondContact O-N 3.4Å; N110-G114 PolarHBondContact O-N 2.78Å
111	G	81.1	Confident	83.7	Confident	35 Å²	35	45.1 Å²	45.1	36%	0.361	27%	0.265	S	S	.	.			trans	67.6	-170.6	-174.8	0	0	0	0	0	114.4	G108 N113 G114	G108-G111 PolarHBondContact O-N 2.68Å; G111-N113 VanDerWaalsContact C-N 3.28Å; G111-N113 PolarHBondContact O-N 3.27Å; G111-G114 WeakPolarHBondContact O-CA 3.49Å; G111-G114 PolarHBondContact O-N 2.8Å
112	L	78.2	Confident	84.2	Confident	82 Å²	82	44.7 Å²	44.7	43%	0.429	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-29.5	-175.3	-57.2	174.9	0	0	0	113.4	G114 P117 L200 R202	L112-G114 PolarHBondContact O-N 3.47Å; L112-P117 WeakPolarHBondContact O-CB 3.46Å; L112-L200 HydrophobicContact CB-CD2 4.28Å; L112-L200 HydrophobicContact CD2-CD2 4.05Å; L112-R202 PolarHBondContact O-NH1 2.76Å
113	N	79.6	Confident	84.7	Confident	128 Å²	128	43.4 Å²	43.4	68%	0.684	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-6.8	173.9	-64.9	-15.8	0	0	0	112.9	G111	G111-N113 VanDerWaalsContact C-N 3.28Å; G111-N113 PolarHBondContact O-N 3.27Å
114	G	80.8	Confident	85.1	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.01	25%	0.251	C	S	.	.	S	Bend	trans	-80.9	-176.5	-172.6	0	0	0	0	0	115.5	N110 G111 L112 R202	N110-G114 PolarHBondContact O-N 2.78Å; G111-G114 WeakPolarHBondContact O-CA 3.49Å; G111-G114 PolarHBondContact O-N 2.8Å; L112-G114 PolarHBondContact O-N 3.47Å; G114-R202 PolarHBondContact O-NH1 2.88Å
115	S	82.8	Confident	85.4	Confident	2 Å²	2	39 Å²	39	1%	0.014	23%	0.229	C	C	.	.	S	Bend	trans	-69.1	136.1	162.1	53.4	0	0	0	0	110.3	E52 K105 T123	E52-S115 WeakPolarHBondContact OE1-CB 3.5Å; E52-S115 WeakPolarHBondContact OE2-CB 3.39Å; K105-S115 VanDerWaalsContact CD-OG 3.26Å; K105-S115 WeakPolarHBondContact CD-OG 3.4Å; K105-S115 PolarHBondContact NZ-OG 3.48Å; S115-T123 VanDerWaalsContact CA-OG1 3.31Å; S115-T123 WeakPolarHBondContact CA-OG1 3.46Å
116	V	87.7	Confident	85.5	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	50.6	68.9	178.5	-169.1	0	0	0	0	112.8	E52 D54 K105 V107 G108 I118 T123	E52-V116 HydrophobicContact CB-CG2 3.94Å; D54-V116 HydrophobicContact CB-CG1 3.62Å; K105-V116 HydrophobicContact CB-CG2 4.16Å; V107-V116 HydrophobicContact CG2-CG1 4.21Å; G108-V116 PolarHBondContact N-O 2.7Å; V116-I118 PolarHBondContact O-N 3.37Å; V116-T123 PolarHBondContact N-OG1 3.18Å
117	P	85.6	Confident	85.5	Confident	6 Å²	6	35.2 Å²	35.2	4%	0.039	21%	0.207	C	C	.	.			trans	-76	-20.6	-170.8	30.9	-37	0	0	0	114.9	L112 V160 L200	L112-P117 WeakPolarHBondContact O-CB 3.46Å; P117-V160 HydrophobicContact CG-CG1 4.22Å; P117-V160 HydrophobicContact CG-CG2 4.1Å; P117-L200 HydrophobicContact CB-CD2 3.63Å; P117-L200 HydrophobicContact CG-CD2 3.68Å
118	I	87.6	Confident	85.5	Confident	30 Å²	30	36.2 Å²	36.2	15%	0.154	21%	0.208	C	C	.	.	S	Bend	trans	-140.4	161.3	178.3	56.6	172.9	0	0	0	111.4	V116 S121 I162 L197 L200	V116-I118 PolarHBondContact O-N 3.37Å; I118-S121 PolarHBondContact N-OG 3.15Å; I118-S121 VanDerWaalsContact O-CB 3.3Å; I118-S121 WeakPolarHBondContact O-CB 3.06Å; I118-S121 PolarHBondContact O-N 2.82Å; I118-S121 PolarHBondContact O-OG 3.31Å; I118-I162 HydrophobicContact CD1-CD1 3.64Å; I118-I162 HydrophobicContact CD1-CG1 4.17Å; I118-L197 HydrophobicContact CD1-CD2 4.11Å; I118-L200 HydrophobicContact CD1-CD1 4.07Å; I118-L200 HydrophobicContact CG2-CD2 4.28Å
119	S	87.8	Confident	85.7	Confident	73 Å²	73	35.7 Å²	35.7	51%	0.51	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	148.4	175.6	-53.7	0	0	0	0	111.8	D54 S121	D54-S119 VanDerWaalsContact OD2-CA 3.3Å; D54-S119 WeakPolarHBondContact OD2-CA 3.49Å; S119-S121 PolarHBondContact O-N 2.72Å
120	F	88.3	Confident	85.7	Confident	46 Å²	46	32.5 Å²	32.5	20%	0.202	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	23.5	-174.2	-64.4	-95.4	0	0	0	114.9	D54 I57 M60 I162 L163 T165 Q168	D54-F120 PolarHBondContact OD2-N 3.23Å; I57-F120 HydrophobicContact CG1-CB 4.38Å; I57-F120 HydrophobicContact CG1-CD1 4.05Å; I57-F120 HydrophobicContact CG1-CG 4.42Å; M60-F120 HydrophobicContact SD-CE1 4.38Å; F120-I162 CarbonylContact O-C 3.54Å; F120-I162 WeakPolarHBondContact O-CA 3.47Å; F120-L163 WeakPolarHBondContact CB-O 3.3Å; F120-L163 PolarHBondContact O-N 2.81Å; F120-T165 HydrophobicContact CD1-CG2 4.26Å; F120-T165 HydrophobicContact CE1-CG2 3.93Å; F120-Q168 VanDerWaalsContact CE2-NE2 3.31Å
121	S	91.4	Very high	85.7	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	159.6	173.3	72.7	0	0	0	0	115.5	D54 I57 I118 S119 V161	D54-S121 PolarHBondContact N-O 3.43Å; I57-S121 VanDerWaalsContact CD1-O 3.3Å; I57-S121 WeakPolarHBondContact CD1-O 3.01Å; I118-S121 PolarHBondContact N-OG 3.15Å; I118-S121 VanDerWaalsContact O-CB 3.3Å; I118-S121 WeakPolarHBondContact O-CB 3.06Å; I118-S121 PolarHBondContact O-N 2.82Å; I118-S121 PolarHBondContact O-OG 3.31Å; S119-S121 PolarHBondContact O-N 2.72Å; S121-V161 CarbonylContact C-O 3.48Å; S121-V161 VanDerWaalsContact CA-O 3.24Å; S121-V161 WeakPolarHBondContact CA-O 3.37Å
122	F	90.9	Very high	85.3	Confident	2 Å²	2	31 Å²	31	1%	0.009	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	138.7	174	-37.6	-81.9	0	0	0	109.7	E52 F53 I57 V161 L163 L263	E52-F122 VanDerWaalsContact O-CA 3.29Å; E52-F122 WeakPolarHBondContact O-CA 3.42Å; F53-F122 AromaticContact CD1-CD1 3.22Å; F53-F122 HydrophobicContact CD1-CD1 3.22Å; F53-F122 AromaticContact CD1-CE1 3.46Å; F53-F122 HydrophobicContact CD1-CE1 3.46Å; F53-F122 VanDerWaalsContact CD1-CE1 3.46Å; F53-F122 HydrophobicContact CD1-CG 4.44Å; F53-F122 AromaticContact CE1-CD1 3.5Å; F53-F122 HydrophobicContact CE1-CD1 3.5Å; F53-F122 AromaticContact CE1-CE1 3.68Å; F53-F122 HydrophobicContact CE1-CE1 3.68Å; F53-F122 HydrophobicContact CG-CD1 4.04Å; I57-F122 HydrophobicContact CB-CE1 4.32Å; I57-F122 HydrophobicContact CD1-CD1 3.69Å; I57-F122 HydrophobicContact CD1-CE1 3.36Å; I57-F122 HydrophobicContact CD1-CG 4.46Å; I57-F122 HydrophobicContact CD1-CZ 3.87Å; I57-F122 HydrophobicContact CG1-CE1 4.39Å; I57-F122 HydrophobicContact CG2-CE1 3.66Å; I57-F122 HydrophobicContact CG2-CZ 3.99Å; F122-V161 HydrophobicContact CB-CB 4.44Å; F122-V161 HydrophobicContact CD2-CB 3.73Å; F122-V161 HydrophobicContact CD2-CG1 3.69Å; F122-V161 VanDerWaalsContact CD2-O 3.3Å; F122-V161 WeakPolarHBondContact CD2-O 3.31Å; F122-V161 HydrophobicContact CE2-CG1 4.04Å; F122-V161 PolarHBondContact N-O 2.94Å; F122-V161 PolarHBondContact O-N 3.41Å; F122-V161 VanDerWaalsContact O-N 3.08Å; F122-L163 HydrophobicContact CE2-CB 3.69Å; F122-L163 HydrophobicContact CZ-CB 3.62Å; F122-L163 HydrophobicContact CZ-CD2 4.12Å; F122-L163 HydrophobicContact CZ-CG 4.46Å; F122-L263 HydrophobicContact CD2-CD2 3.88Å; F122-L263 HydrophobicContact CE1-CD1 4.2Å; F122-L263 HydrophobicContact CE2-CD1 4.08Å; F122-L263 HydrophobicContact CE2-CD2 4.08Å; F122-L263 HydrophobicContact CG-CD2 4.3Å; F122-L263 HydrophobicContact CZ-CD1 3.89Å
123	T	93	Very high	84.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	174.1	171.7	53.3	0	0	0	0	110.9	E52 S115 V116 V160	E52-T123 PolarHBondContact N-O 3.08Å; E52-T123 PolarHBondContact O-N 3.49Å; E52-T123 WeakPolarHBondContact OE2-CB 3.49Å; E52-T123 PolarHBondContact OE2-OG1 3.27Å; S115-T123 VanDerWaalsContact CA-OG1 3.31Å; S115-T123 WeakPolarHBondContact CA-OG1 3.46Å; V116-T123 PolarHBondContact N-OG1 3.18Å; T123-V160 HydrophobicContact CG2-CG2 4.28Å
124	W	93.1	Very high	83	Confident	3 Å²	3	30.7 Å²	30.7	1%	0.011	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.8	175.2	-66.3	-94.3	0	0	0	110	I49 T50 C51 E157 E159 V161 L263 I266 T267 L270	I49-W124 HydrophobicContact CG2-CB 4.19Å; I49-W124 HydrophobicContact CG2-CG 4.26Å; T50-W124 WeakPolarHBondContact O-CA 3.43Å; C51-W124 PolarHBondContact SG-NE1 3.01Å; W124-E157 HydrophobicContact CB-CB 4.13Å; W124-E157 HydrophobicContact CB-CG 4.05Å; W124-E157 PolarHBondContact O-N 3.28Å; W124-E159 HydrophobicContact CE3-CB 4.34Å; W124-E159 HydrophobicContact CZ3-CB 4.21Å; W124-V161 HydrophobicContact CH2-CB 4.07Å; W124-V161 HydrophobicContact CH2-CG2 3.55Å; W124-V161 HydrophobicContact CZ3-CB 4.39Å; W124-V161 HydrophobicContact CZ3-CG2 3.81Å; W124-L263 HydrophobicContact CH2-CD2 4.3Å; W124-L263 HydrophobicContact CZ2-CD2 4.36Å; W124-I266 HydrophobicContact CH2-CG2 3.63Å; W124-I266 HydrophobicContact CZ2-CB 4.48Å; W124-I266 HydrophobicContact CZ2-CG2 3.85Å; W124-I266 HydrophobicContact CZ3-CG2 4.19Å; W124-T267 PolarHBondContact NE1-OG1 3.01Å; W124-L270 HydrophobicContact CB-CD1 4.33Å; W124-L270 HydrophobicContact CD2-CD1 3.33Å; W124-L270 HydrophobicContact CE3-CD1 3.44Å; W124-L270 VanDerWaalsContact CE3-CD1 3.44Å; W124-L270 HydrophobicContact CG-CD1 3.74Å; W124-L270 HydrophobicContact CH2-CD1 4.4Å; W124-L270 HydrophobicContact CZ2-CD1 4.29Å; W124-L270 HydrophobicContact CZ3-CD1 4Å
125	T	90.7	Very high	80.9	Confident	6 Å²	6	31.7 Å²	31.7	4%	0.037	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125	166.5	-73.1	0	0	0	0	108.8	I49 T50 E52 Y127 P154	I49-T125 WeakPolarHBondContact CA-O 3.3Å; T50-T125 PolarHBondContact N-O 3.41Å; T50-T125 PolarHBondContact O-N 3.18Å; E52-T125 VanDerWaalsContact CD-OG1 3.29Å; E52-T125 WeakPolarHBondContact OE1-CB 3.41Å; E52-T125 PolarHBondContact OE1-OG1 2.98Å; E52-T125 PolarHBondContact OE2-OG1 3.32Å; T125-Y127 HydrophobicContact CG2-CE1 4.25Å; T125-Y127 HydrophobicContact CG2-CE2 3.84Å; T125-P154 HydrophobicContact CG2-CB 3.61Å
126	R	89	Confident	78.7	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.1	172.3	-174.7	-169.7	-59.4	-92.9	-11.4	110.1	L48 I49 P154 F155 E157 L270 A271 Q274	L48-R126 CarbonylContact O-C 3.55Å; L48-R126 WeakPolarHBondContact O-CA 3.24Å; L48-R126 WeakPolarHBondContact O-CG 3.3Å; I49-R126 HydrophobicContact CG1-CB 4.15Å; I49-R126 HydrophobicContact CG1-CG 4.13Å; R126-P154 CarbonylContact O-C 3.6Å; R126-P154 WeakPolarHBondContact O-CA 3.37Å; R126-F155 HydrophobicContact CB-CD1 4.39Å; R126-F155 PolarHBondContact N-O 2.7Å; R126-F155 PolarHBondContact O-N 3.45Å; R126-E157 IonicContact CZ-OE1 3.63Å; R126-E157 IonicContact NE-OE1 3.58Å; R126-E157 PolarHBondContact NE-OE1 2.9Å; R126-E157 IonicContact NH2-OE1 3.05Å; R126-E157 PolarHBondContact NH2-OE1 3.15Å; R126-E157 IonicContact NH2-OE2 2.76Å; R126-L270 PolarHBondContact NH2-O 3.2Å; R126-A271 PolarHBondContact NH1-O 3.4Å; R126-Q274 VanDerWaalsContact CD-OE1 3.26Å
127	Y	86.6	Confident	76.4	Confident	26 Å²	26	50.3 Å²	50.3	10%	0.102	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	107.2	175.5	-68.2	-82.7	0	0	0	109.9	L48 T50 L98 P99 T125 P129 L152 P154	L48-Y127 PolarHBondContact O-N 3.39Å; T50-Y127 HydrophobicContact CG2-CE2 3.82Å; L98-Y127 HydrophobicContact CD2-CD2 4.35Å; L98-Y127 HydrophobicContact CD2-CG 4.37Å; P99-Y127 HydrophobicContact CG-CE1 4.22Å; P99-Y127 HydrophobicContact CG-CE2 3.95Å; P99-Y127 WeakPolarHBondContact CG-OH 3.43Å; T125-Y127 HydrophobicContact CG2-CE1 4.25Å; T125-Y127 HydrophobicContact CG2-CE2 3.84Å; Y127-P129 WeakPolarHBondContact O-CD 3.46Å; Y127-L152 HydrophobicContact CD1-CB 4.01Å; Y127-L152 HydrophobicContact CG-CB 4.46Å; Y127-P154 HydrophobicContact CD1-CB 4.44Å; Y127-P154 HydrophobicContact CE1-CB 4Å
128	Q	84.3	Confident	74	Confident	72 Å²	72	57.3 Å²	57.3	34%	0.336	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	114	176.1	-58.7	-166.7	20.5	0	0	109	T130 N153 F155	Q128-T130 PolarHBondContact O-N 3.07Å; Q128-N153 PolarHBondContact N-O 2.8Å; Q128-N153 PolarHBondContact O-N 2.95Å; Q128-F155 HydrophobicContact CG-CB 4.25Å
129	P	82.4	Confident	71.7	Confident	19 Å²	19	60.2 Å²	60.2	12%	0.123	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	127	176.4	29.9	-34.5	0	0	0	109.8	L36 L39 L48 Y127 I150 L152	L36-P129 HydrophobicContact CD1-CB 3.74Å; L36-P129 HydrophobicContact CD1-CG 3.74Å; L36-P129 WeakPolarHBondContact CD1-O 3.34Å; L39-P129 HydrophobicContact CB-CB 4.46Å; L39-P129 HydrophobicContact CB-CG 4.03Å; L39-P129 HydrophobicContact CD1-CB 4Å; L39-P129 HydrophobicContact CD1-CG 4.48Å; L48-P129 HydrophobicContact CD1-CG 4.36Å; Y127-P129 WeakPolarHBondContact O-CD 3.46Å; P129-I150 HydrophobicContact CB-CG2 3.79Å; P129-L152 HydrophobicContact CB-CD2 3.91Å
130	T	81	Confident	69.2	Low	47 Å²	47	61.9 Å²	61.9	29%	0.288	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153.4	174	56.8	0	0	0	0	109.3	Q128 I150 K151 N153	Q128-T130 PolarHBondContact O-N 3.07Å; T130-I150 CarbonylContact O-C 3.55Å; T130-I150 WeakPolarHBondContact O-CA 3.33Å; T130-K151 PolarHBondContact N-O 3.03Å; T130-K151 PolarHBondContact O-N 2.89Å; T130-K151 PolarHBondContact OG1-O 2.64Å; T130-N153 WeakPolarHBondContact CG2-ND2 3.35Å; T130-N153 PolarHBondContact OG1-ND2 2.89Å
131	I	77.5	Confident	66.8	Low	52 Å²	52	69 Å²	69	27%	0.267	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	122	170.7	-59.7	177.3	0	0	0	106.8	T32 L36 V133 L148	T32-I131 HydrophobicContact CG2-CD1 4.08Å; T32-I131 HydrophobicContact CG2-CG1 4.04Å; L36-I131 HydrophobicContact CD2-CD1 4.08Å; L36-I131 HydrophobicContact CD2-CG1 4.18Å; I131-V133 HydrophobicContact CB-CG2 4.45Å; I131-V133 HydrophobicContact CG2-CG2 3.94Å; I131-V133 PolarHBondContact O-N 2.91Å; I131-V133 VanDerWaalsContact O-N 3.15Å; I131-L148 HydrophobicContact CG2-CB 4.09Å; I131-L148 HydrophobicContact CG2-CD1 4.46Å; I131-L148 HydrophobicContact CG2-CD2 3.99Å; I131-L148 HydrophobicContact CG2-CG 4.42Å
132	D	73.9	Confident	64.1	Low	53 Å²	53	73.5 Å²	73.5	28%	0.283	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	98.4	174.1	-156.5	-46.6	0	0	0	108.3	S134 N149 K151	D132-S134 VanDerWaalsContact C-N 3.29Å; D132-S134 PolarHBondContact O-N 3.01Å; D132-S134 PolarHBondContact OD1-OG 2.84Å; D132-N149 PolarHBondContact N-O 3.4Å; D132-K151 HydrophobicContact CB-CB 4.27Å; D132-K151 WeakPolarHBondContact OD2-CD 3.23Å; D132-K151 IonicContact OD2-NZ 3.45Å; D132-K151 PolarHBondContact OD2-NZ 2.71Å
133	V	61	Low	61.7	Low	101 Å²	101	78.4 Å²	78.4	61%	0.612	44%	0.437	S	S	*	.			trans	-91.7	69.3	176.6	-171.7	0	0	0	0	107.9	I131 A135	I131-V133 HydrophobicContact CB-CG2 4.45Å; I131-V133 HydrophobicContact CG2-CG2 3.94Å; I131-V133 PolarHBondContact O-N 2.91Å; I131-V133 VanDerWaalsContact O-N 3.15Å; V133-A135 PolarHBondContact O-N 2.77Å
134	S	48.3	Very low	59.3	Low	104 Å²	104	86.4 Å²	86.4	73%	0.727	48%	0.479	S	S	*	.			trans	-73.9	39.8	-178.7	-12.3	0	0	0	0	112.7	D132	D132-S134 VanDerWaalsContact C-N 3.29Å; D132-S134 PolarHBondContact O-N 3.01Å; D132-S134 PolarHBondContact OD1-OG 2.84Å
135	A	35.9	Very low	57	Low	21 Å²	21	93.1 Å²	93.1	17%	0.174	52%	0.516	C	S	.	.			trans	-147.6	85	-169.2	0	0	0	0	0	112.4	V133 E146	V133-A135 PolarHBondContact O-N 2.77Å; A135-E146 VanDerWaalsContact CB-OE2 3.32Å; A135-E146 WeakPolarHBondContact CB-OE2 3.3Å
136	K	37.3	Very low	54.9	Low	202 Å²	202	97.7 Å²	97.7	88%	0.878	54%	0.537	S	S	*	.			trans	159.8	112.9	140.1	-87.8	150.8	-166.5	162.6	0	111.7
137	E	39.4	Very low	53.3	Low	191 Å²	191	103.1 Å²	103.1	89%	0.893	56%	0.563	S	S	*	*	S	Bend	trans	-160.1	-25.6	138.9	-124.1	168.8	-148.7	0	0	112.3
138	N	35.6	Very low	52.1	Low	154 Å²	154	104 Å²	104	82%	0.824	57%	0.57	S	S	*	*	S	Bend	trans	-133.8	149	177.6	-74	-77.6	0	0	0	113.5
139	A	37.8	Very low	51.4	Low	90 Å²	90	104.4 Å²	104.4	74%	0.744	57%	0.574	S	S	*	*	S	Bend	trans	62.5	102.1	164	0	0	0	0	0	120.6
140	S	35.1	Very low	51	Low	109 Å²	109	103.6 Å²	103.6	76%	0.762	57%	0.569	S	S	*	*	S	Bend	trans	49.5	108.3	137.1	61.4	0	0	0	0	121.6
141	K	38.2	Very low	51.1	Low	196 Å²	196	106.1 Å²	106.1	85%	0.852	58%	0.576	S	S	*	*			trans	63.9	125.9	163.8	-62.3	-177.6	178.5	179.8	0	116.1	T143	K141-T143 PolarHBondContact O-N 3.47Å
142	P	35.8	Very low	51.3	Low	93 Å²	93	104.3 Å²	104.3	60%	0.604	57%	0.567	S	S	*	*			trans	-67.2	127.9	162.3	30.6	-31.9	0	0	0	108.7
143	T	39.4	Very low	51.8	Low	106 Å²	106	104.6 Å²	104.6	65%	0.65	57%	0.568	S	S	*	*			trans	-80.2	126.4	156.5	46	0	0	0	0	107.4	K141 D145 E146	K141-T143 PolarHBondContact O-N 3.47Å; T143-D145 PolarHBondContact O-N 3.08Å; T143-E146 PolarHBondContact O-N 3.27Å
144	D	43.8	Very low	53.1	Low	167 Å²	167	104 Å²	104	89%	0.893	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-2.1	-170.6	-65.6	-66.4	0	0	0	115.5
145	D	43.6	Very low	55	Low	145 Å²	145	103.6 Å²	103.6	78%	0.775	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	31.9	172.9	-80.4	-46.8	0	0	0	113.7	T143 M147	T143-D145 PolarHBondContact O-N 3.08Å; D145-M147 PolarHBondContact O-N 3.18Å
146	E	47	Very low	57.5	Low	101 Å²	101	105.3 Å²	105.3	47%	0.472	56%	0.558	S	S	.	*			trans	-63.3	81.9	165.4	-82.7	-176.7	-164.4	0	0	110.9	A135 T143 L148	A135-E146 VanDerWaalsContact CB-OE2 3.32Å; A135-E146 WeakPolarHBondContact CB-OE2 3.3Å; T143-E146 PolarHBondContact O-N 3.27Å; E146-L148 PolarHBondContact O-N 2.98Å
147	M	54.9	Low	60.1	Low	116 Å²	116	95.9 Å²	95.9	57%	0.571	52%	0.517	S	S	*	.			trans	-68.1	92.1	179	-72.1	-168.5	68	0	0	111.3	D145 N149	D145-M147 PolarHBondContact O-N 3.18Å; M147-N149 PolarHBondContact O-N 3.4Å; M147-N149 PolarHBondContact O-ND2 2.89Å
148	L	62.6	Low	62.5	Low	46 Å²	46	89.4 Å²	89.4	24%	0.241	49%	0.491	C	S	.	.			trans	-53.8	97.5	172.7	-66.6	-179.3	0	0	0	111.7	V29 T32 I131 E146	V29-L148 HydrophobicContact CB-CD1 4.35Å; V29-L148 HydrophobicContact CG1-CD1 4.06Å; V29-L148 HydrophobicContact CG2-CD1 3.97Å; T32-L148 HydrophobicContact CG2-CB 4.23Å; T32-L148 PolarHBondContact OG1-O 3.18Å; I131-L148 HydrophobicContact CG2-CB 4.09Å; I131-L148 HydrophobicContact CG2-CD1 4.46Å; I131-L148 HydrophobicContact CG2-CD2 3.99Å; I131-L148 HydrophobicContact CG2-CG 4.42Å; E146-L148 PolarHBondContact O-N 2.98Å
149	N	69.5	Low	65.2	Low	79 Å²	79	83.2 Å²	83.2	42%	0.422	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	146.2	179.3	-75.9	-52.4	0	0	0	110.8	D132 M147	D132-N149 PolarHBondContact N-O 3.4Å; M147-N149 PolarHBondContact O-N 3.4Å; M147-N149 PolarHBondContact O-ND2 2.89Å
150	I	73.8	Confident	67.8	Low	2 Å²	2	79 Å²	79	1%	0.01	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	124.8	169.2	-58.7	-177	0	0	0	107.8	T32 L35 L39 L90 V94 Q97 P129 T130 L152	T32-I150 HydrophobicContact CG2-CD1 4.23Å; T32-I150 HydrophobicContact CG2-CG1 3.8Å; L35-I150 HydrophobicContact CB-CD1 3.96Å; L35-I150 HydrophobicContact CD2-CD1 3.87Å; L35-I150 HydrophobicContact CG-CD1 3.82Å; L39-I150 HydrophobicContact CD1-CD1 4.16Å; L39-I150 HydrophobicContact CD1-CG2 4.33Å; L90-I150 HydrophobicContact CD2-CD1 4.24Å; V94-I150 HydrophobicContact CG2-CB 3.92Å; V94-I150 HydrophobicContact CG2-CD1 4.34Å; V94-I150 HydrophobicContact CG2-CG2 4.15Å; Q97-I150 PolarHBondContact NE2-O 3.01Å; Q97-I150 PolarHBondContact OE1-O 3.36Å; P129-I150 HydrophobicContact CB-CG2 3.79Å; T130-I150 CarbonylContact O-C 3.55Å; T130-I150 WeakPolarHBondContact O-CA 3.33Å; I150-L152 HydrophobicContact CG2-CD2 4.5Å
151	K	82.3	Confident	70.6	Confident	100 Å²	100	73.8 Å²	73.8	44%	0.435	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.6	175.8	179.4	172.5	178.3	175.7	0	110	T130 D132 N153	T130-K151 PolarHBondContact N-O 3.03Å; T130-K151 PolarHBondContact O-N 2.89Å; T130-K151 PolarHBondContact OG1-O 2.64Å; D132-K151 HydrophobicContact CB-CB 4.27Å; D132-K151 WeakPolarHBondContact OD2-CD 3.23Å; D132-K151 IonicContact OD2-NZ 3.45Å; D132-K151 PolarHBondContact OD2-NZ 2.71Å; K151-N153 PolarHBondContact O-N 3.27Å
152	L	81.8	Confident	73.2	Confident	14 Å²	14	64.6 Å²	64.6	7%	0.073	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	96.4	177.9	-67.2	-170.7	0	0	0	111.1	L48 V94 Q97 L98 Y127 P129 I150	L48-L152 HydrophobicContact CD2-CD2 4.3Å; V94-L152 HydrophobicContact CG1-CD1 4.31Å; V94-L152 HydrophobicContact CG1-CD2 4.46Å; Q97-L152 HydrophobicContact CB-CD1 3.78Å; Q97-L152 HydrophobicContact CB-CG 4.2Å; Q97-L152 VanDerWaalsContact OE1-N 3.12Å; L98-L152 HydrophobicContact CD2-CD1 3.56Å; L98-L152 HydrophobicContact CG-CD1 3.66Å; Y127-L152 HydrophobicContact CD1-CB 4.01Å; Y127-L152 HydrophobicContact CG-CB 4.46Å; P129-L152 HydrophobicContact CB-CD2 3.91Å; I150-L152 HydrophobicContact CG2-CD2 4.5Å
153	N	85.2	Confident	76	Confident	59 Å²	59	60.2 Å²	60.2	32%	0.316	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.1	177.9	-67.8	-28.6	0	0	0	110.6	Q128 T130 K151	Q128-N153 PolarHBondContact N-O 2.8Å; Q128-N153 PolarHBondContact O-N 2.95Å; T130-N153 WeakPolarHBondContact CG2-ND2 3.35Å; T130-N153 PolarHBondContact OG1-ND2 2.89Å; K151-N153 PolarHBondContact O-N 3.27Å
154	P	88.2	Confident	78.4	Confident	90 Å²	90	55.5 Å²	55.5	58%	0.584	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	136.3	178.5	29.9	-33.9	0	0	0	111.8	T125 R126 Y127	T125-P154 HydrophobicContact CG2-CB 3.61Å; R126-P154 CarbonylContact O-C 3.6Å; R126-P154 WeakPolarHBondContact O-CA 3.37Å; Y127-P154 HydrophobicContact CD1-CB 4.44Å; Y127-P154 HydrophobicContact CE1-CB 4Å
155	F	88.5	Confident	80.6	Confident	95 Å²	95	48.8 Å²	48.8	42%	0.417	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	115.1	175.2	173.7	-91.6	0	0	0	108.2	R126 Q128 E157	R126-F155 HydrophobicContact CB-CD1 4.39Å; R126-F155 PolarHBondContact N-O 2.7Å; R126-F155 PolarHBondContact O-N 3.45Å; Q128-F155 HydrophobicContact CG-CB 4.25Å; F155-E157 PolarHBondContact O-N 2.98Å
156	I	88.7	Confident	82.6	Confident	57 Å²	57	43 Å²	43	29%	0.292	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	124.6	179.5	-57.3	175.3	0	0	0	108.4
157	E	91	Very high	84.3	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.019	23%	0.227	C	C	.	.			trans	-68.4	140.6	173.6	-71.4	-72.8	152	0	0	110.2	W124 R126 F155 E159 R202 L270 R273	W124-E157 HydrophobicContact CB-CB 4.13Å; W124-E157 HydrophobicContact CB-CG 4.05Å; W124-E157 PolarHBondContact O-N 3.28Å; R126-E157 IonicContact CZ-OE1 3.63Å; R126-E157 IonicContact NE-OE1 3.58Å; R126-E157 PolarHBondContact NE-OE1 2.9Å; R126-E157 IonicContact NH2-OE1 3.05Å; R126-E157 PolarHBondContact NH2-OE1 3.15Å; R126-E157 IonicContact NH2-OE2 2.76Å; F155-E157 PolarHBondContact O-N 2.98Å; E157-E159 PolarHBondContact O-N 3.23Å; E157-R202 PolarHBondContact O-NH2 3.47Å; E157-L270 HydrophobicContact CB-CD2 4.47Å; E157-L270 HydrophobicContact CG-CD2 4.3Å; E157-L270 WeakPolarHBondContact OE2-CD2 3.42Å; E157-R273 IonicContact OE2-CZ 2.7Å; E157-R273 IonicContact OE2-NH1 2.68Å; E157-R273 PolarHBondContact OE2-NH1 3.35Å
158	P	89.9	Confident	85.8	Confident	54 Å²	54	39.9 Å²	39.9	35%	0.351	21%	0.212	S	C	.	.	S	Bend	trans	-67.1	-24	-176.6	26.6	-35.2	0	0	0	113.2	R202 P203	P158-R202 WeakPolarHBondContact O-CB 3.43Å; P158-R202 PolarHBondContact O-NE 2.83Å; P158-P203 HydrophobicContact CB-CG 4.2Å; P158-P203 WeakPolarHBondContact O-CD 3.49Å
159	E	91.8	Very high	86.9	Confident	25 Å²	25	37.7 Å²	37.7	12%	0.117	20%	0.201	C	C	.	.			trans	-60.4	135.2	179.5	-55.2	-54.6	133.5	0	0	112.7	W124 E157 P203 L270 R273	W124-E159 HydrophobicContact CE3-CB 4.34Å; W124-E159 HydrophobicContact CZ3-CB 4.21Å; E157-E159 PolarHBondContact O-N 3.23Å; E159-P203 WeakPolarHBondContact OE1-CG 3.39Å; E159-L270 HydrophobicContact CG-CD1 4.4Å; E159-L270 HydrophobicContact CG-CD2 3.63Å; E159-R273 IonicContact OE1-CZ 2.66Å; E159-R273 IonicContact OE1-NH1 3.19Å; E159-R273 PolarHBondContact OE1-NH1 2.89Å; E159-R273 IonicContact OE1-NH2 2.8Å; E159-R273 PolarHBondContact OE1-NH2 3.17Å
160	V	92.8	Very high	87.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.1	164	-174.4	0	0	0	0	107.8	P117 T123 I162 R202 P203 V204 T205	P117-V160 HydrophobicContact CG-CG1 4.22Å; P117-V160 HydrophobicContact CG-CG2 4.1Å; T123-V160 HydrophobicContact CG2-CG2 4.28Å; V160-I162 HydrophobicContact CG1-CG1 4.31Å; V160-R202 HydrophobicContact CG2-CB 4.16Å; V160-P203 PolarHBondContact N-O 2.96Å; V160-V204 CarbonylContact O-C 3.6Å; V160-V204 VanDerWaalsContact O-CA 3.31Å; V160-V204 WeakPolarHBondContact O-CA 3.37Å; V160-T205 PolarHBondContact O-N 2.84Å
161	V	93.9	Very high	88.1	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	143.7	168.5	179.3	0	0	0	0	108.5	S121 F122 W124 T205 I207 L263 I266	S121-V161 CarbonylContact C-O 3.48Å; S121-V161 VanDerWaalsContact CA-O 3.24Å; S121-V161 WeakPolarHBondContact CA-O 3.37Å; F122-V161 HydrophobicContact CB-CB 4.44Å; F122-V161 HydrophobicContact CD2-CB 3.73Å; F122-V161 HydrophobicContact CD2-CG1 3.69Å; F122-V161 VanDerWaalsContact CD2-O 3.3Å; F122-V161 WeakPolarHBondContact CD2-O 3.31Å; F122-V161 HydrophobicContact CE2-CG1 4.04Å; F122-V161 PolarHBondContact N-O 2.94Å; F122-V161 PolarHBondContact O-N 3.41Å; F122-V161 VanDerWaalsContact O-N 3.08Å; W124-V161 HydrophobicContact CH2-CB 4.07Å; W124-V161 HydrophobicContact CH2-CG2 3.55Å; W124-V161 HydrophobicContact CZ3-CB 4.39Å; W124-V161 HydrophobicContact CZ3-CG2 3.81Å; V161-T205 CarbonylContact C-O 3.54Å; V161-T205 VanDerWaalsContact CA-O 3.3Å; V161-T205 WeakPolarHBondContact CA-O 3.32Å; V161-T205 HydrophobicContact CG1-CG2 4.45Å; V161-T205 HydrophobicContact CG2-CG2 4.36Å; V161-I207 HydrophobicContact CG1-CD1 3.56Å; V161-I207 HydrophobicContact CG1-CG1 3.86Å; V161-L263 HydrophobicContact CB-CD2 4.26Å; V161-L263 HydrophobicContact CG1-CD2 3.84Å; V161-I266 HydrophobicContact CG2-CD1 3.95Å; V161-I266 HydrophobicContact CG2-CG2 4.44Å
162	I	93.6	Very high	88.2	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.8	-179.7	-54.4	170.2	0	0	0	109.2	I118 F120 V160 L164 L197 V204 T205 I207	I118-I162 HydrophobicContact CD1-CD1 3.64Å; I118-I162 HydrophobicContact CD1-CG1 4.17Å; F120-I162 CarbonylContact O-C 3.54Å; F120-I162 WeakPolarHBondContact O-CA 3.47Å; V160-I162 HydrophobicContact CG1-CG1 4.31Å; I162-L164 HydrophobicContact CG2-CD2 4.21Å; I162-L164 HydrophobicContact CG2-CG 4.36Å; I162-L197 HydrophobicContact CD1-CD2 3.34Å; I162-V204 HydrophobicContact CD1-CG1 3.43Å; I162-V204 VanDerWaalsContact CD1-CG1 3.43Å; I162-V204 HydrophobicContact CG1-CG1 4.07Å; I162-T205 PolarHBondContact N-O 3.07Å; I162-I207 PolarHBondContact O-N 2.79Å
163	L	93.4	Very high	88.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	102.8	174.4	-177.4	64.1	0	0	0	111.2	I57 M60 L63 F120 F122 I207 L209 V259	I57-L163 HydrophobicContact CG2-CD2 4.03Å; M60-L163 HydrophobicContact CE-CD2 4.28Å; M60-L163 HydrophobicContact SD-CD2 3.78Å; L63-L163 HydrophobicContact CD2-CD2 3.75Å; F120-L163 WeakPolarHBondContact CB-O 3.3Å; F120-L163 PolarHBondContact O-N 2.81Å; F122-L163 HydrophobicContact CE2-CB 3.69Å; F122-L163 HydrophobicContact CZ-CB 3.62Å; F122-L163 HydrophobicContact CZ-CD2 4.12Å; F122-L163 HydrophobicContact CZ-CG 4.46Å; L163-I207 HydrophobicContact CD1-CB 4.14Å; L163-I207 HydrophobicContact CD1-CG2 3.87Å; L163-L209 HydrophobicContact CD1-CB 3.88Å; L163-V259 HydrophobicContact CD1-CG1 4.02Å; L163-V259 HydrophobicContact CD1-CG2 4.17Å
164	L	91.1	Very high	87.9	Confident	7 Å²	7	39 Å²	39	4%	0.037	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.5	174.4	-63.5	173.3	0	0	0	109.8	I162 Q168 I169 L172 F193 I207 F208 L209	I162-L164 HydrophobicContact CG2-CD2 4.21Å; I162-L164 HydrophobicContact CG2-CG 4.36Å; L164-Q168 HydrophobicContact CD2-CB 4.42Å; L164-I169 HydrophobicContact CB-CD1 4.41Å; L164-I169 HydrophobicContact CB-CG1 3.87Å; L164-I169 WeakPolarHBondContact O-CD1 3.27Å; L164-L172 HydrophobicContact CD1-CD1 3.94Å; L164-L172 HydrophobicContact CD2-CD1 4.4Å; L164-F193 HydrophobicContact CD1-CE1 4.1Å; L164-F193 HydrophobicContact CD1-CZ 3.91Å; L164-F193 HydrophobicContact CD2-CE2 4.06Å; L164-F193 HydrophobicContact CD2-CZ 3.86Å; L164-F193 HydrophobicContact CG-CZ 4.36Å; L164-I207 PolarHBondContact N-O 3.32Å; L164-F208 HydrophobicContact CD1-CD1 4.06Å; L164-F208 HydrophobicContact CD1-CE1 3.58Å; L164-F208 HydrophobicContact CD1-CZ 3.88Å; L164-L209 PolarHBondContact O-N 3.3Å
165	T	88.5	Confident	87	Confident	26 Å²	26	37.6 Å²	37.6	16%	0.16	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	157.2	175.1	62.5	0	0	0	0	111.6	M60 F120 D167 Q168 I169	M60-T165 HydrophobicContact CE-CG2 3.92Å; M60-T165 HydrophobicContact SD-CG2 4.3Å; F120-T165 HydrophobicContact CD1-CG2 4.26Å; F120-T165 HydrophobicContact CE1-CG2 3.93Å; T165-D167 PolarHBondContact O-N 3.16Å; T165-Q168 PolarHBondContact O-N 2.83Å; T165-Q168 VanDerWaalsContact OG1-CD 3.24Å; T165-Q168 WeakPolarHBondContact OG1-CG 3.28Å; T165-Q168 PolarHBondContact OG1-OE1 3.42Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.3Å; T165-I169 PolarHBondContact O-N 3.29Å
166	A	85.4	Confident	85.5	Confident	23 Å²	23	35.5 Å²	35.5	19%	0.19	19%	0.189	C	C	.	.	H	α-helix	trans	-53.4	-28.2	-176.2	0	0	0	0	0	114.6	K170 L209	A166-K170 WeakPolarHBondContact O-CE 3.43Å; A166-K170 VanDerWaalsContact O-CG 3.28Å; A166-K170 WeakPolarHBondContact O-CG 3.45Å; A166-K170 PolarHBondContact O-N 3.26Å; A166-L209 PolarHBondContact N-O 3.01Å; A166-L209 VanDerWaalsContact N-O 3.1Å
167	D	83.9	Confident	83.7	Confident	97 Å²	97	36.2 Å²	36.2	52%	0.519	20%	0.199	S	C	.	.	H	α-helix	trans	-82.9	-40.2	177.6	-63.4	-64	0	0	0	113	T165 I169 K170 N171	T165-D167 PolarHBondContact O-N 3.16Å; D167-I169 VanDerWaalsContact C-N 3.26Å; D167-I169 PolarHBondContact O-N 3.25Å; D167-K170 PolarHBondContact O-N 3.42Å; D167-K170 IonicContact OD1-NZ 3.54Å; D167-K170 PolarHBondContact OD1-NZ 2.68Å; D167-N171 PolarHBondContact O-N 3.48Å
168	Q	86.2	Confident	81.5	Confident	55 Å²	55	42.4 Å²	42.4	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-58.8	-40.6	168.6	-71.1	159.6	-31.6	0	0	111	F120 L164 T165 N171 L172	F120-Q168 VanDerWaalsContact CE2-NE2 3.31Å; L164-Q168 HydrophobicContact CD2-CB 4.42Å; T165-Q168 PolarHBondContact O-N 2.83Å; T165-Q168 VanDerWaalsContact OG1-CD 3.24Å; T165-Q168 WeakPolarHBondContact OG1-CG 3.28Å; T165-Q168 PolarHBondContact OG1-OE1 3.42Å; Q168-N171 PolarHBondContact O-N 3.13Å; Q168-L172 WeakPolarHBondContact O-CG 3.2Å; Q168-L172 PolarHBondContact O-N 3.11Å; Q168-L172 VanDerWaalsContact O-N 3.16Å
169	I	86.3	Confident	79.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-47	176.3	-61.2	168.8	0	0	0	110.7	L164 T165 D167 N171 L172 L173 F208 T210 F214 I234	L164-I169 HydrophobicContact CB-CD1 4.41Å; L164-I169 HydrophobicContact CB-CG1 3.87Å; L164-I169 WeakPolarHBondContact O-CD1 3.27Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.3Å; T165-I169 PolarHBondContact O-N 3.29Å; D167-I169 VanDerWaalsContact C-N 3.26Å; D167-I169 PolarHBondContact O-N 3.25Å; I169-N171 VanDerWaalsContact C-N 3.28Å; I169-N171 PolarHBondContact O-N 3.03Å; I169-L172 PolarHBondContact O-N 3.18Å; I169-L173 HydrophobicContact CG2-CD1 4.39Å; I169-L173 HydrophobicContact CG2-CG 4.26Å; I169-L173 WeakPolarHBondContact O-CG 3.2Å; I169-L173 PolarHBondContact O-N 3.17Å; I169-F208 HydrophobicContact CD1-CB 3.75Å; I169-F208 HydrophobicContact CD1-CD1 3.93Å; I169-F208 HydrophobicContact CD1-CG 4.33Å; I169-F208 HydrophobicContact CG1-CD1 3.88Å; I169-F208 HydrophobicContact CG2-CD1 4.45Å; I169-T210 HydrophobicContact CD1-CG2 4.39Å; I169-F214 HydrophobicContact CB-CE2 4.31Å; I169-F214 HydrophobicContact CB-CZ 4.48Å; I169-F214 HydrophobicContact CG2-CE2 3.86Å; I169-F214 HydrophobicContact CG2-CZ 3.56Å; I169-I234 HydrophobicContact CG2-CD1 4.38Å
170	K	83.8	Confident	76.8	Confident	97 Å²	97	48.5 Å²	48.5	42%	0.422	29%	0.285	S	S	.	.	H	α-helix	trans	-54.4	-45.1	177.1	-70.1	161.7	-156.2	166.2	0	111.6	A166 D167 L172 L173 F214	A166-K170 WeakPolarHBondContact O-CE 3.43Å; A166-K170 VanDerWaalsContact O-CG 3.28Å; A166-K170 WeakPolarHBondContact O-CG 3.45Å; A166-K170 PolarHBondContact O-N 3.26Å; D167-K170 PolarHBondContact O-N 3.42Å; D167-K170 IonicContact OD1-NZ 3.54Å; D167-K170 PolarHBondContact OD1-NZ 2.68Å; K170-L172 VanDerWaalsContact C-N 3.27Å; K170-L172 PolarHBondContact O-N 2.93Å; K170-L173 PolarHBondContact O-N 3.06Å; K170-F214 HydrophobicContact CG-CE2 4.37Å
171	N	83.7	Confident	74.3	Confident	92 Å²	92	58.4 Å²	58.4	49%	0.492	33%	0.328	S	S	.	.	H	α-helix	trans	-65	-29.6	-179.8	-65.8	-7.7	0	0	0	113	D167 Q168 I169 N189	D167-N171 PolarHBondContact O-N 3.48Å; Q168-N171 PolarHBondContact O-N 3.13Å; I169-N171 VanDerWaalsContact C-N 3.28Å; I169-N171 PolarHBondContact O-N 3.03Å; N171-N189 PolarHBondContact O-ND2 2.79Å
172	L	83.8	Confident	71.6	Confident	12 Å²	12	67 Å²	67	6%	0.063	37%	0.368	C	S	.	.	H	α-helix	trans	-79.6	-16	172.4	-66.4	172	0	0	0	113.5	L164 Q168 I169 K170 N187 N189 L190 F193 L237	L164-L172 HydrophobicContact CD1-CD1 3.94Å; L164-L172 HydrophobicContact CD2-CD1 4.4Å; Q168-L172 WeakPolarHBondContact O-CG 3.2Å; Q168-L172 PolarHBondContact O-N 3.11Å; Q168-L172 VanDerWaalsContact O-N 3.16Å; I169-L172 PolarHBondContact O-N 3.18Å; K170-L172 VanDerWaalsContact C-N 3.27Å; K170-L172 PolarHBondContact O-N 2.93Å; L172-N187 PolarHBondContact O-ND2 3.16Å; L172-N189 HydrophobicContact CD2-CB 4.5Å; L172-L190 HydrophobicContact CD2-CB 4.47Å; L172-L190 HydrophobicContact CD2-CD1 4.29Å; L172-F193 HydrophobicContact CD1-CD1 3.99Å; L172-F193 HydrophobicContact CD1-CE1 4.11Å; L172-F193 HydrophobicContact CD1-CG 4.44Å; L172-F193 HydrophobicContact CD2-CB 3.79Å; L172-F193 HydrophobicContact CD2-CD1 3.99Å; L172-F193 HydrophobicContact CD2-CG 4Å; L172-L237 HydrophobicContact CB-CD1 4.43Å; L172-L237 HydrophobicContact CB-CD2 3.99Å
173	L	83.7	Confident	69	Low	17 Å²	17	76.7 Å²	76.7	9%	0.089	41%	0.41	C	S	.	.	H	α-helix	trans	-88.1	-15.8	179.4	-62.8	-172.5	0	0	0	115.1	I169 K170 K175 F214 Y231 I232 L237	I169-L173 HydrophobicContact CG2-CD1 4.39Å; I169-L173 HydrophobicContact CG2-CG 4.26Å; I169-L173 WeakPolarHBondContact O-CG 3.2Å; I169-L173 PolarHBondContact O-N 3.17Å; K170-L173 PolarHBondContact O-N 3.06Å; L173-K175 PolarHBondContact O-N 3Å; L173-F214 HydrophobicContact CD1-CE1 4.5Å; L173-F214 HydrophobicContact CD1-CZ 3.76Å; L173-Y231 HydrophobicContact CB-CD1 4.22Å; L173-Y231 WeakPolarHBondContact O-CA 3.39Å; L173-I232 HydrophobicContact CB-CG2 4Å; L173-I232 HydrophobicContact CD2-CG2 3.29Å; L173-I232 HydrophobicContact CG-CG2 4.2Å; L173-I232 PolarHBondContact O-N 3.04Å; L173-L237 HydrophobicContact CD2-CB 3.99Å; L173-L237 HydrophobicContact CD2-CD2 3.6Å; L173-L237 HydrophobicContact CD2-CG 4.39Å
174	I	78.2	Confident	66.5	Low	65 Å²	65	83.1 Å²	83.1	33%	0.333	44%	0.444	S	S	.	.			trans	-76.5	107.9	-176.5	-61.2	162.2	0	0	0	110	N187 Y231	I174-N187 PolarHBondContact O-ND2 2.96Å; I174-N187 VanDerWaalsContact O-ND2 3.14Å; I174-N187 PolarHBondContact O-OD1 2.78Å; I174-Y231 HydrophobicContact CG1-CD1 4.47Å; I174-Y231 HydrophobicContact CG1-CE1 3.81Å
175	K	68.3	Low	64.4	Low	60 Å²	60	89.7 Å²	89.7	26%	0.261	47%	0.474	S	S	.	.			trans	-72.2	131	168.4	-66	-171.6	-167.1	-177.5	0	110.1	L173 S177 S230 I232 E236	L173-K175 PolarHBondContact O-N 3Å; K175-S177 PolarHBondContact O-N 2.82Å; K175-S230 WeakPolarHBondContact CB-O 3.34Å; K175-S230 WeakPolarHBondContact CD-O 3.37Å; K175-S230 WeakPolarHBondContact CG-O 3.46Å; K175-I232 VanDerWaalsContact CE-CB 3.43Å; K175-I232 VanDerWaalsContact CE-CG1 3.45Å; K175-I232 HydrophobicContact CG-CB 4.41Å; K175-E236 IonicContact NZ-OE1 2.77Å; K175-E236 PolarHBondContact NZ-OE1 3.21Å
176	S	57.8	Low	62.8	Low	51 Å²	51	92.9 Å²	92.9	36%	0.357	49%	0.487	S	S	.	.			trans	-66.7	120.8	-178.4	-174.4	0	0	0	0	111.3
177	S	49.8	Very low	62.1	Low	71 Å²	71	92.3 Å²	92.3	50%	0.497	48%	0.481	S	S	.	.			trans	-106.1	46.1	-170.3	69.2	0	0	0	0	113.7	K175	K175-S177 PolarHBondContact O-N 2.82Å
178	N	46.1	Very low	61.8	Low	134 Å²	134	92 Å²	92	72%	0.717	48%	0.483	S	S	*	.			trans	-92.9	123.6	169.7	-78.6	-11.5	0	0	0	110.2
179	G	40.6	Very low	61.7	Low	72 Å²	72	93.3 Å²	93.3	74%	0.742	49%	0.491	S	S	*	.			trans	-97.6	104.8	-170.3	0	0	0	0	0	114.3
180	T	42.7	Very low	61.5	Low	135 Å²	135	93.3 Å²	93.3	83%	0.828	49%	0.491	S	S	*	.			trans	-150.3	153.5	152.9	4.3	0	0	0	0	110.5	Q182	T180-Q182 PolarHBondContact O-N 3.43Å
181	K	38.7	Very low	61.6	Low	208 Å²	208	90.7 Å²	90.7	90%	0.904	48%	0.482	S	S	*	.	S	Bend	trans	-80.9	87.2	-164.2	-63.9	174.1	-178.6	172.8	0	113.4
182	Q	38.7	Very low	61.7	Low	183 Å²	183	89.3 Å²	89.3	86%	0.855	48%	0.483	S	S	*	.			trans	-152.1	146.7	153.2	-110.2	155.2	23.6	0	0	111.6	T180 L184	T180-Q182 PolarHBondContact O-N 3.43Å; Q182-L184 PolarHBondContact O-N 3.33Å; Q182-L184 VanDerWaalsContact O-N 3.13Å
183	K	37.5	Very low	62	Low	206 Å²	206	90.2 Å²	90.2	90%	0.896	49%	0.486	S	S	*	.	S	Bend	trans	-83.9	87.7	-166.9	-69.4	179.1	177.4	177.9	0	112
184	L	42.4	Very low	62.1	Low	134 Å²	134	89.4 Å²	89.4	70%	0.702	48%	0.482	S	S	*	.			trans	-164.3	78.7	154.4	-98.1	144.5	0	0	0	107.6	Q182 E186	Q182-L184 PolarHBondContact O-N 3.33Å; Q182-L184 VanDerWaalsContact O-N 3.13Å; L184-E186 WeakPolarHBondContact CD2-OE1 3.34Å; L184-E186 PolarHBondContact O-N 2.94Å
185	H	46.1	Very low	62.6	Low	145 Å²	145	89 Å²	89	67%	0.671	48%	0.483	S	S	*	.			trans	-79.7	73.2	179.5	-100.4	-61.8	0	0	0	110.3
186	E	55.2	Low	63.5	Low	93 Å²	93	88.3 Å²	88.3	44%	0.435	49%	0.485	S	S	.	.			trans	-101.4	127.9	-165	-141.8	170.1	-116.6	0	0	110.4	L184 T188 I191	L184-E186 WeakPolarHBondContact CD2-OE1 3.34Å; L184-E186 PolarHBondContact O-N 2.94Å; E186-T188 PolarHBondContact O-N 2.92Å; E186-I191 HydrophobicContact CB-CD1 3.65Å; E186-I191 HydrophobicContact CB-CG1 4.24Å; E186-I191 HydrophobicContact CG-CD1 3.6Å; E186-I191 HydrophobicContact CG-CG1 3.66Å; E186-I191 WeakPolarHBondContact OE2-CD1 3.4Å
187	N	70.3	Confident	64.9	Low	12 Å²	12	86.1 Å²	86.1	6%	0.064	47%	0.469	C	S	.	.			trans	-77.1	106.8	-175.5	171.4	4.7	0	0	0	109.9	L172 I174 N189 L190 I191	L172-N187 PolarHBondContact O-ND2 3.16Å; I174-N187 PolarHBondContact O-ND2 2.96Å; I174-N187 VanDerWaalsContact O-ND2 3.14Å; I174-N187 PolarHBondContact O-OD1 2.78Å; N187-N189 PolarHBondContact O-N 3.4Å; N187-N189 VanDerWaalsContact O-N 3.08Å; N187-N189 PolarHBondContact OD1-N 3.2Å; N187-N189 VanDerWaalsContact OD1-N 3.13Å; N187-L190 HydrophobicContact CB-CB 3.9Å; N187-L190 CarbonylContact O-C 3.5Å; N187-L190 WeakPolarHBondContact O-CA 3.28Å; N187-L190 WeakPolarHBondContact O-CB 3.46Å; N187-L190 PolarHBondContact O-N 3.31Å; N187-I191 WeakPolarHBondContact O-CG1 3.43Å; N187-I191 PolarHBondContact O-N 2.97Å
188	T	78.8	Confident	66.7	Low	90 Å²	90	86.5 Å²	86.5	55%	0.552	46%	0.464	S	S	*	.	H	α-helix	trans	-51.1	-36.7	-176	-42.3	0	0	0	0	114.3	E186 A192	E186-T188 PolarHBondContact O-N 2.92Å; T188-A192 WeakPolarHBondContact O-CB 3.31Å; T188-A192 PolarHBondContact O-N 3.43Å
189	N	82.6	Confident	68.6	Low	82 Å²	82	84.6 Å²	84.6	44%	0.439	45%	0.454	S	S	.	.	H	α-helix	trans	-68.9	-38.6	176.3	-66.8	-18.1	0	0	0	112	N171 L172 N187 F193	N171-N189 PolarHBondContact O-ND2 2.79Å; L172-N189 HydrophobicContact CD2-CB 4.5Å; N187-N189 PolarHBondContact O-N 3.4Å; N187-N189 VanDerWaalsContact O-N 3.08Å; N187-N189 PolarHBondContact OD1-N 3.2Å; N187-N189 VanDerWaalsContact OD1-N 3.13Å; N189-F193 VanDerWaalsContact O-CB 3.22Å; N189-F193 WeakPolarHBondContact O-CB 3.43Å; N189-F193 PolarHBondContact O-N 3.41Å
190	L	84	Confident	70.8	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-75.6	-34.6	179	-176.3	52.6	0	0	0	112.2	L172 N187 F193 G194 I232 L237 E240 L241	L172-L190 HydrophobicContact CD2-CB 4.47Å; L172-L190 HydrophobicContact CD2-CD1 4.29Å; N187-L190 HydrophobicContact CB-CB 3.9Å; N187-L190 CarbonylContact O-C 3.5Å; N187-L190 WeakPolarHBondContact O-CA 3.28Å; N187-L190 WeakPolarHBondContact O-CB 3.46Å; N187-L190 PolarHBondContact O-N 3.31Å; L190-F193 HydrophobicContact CD1-CD1 4.42Å; L190-G194 PolarHBondContact O-N 3.3Å; L190-I232 HydrophobicContact CD2-CD1 4.43Å; L190-L237 HydrophobicContact CD1-CD1 3.45Å; L190-L237 VanDerWaalsContact CD1-CD1 3.45Å; L190-L237 HydrophobicContact CD2-CD1 3.62Å; L190-L237 HydrophobicContact CG-CD1 4.19Å; L190-E240 VanDerWaalsContact CD2-CD 3.44Å; L190-E240 HydrophobicContact CD2-CG 4.49Å; L190-E240 VanDerWaalsContact CD2-OE1 3.29Å; L190-E240 WeakPolarHBondContact CD2-OE1 3.37Å; L190-E240 WeakPolarHBondContact CD2-OE2 3.42Å; L190-L241 HydrophobicContact CD1-CD2 3.9Å; L190-L241 HydrophobicContact CD1-CG 4.22Å
191	I	85.4	Confident	72.9	Confident	43 Å²	43	82 Å²	82	22%	0.221	42%	0.418	C	S	.	.	H	α-helix	trans	-61.3	-55.8	169.6	-56.6	162.3	0	0	0	109.2	E186 N187 F193 G194 T195 W245	E186-I191 HydrophobicContact CB-CD1 3.65Å; E186-I191 HydrophobicContact CB-CG1 4.24Å; E186-I191 HydrophobicContact CG-CD1 3.6Å; E186-I191 HydrophobicContact CG-CG1 3.66Å; E186-I191 WeakPolarHBondContact OE2-CD1 3.4Å; N187-I191 WeakPolarHBondContact O-CG1 3.43Å; N187-I191 PolarHBondContact O-N 2.97Å; I191-F193 VanDerWaalsContact C-N 3.29Å; I191-F193 PolarHBondContact O-N 3.38Å; I191-G194 PolarHBondContact O-N 2.98Å; I191-T195 WeakPolarHBondContact O-CB 3.22Å; I191-T195 PolarHBondContact O-N 2.84Å; I191-T195 PolarHBondContact O-OG1 2.68Å; I191-W245 HydrophobicContact CG2-CH2 4.2Å
192	A	86.2	Confident	75.3	Confident	62 Å²	62	73.7 Å²	73.7	51%	0.512	38%	0.381	S	S	.	.	H	α-helix	trans	-58.8	-42.2	-178.3	0	0	0	0	0	111.8	T188 S196	T188-A192 WeakPolarHBondContact O-CB 3.31Å; T188-A192 PolarHBondContact O-N 3.43Å; A192-S196 WeakPolarHBondContact O-CB 3.3Å; A192-S196 PolarHBondContact O-N 2.89Å; A192-S196 VanDerWaalsContact O-N 3.07Å; A192-S196 PolarHBondContact O-OG 3Å
193	F	88.8	Confident	77.8	Confident	32 Å²	32	67.1 Å²	67.1	14%	0.14	35%	0.354	C	S	.	.	H	α-helix	trans	-62.8	-54.5	173.7	-178.7	-117	0	0	0	111.4	L164 L172 N189 L190 I191 T195 S196 L197 L241	L164-F193 HydrophobicContact CD1-CE1 4.1Å; L164-F193 HydrophobicContact CD1-CZ 3.91Å; L164-F193 HydrophobicContact CD2-CE2 4.06Å; L164-F193 HydrophobicContact CD2-CZ 3.86Å; L164-F193 HydrophobicContact CG-CZ 4.36Å; L172-F193 HydrophobicContact CD1-CD1 3.99Å; L172-F193 HydrophobicContact CD1-CE1 4.11Å; L172-F193 HydrophobicContact CD1-CG 4.44Å; L172-F193 HydrophobicContact CD2-CB 3.79Å; L172-F193 HydrophobicContact CD2-CD1 3.99Å; L172-F193 HydrophobicContact CD2-CG 4Å; N189-F193 VanDerWaalsContact O-CB 3.22Å; N189-F193 WeakPolarHBondContact O-CB 3.43Å; N189-F193 PolarHBondContact O-N 3.41Å; L190-F193 HydrophobicContact CD1-CD1 4.42Å; I191-F193 VanDerWaalsContact C-N 3.29Å; I191-F193 PolarHBondContact O-N 3.38Å; F193-T195 PolarHBondContact O-N 3.09Å; F193-S196 CarbonylContact O-C 3.28Å; F193-S196 WeakPolarHBondContact O-CA 3.26Å; F193-S196 WeakPolarHBondContact O-CB 3.29Å; F193-S196 PolarHBondContact O-N 2.88Å; F193-S196 PolarHBondContact O-OG 3.36Å; F193-L197 HydrophobicContact CD1-CD1 4.31Å; F193-L197 HydrophobicContact CD2-CD2 4.48Å; F193-L197 HydrophobicContact CE1-CD1 3.75Å; F193-L197 HydrophobicContact CE1-CG 4.3Å; F193-L197 HydrophobicContact CE2-CD2 3.94Å; F193-L197 HydrophobicContact CE2-CG 4.4Å; F193-L197 HydrophobicContact CZ-CD1 3.89Å; F193-L197 HydrophobicContact CZ-CD2 3.97Å; F193-L197 HydrophobicContact CZ-CG 4.21Å; F193-L197 WeakPolarHBondContact O-CG 3.2Å; F193-L197 PolarHBondContact O-N 2.68Å; F193-L241 HydrophobicContact CD1-CD2 4.06Å; F193-L241 HydrophobicContact CE1-CD1 4.36Å; F193-L241 HydrophobicContact CE1-CD2 3.99Å
194	G	87.1	Confident	80.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60	-40.9	-179.1	0	0	0	0	0	114.2	L190 I191 S196 L197 M198 W245	L190-G194 PolarHBondContact O-N 3.3Å; I191-G194 PolarHBondContact O-N 2.98Å; G194-S196 VanDerWaalsContact C-N 3.34Å; G194-L197 WeakPolarHBondContact O-CB 3.22Å; G194-L197 PolarHBondContact O-N 3.18Å; G194-L197 VanDerWaalsContact O-N 3.16Å; G194-M198 PolarHBondContact O-N 2.66Å; G194-W245 VanDerWaalsContact CA-CD2 3.46Å; G194-W245 VanDerWaalsContact CA-CE3 3.46Å
195	T	87.2	Confident	82.9	Confident	56 Å²	56	51.6 Å²	51.6	34%	0.344	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-40.9	171.7	-54.5	0	0	0	0	111.1	I191 F193 L197 M198 N199	I191-T195 WeakPolarHBondContact O-CB 3.22Å; I191-T195 PolarHBondContact O-N 2.84Å; I191-T195 PolarHBondContact O-OG1 2.68Å; F193-T195 PolarHBondContact O-N 3.09Å; T195-L197 VanDerWaalsContact C-N 3.28Å; T195-L197 PolarHBondContact O-N 2.77Å; T195-M198 PolarHBondContact O-N 3.11Å; T195-N199 WeakPolarHBondContact O-CB 3.41Å; T195-N199 PolarHBondContact O-N 3.5Å; T195-N199 PolarHBondContact O-ND2 2.94Å; T195-N199 PolarHBondContact O-OD1 3.2Å
196	S	87.4	Confident	85.1	Confident	45 Å²	45	44.7 Å²	44.7	32%	0.315	25%	0.25	S	S	.	.	H	α-helix	trans	-66.2	-28.6	174.4	74.7	0	0	0	0	113.2	A192 F193 G194	A192-S196 WeakPolarHBondContact O-CB 3.3Å; A192-S196 PolarHBondContact O-N 2.89Å; A192-S196 VanDerWaalsContact O-N 3.07Å; A192-S196 PolarHBondContact O-OG 3Å; F193-S196 CarbonylContact O-C 3.28Å; F193-S196 WeakPolarHBondContact O-CA 3.26Å; F193-S196 WeakPolarHBondContact O-CB 3.29Å; F193-S196 PolarHBondContact O-N 2.88Å; F193-S196 PolarHBondContact O-OG 3.36Å; G194-S196 VanDerWaalsContact C-N 3.34Å
197	L	88.6	Confident	87	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-71.6	-45.3	171.2	-57.4	-166.6	0	0	0	112.2	I118 I162 F193 G194 T195 N199 L200 V204 L241 V247	I118-L197 HydrophobicContact CD1-CD2 4.11Å; I162-L197 HydrophobicContact CD1-CD2 3.34Å; F193-L197 HydrophobicContact CD1-CD1 4.31Å; F193-L197 HydrophobicContact CD2-CD2 4.48Å; F193-L197 HydrophobicContact CE1-CD1 3.75Å; F193-L197 HydrophobicContact CE1-CG 4.3Å; F193-L197 HydrophobicContact CE2-CD2 3.94Å; F193-L197 HydrophobicContact CE2-CG 4.4Å; F193-L197 HydrophobicContact CZ-CD1 3.89Å; F193-L197 HydrophobicContact CZ-CD2 3.97Å; F193-L197 HydrophobicContact CZ-CG 4.21Å; F193-L197 WeakPolarHBondContact O-CG 3.2Å; F193-L197 PolarHBondContact O-N 2.68Å; G194-L197 WeakPolarHBondContact O-CB 3.22Å; G194-L197 PolarHBondContact O-N 3.18Å; G194-L197 VanDerWaalsContact O-N 3.16Å; T195-L197 VanDerWaalsContact C-N 3.28Å; T195-L197 PolarHBondContact O-N 2.77Å; L197-N199 VanDerWaalsContact C-N 3.3Å; L197-N199 PolarHBondContact O-N 2.99Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 PolarHBondContact O-N 2.8Å; L197-V204 HydrophobicContact CD1-CG1 4.26Å; L197-V204 HydrophobicContact CD2-CG1 4.36Å; L197-L241 HydrophobicContact CD1-CD2 4.23Å; L197-V247 HydrophobicContact CD1-CG2 3.49Å; L197-V247 VanDerWaalsContact CD1-CG2 3.49Å
198	M	86.2	Confident	88	Confident	79 Å²	79	39.7 Å²	39.7	39%	0.389	23%	0.227	S	C	.	.	H	α-helix	trans	-58.5	-43.1	176	-76.9	-171.3	171	0	0	111.7	G194 T195 L200 N201 N244 W245	G194-M198 PolarHBondContact O-N 2.66Å; T195-M198 PolarHBondContact O-N 3.11Å; M198-L200 PolarHBondContact O-N 2.83Å; M198-N201 PolarHBondContact O-N 2.76Å; M198-N244 WeakPolarHBondContact CE-O 3.42Å; M198-W245 HydrophobicContact CE-CE3 3.75Å; M198-W245 HydrophobicContact CE-CZ3 4.18Å; M198-W245 HydrophobicContact CG-CE3 4.15Å; M198-W245 HydrophobicContact SD-CE3 3.95Å; M198-W245 HydrophobicContact SD-CZ3 4.06Å
199	N	87.3	Confident	88.6	Confident	95 Å²	95	36.2 Å²	36.2	51%	0.508	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-15	179.9	-71.8	-13.4	0	0	0	114.1	T195 L197 N201	T195-N199 WeakPolarHBondContact O-CB 3.41Å; T195-N199 PolarHBondContact O-N 3.5Å; T195-N199 PolarHBondContact O-ND2 2.94Å; T195-N199 PolarHBondContact O-OD1 3.2Å; L197-N199 VanDerWaalsContact C-N 3.3Å; L197-N199 PolarHBondContact O-N 2.99Å; N199-N201 VanDerWaalsContact C-N 3.34Å
200	L	86.5	Confident	88.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-21.5	174	-65.7	174.2	0	0	0	113.8	L112 P117 I118 L197 M198 R202 V204	L112-L200 HydrophobicContact CB-CD2 4.28Å; L112-L200 HydrophobicContact CD2-CD2 4.05Å; P117-L200 HydrophobicContact CB-CD2 3.63Å; P117-L200 HydrophobicContact CG-CD2 3.68Å; I118-L200 HydrophobicContact CD1-CD1 4.07Å; I118-L200 HydrophobicContact CG2-CD2 4.28Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 PolarHBondContact O-N 2.8Å; M198-L200 PolarHBondContact O-N 2.83Å; L200-R202 HydrophobicContact CB-CB 4.34Å; L200-R202 VanDerWaalsContact O-CG 3.29Å; L200-R202 WeakPolarHBondContact O-CG 3.46Å; L200-R202 PolarHBondContact O-N 2.83Å; L200-R202 VanDerWaalsContact O-N 3.08Å; L200-V204 HydrophobicContact CD1-CG2 3.84Å
201	N	86.7	Confident	88.4	Confident	152 Å²	152	33.3 Å²	33.3	81%	0.813	19%	0.193	S	C	*	.			trans	47.5	34.4	-174.2	-73	-42.4	0	0	0	114.1	M198 N199	M198-N201 PolarHBondContact O-N 2.76Å; N199-N201 VanDerWaalsContact C-N 3.34Å
202	R	88.7	Confident	87.6	Confident	34 Å²	34	36.5 Å²	36.5	13%	0.128	22%	0.217	C	C	.	.	S	Bend	trans	-135.8	152.1	-172.5	-79.4	168.1	77.3	171.6	10.5	111.1	L112 G114 E157 P158 V160 L200 V204	L112-R202 PolarHBondContact O-NH1 2.76Å; G114-R202 PolarHBondContact O-NH1 2.88Å; E157-R202 PolarHBondContact O-NH2 3.47Å; P158-R202 WeakPolarHBondContact O-CB 3.43Å; P158-R202 PolarHBondContact O-NE 2.83Å; V160-R202 HydrophobicContact CG2-CB 4.16Å; L200-R202 HydrophobicContact CB-CB 4.34Å; L200-R202 VanDerWaalsContact O-CG 3.29Å; L200-R202 WeakPolarHBondContact O-CG 3.46Å; L200-R202 PolarHBondContact O-N 2.83Å; L200-R202 VanDerWaalsContact O-N 3.08Å; R202-V204 PolarHBondContact O-N 2.86Å; R202-V204 VanDerWaalsContact O-N 3.09Å
203	P	91.3	Very high	86.4	Confident	44 Å²	44	38.7 Å²	38.7	29%	0.286	22%	0.224	S	C	.	.			trans	-64.1	111.3	172.2	24.3	-30.9	0	0	0	110.5	P158 E159 V160 H248	P158-P203 HydrophobicContact CB-CG 4.2Å; P158-P203 WeakPolarHBondContact O-CD 3.49Å; E159-P203 WeakPolarHBondContact OE1-CG 3.39Å; V160-P203 PolarHBondContact N-O 2.96Å; P203-H248 HydrophobicContact CB-CB 4.44Å
204	V	92.8	Very high	85.2	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.024	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	137	178.4	178.2	0	0	0	0	110.7	V160 I162 L197 L200 R202 V247 H248	V160-V204 CarbonylContact O-C 3.6Å; V160-V204 VanDerWaalsContact O-CA 3.31Å; V160-V204 WeakPolarHBondContact O-CA 3.37Å; I162-V204 HydrophobicContact CD1-CG1 3.43Å; I162-V204 VanDerWaalsContact CD1-CG1 3.43Å; I162-V204 HydrophobicContact CG1-CG1 4.07Å; L197-V204 HydrophobicContact CD1-CG1 4.26Å; L197-V204 HydrophobicContact CD2-CG1 4.36Å; L200-V204 HydrophobicContact CD1-CG2 3.84Å; R202-V204 PolarHBondContact O-N 2.86Å; R202-V204 VanDerWaalsContact O-N 3.09Å; V204-V247 HydrophobicContact CG1-CG1 4.42Å; V204-V247 CarbonylContact O-C 3.46Å; V204-V247 WeakPolarHBondContact O-CG1 3.49Å; V204-H248 WeakPolarHBondContact O-CB 3.42Å; V204-H248 PolarHBondContact O-N 3.45Å
205	T	93.9	Very high	83.6	Confident	10 Å²	10	46.3 Å²	46.3	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.4	168.2	-74.7	0	0	0	0	111	V160 V161 I162 S249	V160-T205 PolarHBondContact O-N 2.84Å; V161-T205 CarbonylContact C-O 3.54Å; V161-T205 VanDerWaalsContact CA-O 3.3Å; V161-T205 WeakPolarHBondContact CA-O 3.32Å; V161-T205 HydrophobicContact CG1-CG2 4.45Å; V161-T205 HydrophobicContact CG2-CG2 4.36Å; I162-T205 PolarHBondContact N-O 3.07Å; T205-S249 CarbonylContact C-O 3.56Å; T205-S249 VanDerWaalsContact CA-O 3.29Å; T205-S249 WeakPolarHBondContact CA-O 3.49Å; T205-S249 WeakPolarHBondContact OG1-CB 3.37Å
206	C	93.4	Very high	81.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.8	-178	-65.8	0	0	0	0	111.9	F208 V247 S249 T250 R251	C206-F208 HydrophobicContact CB-CD2 4.41Å; C206-F208 HydrophobicContact CB-CE2 3.61Å; C206-F208 HydrophobicContact CB-CZ 4.04Å; C206-V247 HydrophobicContact CB-CG1 4.22Å; C206-S249 PolarHBondContact N-O 3.3Å; C206-T250 HydrophobicContact CB-CG2 4.43Å; C206-T250 CarbonylContact O-C 3.36Å; C206-T250 WeakPolarHBondContact O-CA 3.47Å; C206-R251 PolarHBondContact O-N 2.95Å
207	I	93.6	Very high	79.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.1	173.4	-57.2	-179.9	0	0	0	108.6	V161 I162 L163 L164 R251 T253 V259 I262 L263	V161-I207 HydrophobicContact CG1-CD1 3.56Å; V161-I207 HydrophobicContact CG1-CG1 3.86Å; I162-I207 PolarHBondContact O-N 2.79Å; L163-I207 HydrophobicContact CD1-CB 4.14Å; L163-I207 HydrophobicContact CD1-CG2 3.87Å; L164-I207 PolarHBondContact N-O 3.32Å; I207-R251 CarbonylContact C-O 3.02Å; I207-R251 WeakPolarHBondContact CA-O 3.4Å; I207-R251 HydrophobicContact CG1-CB 4.49Å; I207-T253 HydrophobicContact CG2-CG2 4.23Å; I207-V259 HydrophobicContact CG2-CG1 4.43Å; I207-V259 HydrophobicContact CG2-CG2 3.94Å; I207-I262 HydrophobicContact CD1-CG2 3.79Å; I207-L263 HydrophobicContact CD1-CD2 4.21Å; I207-L263 HydrophobicContact CD1-CG 4.27Å
208	F	92.4	Very high	77.9	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	100.7	-178.3	-64.5	-101.5	0	0	0	109.3	L164 I169 C206 T210 I234 L237 L241 T250 R251 V252 T253	L164-F208 HydrophobicContact CD1-CD1 4.06Å; L164-F208 HydrophobicContact CD1-CE1 3.58Å; L164-F208 HydrophobicContact CD1-CZ 3.88Å; I169-F208 HydrophobicContact CD1-CB 3.75Å; I169-F208 HydrophobicContact CD1-CD1 3.93Å; I169-F208 HydrophobicContact CD1-CG 4.33Å; I169-F208 HydrophobicContact CG1-CD1 3.88Å; I169-F208 HydrophobicContact CG2-CD1 4.45Å; C206-F208 HydrophobicContact CB-CD2 4.41Å; C206-F208 HydrophobicContact CB-CE2 3.61Å; C206-F208 HydrophobicContact CB-CZ 4.04Å; F208-T210 PolarHBondContact O-N 3.02Å; F208-I234 HydrophobicContact CB-CD1 4.32Å; F208-I234 HydrophobicContact CD1-CD1 4.44Å; F208-L237 HydrophobicContact CE1-CD2 3.8Å; F208-L237 HydrophobicContact CE1-CG 4.33Å; F208-L241 HydrophobicContact CE1-CD1 4.36Å; F208-L241 HydrophobicContact CZ-CD1 3.66Å; F208-T250 HydrophobicContact CE2-CG2 3.92Å; F208-R251 PolarHBondContact N-O 3.37Å; F208-V252 HydrophobicContact CB-CG2 4.29Å; F208-T253 PolarHBondContact O-N 2.88Å; F208-T253 VanDerWaalsContact O-O 3.11Å; F208-T253 PolarHBondContact O-OG1 3.44Å
209	L	90.4	Very high	75.6	Confident	18 Å²	18	61.7 Å²	61.7	9%	0.094	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	91.6	174.8	-179.8	68.1	0	0	0	109.7	M60 L163 L164 A166 G211 T253 L256 V259	M60-L209 HydrophobicContact CE-CD2 3.78Å; L163-L209 HydrophobicContact CD1-CB 3.88Å; L164-L209 PolarHBondContact O-N 3.3Å; A166-L209 PolarHBondContact N-O 3.01Å; A166-L209 VanDerWaalsContact N-O 3.1Å; L209-G211 VanDerWaalsContact C-N 3.32Å; L209-T253 WeakPolarHBondContact CA-O 3.43Å; L209-L256 HydrophobicContact CD1-CD2 4.19Å; L209-L256 HydrophobicContact CD2-CD2 3.49Å; L209-L256 VanDerWaalsContact CD2-CD2 3.49Å; L209-V259 HydrophobicContact CD1-CG2 4.17Å
210	T	83.9	Confident	73.3	Confident	3 Å²	3	65 Å²	65	2%	0.018	35%	0.352	C	S	.	.			trans	-76.2	-22.8	-178.3	70	0	0	0	0	112.8	I169 F208 F214 I234 V252 T253	I169-T210 HydrophobicContact CD1-CG2 4.39Å; F208-T210 PolarHBondContact O-N 3.02Å; T210-F214 HydrophobicContact CG2-CD1 3.99Å; T210-F214 HydrophobicContact CG2-CE1 4.24Å; T210-F214 HydrophobicContact CG2-CG 4.33Å; T210-F214 WeakPolarHBondContact O-CB 3.2Å; T210-I234 HydrophobicContact CG2-CD1 3.65Å; T210-V252 HydrophobicContact CG2-CG1 3.6Å; T210-T253 PolarHBondContact N-O 2.92Å; T210-T253 PolarHBondContact OG1-O 3.3Å
211	G	78.4	Confident	71.1	Confident	17 Å²	17	72.6 Å²	72.6	18%	0.175	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	-174.1	-164.5	0	0	0	0	0	112.7	L209 S254	L209-G211 VanDerWaalsContact C-N 3.32Å; G211-S254 CarbonylContact C-O 3.54Å; G211-S254 WeakPolarHBondContact CA-O 3.18Å
212	P	68.5	Low	68.3	Low	110 Å²	110	70.6 Å²	70.6	71%	0.714	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-36.5	-177.1	28.7	-33.5	0	0	0	113.7	F214	P212-F214 PolarHBondContact O-N 3.09Å
213	T	61.7	Low	65.6	Low	109 Å²	109	75 Å²	75	67%	0.669	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-74.5	-22.4	-169.8	50.6	0	0	0	0	114.3	K215 S216	T213-K215 PolarHBondContact O-N 2.81Å; T213-S216 WeakPolarHBondContact O-CB 3.32Å; T213-S216 PolarHBondContact O-N 3.21Å
214	F	63.9	Low	62.8	Low	44 Å²	44	78.9 Å²	78.9	19%	0.193	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-67.2	-33.1	-172.7	-168.1	-82.2	0	0	0	113.5	I169 K170 L173 T210 P212 S216 I234	I169-F214 HydrophobicContact CB-CE2 4.31Å; I169-F214 HydrophobicContact CB-CZ 4.48Å; I169-F214 HydrophobicContact CG2-CE2 3.86Å; I169-F214 HydrophobicContact CG2-CZ 3.56Å; K170-F214 HydrophobicContact CG-CE2 4.37Å; L173-F214 HydrophobicContact CD1-CE1 4.5Å; L173-F214 HydrophobicContact CD1-CZ 3.76Å; T210-F214 HydrophobicContact CG2-CD1 3.99Å; T210-F214 HydrophobicContact CG2-CE1 4.24Å; T210-F214 HydrophobicContact CG2-CG 4.33Å; T210-F214 WeakPolarHBondContact O-CB 3.2Å; P212-F214 PolarHBondContact O-N 3.09Å; F214-S216 PolarHBondContact O-N 3.48Å; F214-I234 HydrophobicContact CE1-CD1 4Å; F214-I234 HydrophobicContact CZ-CD1 4.39Å
215	K	53.6	Low	60	Low	148 Å²	148	87.5 Å²	87.5	64%	0.643	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-70.5	-10	176.6	-70.2	-175.6	177.2	177.7	0	113.8	T213	T213-K215 PolarHBondContact O-N 2.81Å
216	S	47.1	Very low	57	Low	94 Å²	94	94.1 Å²	94.1	66%	0.657	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-87.4	-14.5	-172.5	-170.6	0	0	0	0	115	T213 F214	T213-S216 WeakPolarHBondContact O-CB 3.32Å; T213-S216 PolarHBondContact O-N 3.21Å; F214-S216 PolarHBondContact O-N 3.48Å
217	K	48.8	Very low	54.4	Low	159 Å²	159	99.6 Å²	99.6	69%	0.691	56%	0.559	S	S	*	*	S	Bend	trans	-99.6	-5.1	-163	-72.2	-161.4	172.3	-167.4	0	116.7	N219	K217-N219 PolarHBondContact O-N 3.3Å
218	T	46.6	Very low	51.6	Low	120 Å²	120	105.2 Å²	105.2	74%	0.736	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-15.7	-175.4	48.5	0	0	0	0	115
219	N	37.5	Very low	49.5	Very low	134 Å²	134	106.5 Å²	106.5	72%	0.717	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	4.1	-165	-63.7	21	0	0	0	114.8	K217	K217-N219 PolarHBondContact O-N 3.3Å
220	H	39.5	Very low	48.1	Very low	165 Å²	165	109.3 Å²	109.3	76%	0.764	63%	0.629	S	S	*	*			trans	-139.4	24.7	-165.7	-92.8	-63.1	0	0	0	116.9
221	L	39.5	Very low	47.5	Very low	159 Å²	159	116.1 Å²	116.1	83%	0.832	66%	0.655	S	S	*	*			trans	-119.9	65.9	170.6	-80.6	91.3	0	0	0	112.9
222	S	29.7	Very low	47.6	Very low	111 Å²	111	115.5 Å²	115.5	78%	0.776	65%	0.648	S	S	*	*			trans	-104.9	153.5	149.2	55.5	0	0	0	0	109
223	S	30.2	Very low	48.3	Very low	125 Å²	125	113 Å²	113	87%	0.874	63%	0.633	S	S	*	*	S	Bend	trans	67.6	63.3	176.4	-169.7	0	0	0	0	118.2
224	S	33.8	Very low	49.4	Very low	126 Å²	126	109.4 Å²	109.4	88%	0.881	61%	0.609	S	S	*	*				-151.9	159.4	126.9	-161.4	0	0	0	0	111.5
225	K	33	Very low	50.5	Low	185 Å²	185	113 Å²	113	80%	0.804	63%	0.631	S	S	*	*			trans	-74.5	148.1	-161.5	-67	172.1	179.2	173.8	0	114.1
226	N	32.4	Very low	52.1	Low	149 Å²	149	109.9 Å²	109.9	80%	0.797	62%	0.618	S	S	*	*	S	Bend	trans	63.5	55.4	148.2	-58.7	5.5	0	0	0	118.8
227	T	37.1	Very low	54.1	Low	115 Å²	115	105.4 Å²	105.4	71%	0.706	59%	0.587	S	S	*	*				-167.3	96.3	125.1	14	0	0	0	0	109.5	S229	T227-S229 PolarHBondContact O-N 2.99Å
228	S	36.5	Very low	56.1	Low	118 Å²	118	98.3 Å²	98.3	83%	0.825	56%	0.557	S	S	*	*			trans	-76.5	65.5	178.2	56.7	0	0	0	0	111.3	S230	S228-S230 PolarHBondContact O-N 3.21Å; S228-S230 VanDerWaalsContact O-N 3.15Å
229	S	48	Very low	58.1	Low	28 Å²	28	94.5 Å²	94.5	20%	0.196	54%	0.538	C	S	.	.			trans	-62.3	110.5	165.3	39.2	0	0	0	0	108	T227 Y231	T227-S229 PolarHBondContact O-N 2.99Å; S229-Y231 VanDerWaalsContact C-N 3.27Å; S229-Y231 WeakPolarHBondContact O-CD2 3.37Å; S229-Y231 PolarHBondContact O-N 3.37Å; S229-Y231 WeakPolarHBondContact OG-CE2 3.34Å
230	S	61.4	Low	60.5	Low	76 Å²	76	90.2 Å²	90.2	53%	0.531	51%	0.513	S	S	.	.			trans	-76.9	79.7	-178.9	42	0	0	0	0	109.6	K175 S228 I232	K175-S230 WeakPolarHBondContact CB-O 3.34Å; K175-S230 WeakPolarHBondContact CD-O 3.37Å; K175-S230 WeakPolarHBondContact CG-O 3.46Å; S228-S230 PolarHBondContact O-N 3.21Å; S228-S230 VanDerWaalsContact O-N 3.15Å; S230-I232 PolarHBondContact O-N 2.8Å; S230-I232 VanDerWaalsContact O-N 3.15Å
231	Y	69.7	Low	62.9	Low	146 Å²	146	82.3 Å²	82.3	57%	0.573	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-49.7	123.6	178.4	-70.3	-86.4	0	0	0	110.8	L173 I174 S229	L173-Y231 HydrophobicContact CB-CD1 4.22Å; L173-Y231 WeakPolarHBondContact O-CA 3.39Å; I174-Y231 HydrophobicContact CG1-CD1 4.47Å; I174-Y231 HydrophobicContact CG1-CE1 3.81Å; S229-Y231 VanDerWaalsContact C-N 3.27Å; S229-Y231 WeakPolarHBondContact O-CD2 3.37Å; S229-Y231 PolarHBondContact O-N 3.37Å; S229-Y231 WeakPolarHBondContact OG-CE2 3.34Å
232	I	80.1	Confident	65.3	Low	5 Å²	5	79 Å²	79	3%	0.026	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-63.3	144.3	169.9	-152.8	174	0	0	0	107.7	L173 K175 L190 S230 E236 L237 E240	L173-I232 HydrophobicContact CB-CG2 4Å; L173-I232 HydrophobicContact CD2-CG2 3.29Å; L173-I232 HydrophobicContact CG-CG2 4.2Å; L173-I232 PolarHBondContact O-N 3.04Å; K175-I232 VanDerWaalsContact CE-CB 3.43Å; K175-I232 VanDerWaalsContact CE-CG1 3.45Å; K175-I232 HydrophobicContact CG-CB 4.41Å; L190-I232 HydrophobicContact CD2-CD1 4.43Å; S230-I232 PolarHBondContact O-N 2.8Å; S230-I232 VanDerWaalsContact O-N 3.15Å; I232-E236 HydrophobicContact CD1-CG 4Å; I232-E236 HydrophobicContact CG1-CB 3.87Å; I232-E236 HydrophobicContact CG1-CG 3.47Å; I232-E236 VanDerWaalsContact CG1-CG 3.47Å; I232-E236 WeakPolarHBondContact CG1-OE1 3.44Å; I232-E236 WeakPolarHBondContact CG1-OE2 3.4Å; I232-L237 HydrophobicContact CG2-CB 4.03Å; I232-E240 WeakPolarHBondContact CD1-OE2 3.47Å
233	S	84.3	Confident	68.3	Low	58 Å²	58	80 Å²	80	41%	0.406	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-74	152.6	172.5	74.7	0	0	0	0	110.4	N235 E236 L237	S233-N235 PolarHBondContact O-N 2.75Å; S233-E236 PolarHBondContact N-OE2 3.17Å; S233-E236 WeakPolarHBondContact O-CB 3.35Å; S233-E236 PolarHBondContact O-N 2.99Å; S233-E236 VanDerWaalsContact O-N 3.08Å; S233-E236 WeakPolarHBondContact OG-CB 3.37Å; S233-E236 PolarHBondContact OG-N 3.16Å; S233-E236 VanDerWaalsContact OG-N 3.11Å; S233-L237 PolarHBondContact O-N 3.23Å
234	I	85.5	Confident	71.1	Confident	33 Å²	33	78.1 Å²	78.1	17%	0.169	43%	0.433	C	S	.	.	H	α-helix	trans	-60.8	-28.5	177.5	-169.2	167.8	0	0	0	112.5	I169 F208 T210 F214 C238 V252	I169-I234 HydrophobicContact CG2-CD1 4.38Å; F208-I234 HydrophobicContact CB-CD1 4.32Å; F208-I234 HydrophobicContact CD1-CD1 4.44Å; T210-I234 HydrophobicContact CG2-CD1 3.65Å; F214-I234 HydrophobicContact CE1-CD1 4Å; F214-I234 HydrophobicContact CZ-CD1 4.39Å; I234-C238 WeakPolarHBondContact O-CB 3.32Å; I234-C238 PolarHBondContact O-N 3.08Å; I234-C238 PolarHBondContact O-SG 2.86Å; I234-V252 HydrophobicContact CD1-CG1 3.91Å; I234-V252 HydrophobicContact CD1-CG2 4.06Å; I234-V252 HydrophobicContact CG1-CG2 4.29Å
235	N	87	Confident	73.7	Confident	120 Å²	120	73.7 Å²	73.7	64%	0.642	40%	0.397	S	S	*	.	H	α-helix	trans	-73.5	-38.7	175.4	-65.8	-10.4	0	0	0	111.8	S233 C238 A239	S233-N235 PolarHBondContact O-N 2.75Å; N235-C238 WeakPolarHBondContact O-CB 3.08Å; N235-C238 PolarHBondContact O-N 3.44Å; N235-A239 WeakPolarHBondContact O-CB 3.43Å; N235-A239 PolarHBondContact O-N 2.84Å
236	E	86.9	Confident	76.3	Confident	81 Å²	81	72 Å²	72	38%	0.379	39%	0.392	S	S	.	.	H	α-helix	trans	-67.4	-43.1	175.2	-175.6	-171	172.5	0	0	110.6	K175 I232 S233 C238 A239 E240	K175-E236 IonicContact NZ-OE1 2.77Å; K175-E236 PolarHBondContact NZ-OE1 3.21Å; I232-E236 HydrophobicContact CD1-CG 4Å; I232-E236 HydrophobicContact CG1-CB 3.87Å; I232-E236 HydrophobicContact CG1-CG 3.47Å; I232-E236 VanDerWaalsContact CG1-CG 3.47Å; I232-E236 WeakPolarHBondContact CG1-OE1 3.44Å; I232-E236 WeakPolarHBondContact CG1-OE2 3.4Å; S233-E236 PolarHBondContact N-OE2 3.17Å; S233-E236 WeakPolarHBondContact O-CB 3.35Å; S233-E236 PolarHBondContact O-N 2.99Å; S233-E236 VanDerWaalsContact O-N 3.08Å; S233-E236 WeakPolarHBondContact OG-CB 3.37Å; S233-E236 PolarHBondContact OG-N 3.16Å; S233-E236 VanDerWaalsContact OG-N 3.11Å; E236-C238 VanDerWaalsContact C-N 3.34Å; E236-C238 PolarHBondContact O-N 3.5Å; E236-A239 PolarHBondContact O-N 3.13Å; E236-E240 WeakPolarHBondContact O-CB 3.36Å; E236-E240 PolarHBondContact O-N 2.97Å
237	L	88.1	Confident	79	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-58	-43.8	168.3	174	63.3	0	0	0	112.1	L172 L173 L190 F208 I232 S233 A239 E240 L241	L172-L237 HydrophobicContact CB-CD1 4.43Å; L172-L237 HydrophobicContact CB-CD2 3.99Å; L173-L237 HydrophobicContact CD2-CB 3.99Å; L173-L237 HydrophobicContact CD2-CD2 3.6Å; L173-L237 HydrophobicContact CD2-CG 4.39Å; L190-L237 HydrophobicContact CD1-CD1 3.45Å; L190-L237 VanDerWaalsContact CD1-CD1 3.45Å; L190-L237 HydrophobicContact CD2-CD1 3.62Å; L190-L237 HydrophobicContact CG-CD1 4.19Å; F208-L237 HydrophobicContact CE1-CD2 3.8Å; F208-L237 HydrophobicContact CE1-CG 4.33Å; I232-L237 HydrophobicContact CG2-CB 4.03Å; S233-L237 PolarHBondContact O-N 3.23Å; L237-A239 VanDerWaalsContact C-N 3.32Å; L237-A239 PolarHBondContact O-N 3.08Å; L237-E240 PolarHBondContact O-N 2.73Å; L237-L241 HydrophobicContact CD1-CD1 3.82Å; L237-L241 HydrophobicContact CD1-CG 4.15Å; L237-L241 HydrophobicContact CG-CD1 3.99Å; L237-L241 WeakPolarHBondContact O-CB 3.32Å; L237-L241 WeakPolarHBondContact O-CG 3.36Å; L237-L241 PolarHBondContact O-N 2.94Å
238	C	90.5	Very high	81.5	Confident	11 Å²	11	66.1 Å²	66.1	7%	0.074	35%	0.352	C	S	.	.	H	α-helix	trans	-64.5	-35.2	177.2	-77.2	0	0	0	0	112.7	I234 N235 E236 Q242 T250	I234-C238 WeakPolarHBondContact O-CB 3.32Å; I234-C238 PolarHBondContact O-N 3.08Å; I234-C238 PolarHBondContact O-SG 2.86Å; N235-C238 WeakPolarHBondContact O-CB 3.08Å; N235-C238 PolarHBondContact O-N 3.44Å; E236-C238 VanDerWaalsContact C-N 3.34Å; E236-C238 PolarHBondContact O-N 3.5Å; C238-Q242 WeakPolarHBondContact O-CG 3.45Å; C238-Q242 PolarHBondContact O-N 2.95Å; C238-T250 HydrophobicContact CB-CG2 4.4Å
239	A	88.9	Confident	84.1	Confident	39 Å²	39	61.5 Å²	61.5	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-73.3	-43.3	175.4	0	0	0	0	0	111.6	N235 E236 L237 L241 Q242 L243	N235-A239 WeakPolarHBondContact O-CB 3.43Å; N235-A239 PolarHBondContact O-N 2.84Å; E236-A239 PolarHBondContact O-N 3.13Å; L237-A239 VanDerWaalsContact C-N 3.32Å; L237-A239 PolarHBondContact O-N 3.08Å; A239-L241 VanDerWaalsContact C-N 3.32Å; A239-L241 PolarHBondContact O-N 3.25Å; A239-Q242 PolarHBondContact O-N 2.83Å; A239-Q242 VanDerWaalsContact O-N 3.15Å; A239-L243 WeakPolarHBondContact O-CB 3.36Å; A239-L243 VanDerWaalsContact O-CG 3.3Å; A239-L243 WeakPolarHBondContact O-CG 3.3Å; A239-L243 PolarHBondContact O-N 2.83Å
240	E	88.1	Confident	86.1	Confident	44 Å²	44	60.8 Å²	60.8	21%	0.206	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-41	177.7	-161.3	-174.2	143.3	0	0	111.6	L190 I232 E236 L237 Q242 L243 N244 W245	L190-E240 VanDerWaalsContact CD2-CD 3.44Å; L190-E240 HydrophobicContact CD2-CG 4.49Å; L190-E240 VanDerWaalsContact CD2-OE1 3.29Å; L190-E240 WeakPolarHBondContact CD2-OE1 3.37Å; L190-E240 WeakPolarHBondContact CD2-OE2 3.42Å; I232-E240 WeakPolarHBondContact CD1-OE2 3.47Å; E236-E240 WeakPolarHBondContact O-CB 3.36Å; E236-E240 PolarHBondContact O-N 2.97Å; L237-E240 PolarHBondContact O-N 2.73Å; E240-Q242 PolarHBondContact O-N 3.18Å; E240-L243 PolarHBondContact O-N 2.69Å; E240-N244 HydrophobicContact CG-CB 4.43Å; E240-N244 VanDerWaalsContact CG-ND2 3.34Å; E240-N244 WeakPolarHBondContact CG-ND2 3.48Å; E240-N244 WeakPolarHBondContact O-CB 3.41Å; E240-N244 PolarHBondContact O-N 3.38Å; E240-W245 PolarHBondContact O-N 2.9Å
241	L	89.9	Confident	87.6	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-34.6	174.8	-75	167.4	0	0	0	113.4	L190 F193 L197 F208 L237 A239 W245 H246 V247	L190-L241 HydrophobicContact CD1-CD2 3.9Å; L190-L241 HydrophobicContact CD1-CG 4.22Å; F193-L241 HydrophobicContact CD1-CD2 4.06Å; F193-L241 HydrophobicContact CE1-CD1 4.36Å; F193-L241 HydrophobicContact CE1-CD2 3.99Å; L197-L241 HydrophobicContact CD1-CD2 4.23Å; F208-L241 HydrophobicContact CE1-CD1 4.36Å; F208-L241 HydrophobicContact CZ-CD1 3.66Å; L237-L241 HydrophobicContact CD1-CD1 3.82Å; L237-L241 HydrophobicContact CD1-CG 4.15Å; L237-L241 HydrophobicContact CG-CD1 3.99Å; L237-L241 WeakPolarHBondContact O-CB 3.32Å; L237-L241 WeakPolarHBondContact O-CG 3.36Å; L237-L241 PolarHBondContact O-N 2.94Å; A239-L241 VanDerWaalsContact C-N 3.32Å; A239-L241 PolarHBondContact O-N 3.25Å; L241-W245 HydrophobicContact CD2-CB 4.17Å; L241-W245 HydrophobicContact CD2-CG 4.26Å; L241-W245 CarbonylContact O-C 3.42Å; L241-W245 VanDerWaalsContact O-C 3.28Å; L241-W245 PolarHBondContact O-N 2.94Å; L241-H246 PolarHBondContact O-N 3.16Å; L241-V247 HydrophobicContact CB-CB 4.25Å; L241-V247 HydrophobicContact CB-CG2 3.99Å; L241-V247 HydrophobicContact CD2-CG2 4.22Å; L241-V247 VanDerWaalsContact O-CB 3.3Å; L241-V247 WeakPolarHBondContact O-CB 3.29Å; L241-V247 WeakPolarHBondContact O-CG2 3.28Å; L241-V247 PolarHBondContact O-N 3.25Å
242	Q	91.2	Very high	88.6	Confident	90 Å²	90	59.4 Å²	59.4	42%	0.421	30%	0.303	S	S	.	.	H	α-helix	trans	-74.7	-43.1	175.2	-72.9	176.7	9.6	0	0	112.3	C238 A239 E240 T250	C238-Q242 WeakPolarHBondContact O-CG 3.45Å; C238-Q242 PolarHBondContact O-N 2.95Å; A239-Q242 PolarHBondContact O-N 2.83Å; A239-Q242 VanDerWaalsContact O-N 3.15Å; E240-Q242 PolarHBondContact O-N 3.18Å; Q242-T250 HydrophobicContact CG-CG2 4.22Å; Q242-T250 PolarHBondContact NE2-OG1 3.17Å
243	L	90.9	Very high	89.1	Confident	131 Å²	131	59.5 Å²	59.5	69%	0.686	30%	0.304	S	S	*	.	H	α-helix	trans	-84.9	-45.7	-170.8	-66.1	172.5	0	0	0	113.4	A239 E240	A239-L243 WeakPolarHBondContact O-CB 3.36Å; A239-L243 VanDerWaalsContact O-CG 3.3Å; A239-L243 WeakPolarHBondContact O-CG 3.3Å; A239-L243 PolarHBondContact O-N 2.83Å; E240-L243 PolarHBondContact O-N 2.69Å
244	N	89	Confident	89.2	Confident	86 Å²	86	58.8 Å²	58.8	46%	0.46	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-45.5	-178.2	-60.5	-1.5	0	0	0	110.2	M198 E240 H246	M198-N244 WeakPolarHBondContact CE-O 3.42Å; E240-N244 HydrophobicContact CG-CB 4.43Å; E240-N244 VanDerWaalsContact CG-ND2 3.34Å; E240-N244 WeakPolarHBondContact CG-ND2 3.48Å; E240-N244 WeakPolarHBondContact O-CB 3.41Å; E240-N244 PolarHBondContact O-N 3.38Å; N244-H246 PolarHBondContact O-ND1 3.24Å; N244-H246 VanDerWaalsContact O-ND1 3.16Å
245	W	88.3	Confident	89.3	Confident	33 Å²	33	60.3 Å²	60.3	13%	0.125	31%	0.308	C	S	.	.	S	Bend	trans	-100.7	8.9	-168.3	-52.2	105.9	0	0	0	114.6	I191 G194 M198 E240 L241 V247	I191-W245 HydrophobicContact CG2-CH2 4.2Å; G194-W245 VanDerWaalsContact CA-CD2 3.46Å; G194-W245 VanDerWaalsContact CA-CE3 3.46Å; M198-W245 HydrophobicContact CE-CE3 3.75Å; M198-W245 HydrophobicContact CE-CZ3 4.18Å; M198-W245 HydrophobicContact CG-CE3 4.15Å; M198-W245 HydrophobicContact SD-CE3 3.95Å; M198-W245 HydrophobicContact SD-CZ3 4.06Å; E240-W245 PolarHBondContact O-N 2.9Å; L241-W245 HydrophobicContact CD2-CB 4.17Å; L241-W245 HydrophobicContact CD2-CG 4.26Å; L241-W245 CarbonylContact O-C 3.42Å; L241-W245 VanDerWaalsContact O-C 3.28Å; L241-W245 PolarHBondContact O-N 2.94Å; W245-V247 PolarHBondContact O-N 3.06Å; W245-V247 VanDerWaalsContact O-N 3.08Å
246	H	87.9	Confident	89.4	Confident	148 Å²	148	56.4 Å²	56.4	69%	0.685	29%	0.287	S	S	*	.			trans	55.4	25.2	172.9	-63.1	74.5	0	0	0	115.3	L241 N244 H248	L241-H246 PolarHBondContact O-N 3.16Å; N244-H246 PolarHBondContact O-ND1 3.24Å; N244-H246 VanDerWaalsContact O-ND1 3.16Å; H246-H248 PolarHBondContact O-N 3.34Å; H246-H248 VanDerWaalsContact O-N 3.17Å
247	V	90.2	Very high	89.5	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.024	29%	0.287	C	S	.	.			trans	-66.3	114.9	176.6	177.3	0	0	0	0	109.4	L197 V204 C206 L241 W245 S249 T250	L197-V247 HydrophobicContact CD1-CG2 3.49Å; L197-V247 VanDerWaalsContact CD1-CG2 3.49Å; V204-V247 HydrophobicContact CG1-CG1 4.42Å; V204-V247 CarbonylContact O-C 3.46Å; V204-V247 WeakPolarHBondContact O-CG1 3.49Å; C206-V247 HydrophobicContact CB-CG1 4.22Å; L241-V247 HydrophobicContact CB-CB 4.25Å; L241-V247 HydrophobicContact CB-CG2 3.99Å; L241-V247 HydrophobicContact CD2-CG2 4.22Å; L241-V247 VanDerWaalsContact O-CB 3.3Å; L241-V247 WeakPolarHBondContact O-CB 3.29Å; L241-V247 WeakPolarHBondContact O-CG2 3.28Å; L241-V247 PolarHBondContact O-N 3.25Å; W245-V247 PolarHBondContact O-N 3.06Å; W245-V247 VanDerWaalsContact O-N 3.08Å; V247-S249 VanDerWaalsContact C-N 3.25Å; V247-S249 WeakPolarHBondContact CG1-O 3.36Å; V247-S249 PolarHBondContact O-N 3.07Å; V247-T250 HydrophobicContact CG1-CG2 4.02Å
248	H	89.8	Confident	89.5	Confident	137 Å²	137	58.8 Å²	58.8	63%	0.634	30%	0.299	S	S	*	.	S	Bend	trans	-59.5	-31.7	-171.9	-177	70.4	0	0	0	113.6	P203 V204 H246	P203-H248 HydrophobicContact CB-CB 4.44Å; V204-H248 WeakPolarHBondContact O-CB 3.42Å; V204-H248 PolarHBondContact O-N 3.45Å; H246-H248 PolarHBondContact O-N 3.34Å; H246-H248 VanDerWaalsContact O-N 3.17Å
249	S	90.2	Very high	89.5	Confident	22 Å²	22	58.2 Å²	58.2	15%	0.154	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	144.5	175.4	-162.6	0	0	0	0	112.3	T205 C206 V247 R251	T205-S249 CarbonylContact C-O 3.56Å; T205-S249 VanDerWaalsContact CA-O 3.29Å; T205-S249 WeakPolarHBondContact CA-O 3.49Å; T205-S249 WeakPolarHBondContact OG1-CB 3.37Å; C206-S249 PolarHBondContact N-O 3.3Å; V247-S249 VanDerWaalsContact C-N 3.25Å; V247-S249 WeakPolarHBondContact CG1-O 3.36Å; V247-S249 PolarHBondContact O-N 3.07Å; S249-R251 PolarHBondContact OG-NH1 3.39Å
250	T	90.9	Very high	89.6	Confident	13 Å²	13	56.4 Å²	56.4	8%	0.08	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.4	170.5	57.3	0	0	0	0	110.4	C206 F208 C238 Q242 V247	C206-T250 HydrophobicContact CB-CG2 4.43Å; C206-T250 CarbonylContact O-C 3.36Å; C206-T250 WeakPolarHBondContact O-CA 3.47Å; F208-T250 HydrophobicContact CE2-CG2 3.92Å; C238-T250 HydrophobicContact CB-CG2 4.4Å; Q242-T250 HydrophobicContact CG-CG2 4.22Å; Q242-T250 PolarHBondContact NE2-OG1 3.17Å; V247-T250 HydrophobicContact CG1-CG2 4.02Å
251	R	92.2	Very high	89.6	Confident	126 Å²	126	58.2 Å²	58.2	48%	0.475	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	122.2	-177.9	-67.8	-66.2	176.2	-104.9	6.7	110.7	C206 I207 F208 S249 I262	C206-R251 PolarHBondContact O-N 2.95Å; I207-R251 CarbonylContact C-O 3.02Å; I207-R251 WeakPolarHBondContact CA-O 3.4Å; I207-R251 HydrophobicContact CG1-CB 4.49Å; F208-R251 PolarHBondContact N-O 3.37Å; S249-R251 PolarHBondContact OG-NH1 3.39Å; R251-I262 HydrophobicContact CB-CD1 4.26Å; R251-I262 HydrophobicContact CG-CD1 4.47Å
252	V	90.7	Very high	89.7	Confident	67 Å²	67	60.1 Å²	60.1	41%	0.406	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.1	177.7	-175.1	0	0	0	0	109.8	F208 T210 I234	F208-V252 HydrophobicContact CB-CG2 4.29Å; T210-V252 HydrophobicContact CG2-CG1 3.6Å; I234-V252 HydrophobicContact CD1-CG1 3.91Å; I234-V252 HydrophobicContact CD1-CG2 4.06Å; I234-V252 HydrophobicContact CG1-CG2 4.29Å
253	T	90.4	Very high	89.7	Confident	6 Å²	6	56 Å²	56	4%	0.037	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	141.8	-176.6	55.6	0	0	0	0	111.3	I207 F208 L209 T210 D258 V259 I262	I207-T253 HydrophobicContact CG2-CG2 4.23Å; F208-T253 PolarHBondContact O-N 2.88Å; F208-T253 VanDerWaalsContact O-O 3.11Å; F208-T253 PolarHBondContact O-OG1 3.44Å; L209-T253 WeakPolarHBondContact CA-O 3.43Å; T210-T253 PolarHBondContact N-O 2.92Å; T210-T253 PolarHBondContact OG1-O 3.3Å; T253-D258 HydrophobicContact CG2-CB 3.88Å; T253-V259 HydrophobicContact CG2-CG2 4.25Å; T253-V259 WeakPolarHBondContact OG1-CG2 3.46Å; T253-I262 HydrophobicContact CG2-CD1 3.62Å
254	S	86.6	Confident	89.6	Confident	44 Å²	44	50.8 Å²	50.8	31%	0.308	25%	0.253	S	S	.	.	S	Bend	trans	-103.5	-7.6	-179.5	41.4	0	0	0	0	114.3	G211	G211-S254 CarbonylContact C-O 3.54Å; G211-S254 WeakPolarHBondContact CA-O 3.18Å
255	N	87.8	Confident	89.6	Confident	64 Å²	64	49.5 Å²	49.5	34%	0.342	25%	0.254	S	S	.	.	S	Bend	trans	-142.1	166.4	180	73.5	53	0	0	0	110.9	H257 D258	N255-H257 VanDerWaalsContact OD1-CA 3.3Å; N255-H257 WeakPolarHBondContact OD1-CA 3.33Å; N255-H257 VanDerWaalsContact OD1-CB 3.23Å; N255-H257 WeakPolarHBondContact OD1-CB 3.25Å; N255-H257 PolarHBondContact OD1-N 2.86Å; N255-D258 PolarHBondContact ND2-OD1 3.1Å; N255-D258 PolarHBondContact ND2-OD2 2.63Å; N255-D258 PolarHBondContact OD1-N 3.06Å; N255-D258 PolarHBondContact OD1-OD1 3.2Å; N255-D258 PolarHBondContact OD1-OD2 2.78Å
256	L	88.5	Confident	89.7	Confident	38 Å²	38	49.6 Å²	49.6	20%	0.199	26%	0.257	C	S	.	.	H	α-helix	trans	-78.2	-18.8	178.3	-63.2	172.4	0	0	0	113.9	M60 S61 L63 L209 V259 A260	M60-L256 HydrophobicContact CE-CD2 4.47Å; S61-L256 WeakPolarHBondContact O-CD1 3.43Å; L63-L256 HydrophobicContact CB-CD1 4.24Å; L63-L256 HydrophobicContact CB-CD2 4.27Å; L63-L256 HydrophobicContact CD1-CD2 4.21Å; L209-L256 HydrophobicContact CD1-CD2 4.19Å; L209-L256 HydrophobicContact CD2-CD2 3.49Å; L209-L256 VanDerWaalsContact CD2-CD2 3.49Å; L256-V259 PolarHBondContact O-N 2.83Å; L256-A260 PolarHBondContact O-N 2.85Å
257	H	89.2	Confident	89.8	Confident	85 Å²	85	42.7 Å²	42.7	39%	0.394	23%	0.225	S	C	.	.	H	α-helix	trans	-69.2	-42.1	179.5	-160.8	94	0	0	0	111.5	K70 N255 A260 M261	K70-H257 WeakPolarHBondContact CE-CE1 3.22Å; K70-H257 VanDerWaalsContact CE-NE2 3.26Å; K70-H257 WeakPolarHBondContact CE-NE2 3.46Å; K70-H257 PolarHBondContact NZ-CE1 3.39Å; K70-H257 VanDerWaalsContact NZ-CE1 3.32Å; K70-H257 PolarHBondContact NZ-NE2 3.45Å; N255-H257 VanDerWaalsContact OD1-CA 3.3Å; N255-H257 WeakPolarHBondContact OD1-CA 3.33Å; N255-H257 VanDerWaalsContact OD1-CB 3.23Å; N255-H257 WeakPolarHBondContact OD1-CB 3.25Å; N255-H257 PolarHBondContact OD1-N 2.86Å; H257-A260 PolarHBondContact O-N 2.77Å; H257-M261 VanDerWaalsContact O-CG 3.32Å; H257-M261 WeakPolarHBondContact O-CG 3.32Å; H257-M261 PolarHBondContact O-N 2.81Å
258	D	89.5	Confident	89.6	Confident	46 Å²	46	48.6 Å²	48.6	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-41.5	175.7	-57.2	-16.9	0	0	0	110.3	T253 N255 M261 I262	T253-D258 HydrophobicContact CG2-CB 3.88Å; N255-D258 PolarHBondContact ND2-OD1 3.1Å; N255-D258 PolarHBondContact ND2-OD2 2.63Å; N255-D258 PolarHBondContact OD1-N 3.06Å; N255-D258 PolarHBondContact OD1-OD1 3.2Å; N255-D258 PolarHBondContact OD1-OD2 2.78Å; D258-M261 PolarHBondContact O-N 2.99Å; D258-I262 WeakPolarHBondContact O-CB 3.3Å; D258-I262 VanDerWaalsContact O-CG1 3.25Å; D258-I262 WeakPolarHBondContact O-CG1 3.26Å; D258-I262 PolarHBondContact O-N 3.47Å
259	V	90.5	Very high	89.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-48.7	173.2	179.6	0	0	0	0	110.4	L63 L163 I207 L209 T253 L256 M261 I262 L263	L63-V259 HydrophobicContact CD1-CG1 4.41Å; L163-V259 HydrophobicContact CD1-CG1 4.02Å; L163-V259 HydrophobicContact CD1-CG2 4.17Å; I207-V259 HydrophobicContact CG2-CG1 4.43Å; I207-V259 HydrophobicContact CG2-CG2 3.94Å; L209-V259 HydrophobicContact CD1-CG2 4.17Å; T253-V259 HydrophobicContact CG2-CG2 4.25Å; T253-V259 WeakPolarHBondContact OG1-CG2 3.46Å; L256-V259 PolarHBondContact O-N 2.83Å; V259-M261 VanDerWaalsContact C-N 3.34Å; V259-M261 PolarHBondContact O-N 3.48Å; V259-I262 PolarHBondContact O-N 3.25Å; V259-L263 HydrophobicContact CG1-CD1 3.82Å; V259-L263 HydrophobicContact CG1-CG 4.44Å; V259-L263 WeakPolarHBondContact O-CB 3.36Å; V259-L263 WeakPolarHBondContact O-CG 3.15Å; V259-L263 PolarHBondContact O-N 3.3Å
260	A	89.4	Confident	89.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-34	176.6	0	0	0	0	0	113.1	L67 K70 L256 H257 N264	L67-A260 HydrophobicContact CD2-CB 4.28Å; K70-A260 HydrophobicContact CG-CB 4.05Å; L256-A260 PolarHBondContact O-N 2.85Å; H257-A260 PolarHBondContact O-N 2.77Å; A260-N264 WeakPolarHBondContact O-CB 3.34Å; A260-N264 PolarHBondContact O-N 2.84Å
261	M	89.4	Confident	89.2	Confident	82 Å²	82	44 Å²	44	40%	0.404	23%	0.23	S	C	.	.	H	α-helix	trans	-68.4	-42.2	173.3	-72.9	-167.4	-57.2	0	0	112.3	K70 H257 D258 V259 A265	K70-M261 HydrophobicContact CD-CG 4.43Å; H257-M261 VanDerWaalsContact O-CG 3.32Å; H257-M261 WeakPolarHBondContact O-CG 3.32Å; H257-M261 PolarHBondContact O-N 2.81Å; D258-M261 PolarHBondContact O-N 2.99Å; V259-M261 VanDerWaalsContact C-N 3.34Å; V259-M261 PolarHBondContact O-N 3.48Å; M261-A265 WeakPolarHBondContact O-CB 3.35Å; M261-A265 PolarHBondContact O-N 3.49Å
262	I	91.4	Very high	88.8	Confident	40 Å²	40	40.2 Å²	40.2	21%	0.205	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-51	176.6	-71	165.2	0	0	0	110.2	I207 R251 T253 D258 V259 N264 A265 I266	I207-I262 HydrophobicContact CD1-CG2 3.79Å; R251-I262 HydrophobicContact CB-CD1 4.26Å; R251-I262 HydrophobicContact CG-CD1 4.47Å; T253-I262 HydrophobicContact CG2-CD1 3.62Å; D258-I262 WeakPolarHBondContact O-CB 3.3Å; D258-I262 VanDerWaalsContact O-CG1 3.25Å; D258-I262 WeakPolarHBondContact O-CG1 3.26Å; D258-I262 PolarHBondContact O-N 3.47Å; V259-I262 PolarHBondContact O-N 3.25Å; I262-N264 VanDerWaalsContact C-N 3.31Å; I262-N264 PolarHBondContact O-N 3.32Å; I262-A265 WeakPolarHBondContact O-CB 3.23Å; I262-A265 PolarHBondContact O-N 2.85Å; I262-A265 VanDerWaalsContact O-N 3.07Å; I262-I266 HydrophobicContact CG2-CD1 3.73Å; I262-I266 HydrophobicContact CG2-CG1 4.39Å; I262-I266 WeakPolarHBondContact O-CG1 3.34Å; I262-I266 PolarHBondContact O-N 2.88Å
263	L	90.9	Very high	88.5	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-38.3	178.9	-72.3	170.5	0	0	0	112	L67 F122 W124 V161 I207 V259 I266 T267	L67-L263 HydrophobicContact CD2-CB 4.36Å; L67-L263 HydrophobicContact CD2-CD1 3.8Å; F122-L263 HydrophobicContact CD2-CD2 3.88Å; F122-L263 HydrophobicContact CE1-CD1 4.2Å; F122-L263 HydrophobicContact CE2-CD1 4.08Å; F122-L263 HydrophobicContact CE2-CD2 4.08Å; F122-L263 HydrophobicContact CG-CD2 4.3Å; F122-L263 HydrophobicContact CZ-CD1 3.89Å; W124-L263 HydrophobicContact CH2-CD2 4.3Å; W124-L263 HydrophobicContact CZ2-CD2 4.36Å; V161-L263 HydrophobicContact CB-CD2 4.26Å; V161-L263 HydrophobicContact CG1-CD2 3.84Å; I207-L263 HydrophobicContact CD1-CD2 4.21Å; I207-L263 HydrophobicContact CD1-CG 4.27Å; V259-L263 HydrophobicContact CG1-CD1 3.82Å; V259-L263 HydrophobicContact CG1-CG 4.44Å; V259-L263 WeakPolarHBondContact O-CB 3.36Å; V259-L263 WeakPolarHBondContact O-CG 3.15Å; V259-L263 PolarHBondContact O-N 3.3Å; L263-I266 PolarHBondContact O-N 3.48Å; L263-T267 WeakPolarHBondContact O-CB 3.3Å; L263-T267 PolarHBondContact O-N 3.36Å; L263-T267 PolarHBondContact O-OG1 2.85Å
264	N	89.3	Confident	87.9	Confident	23 Å²	23	44.3 Å²	44.3	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-39	172.6	179.5	59.5	0	0	0	112.9	Y46 K70 L71 N74 A260 I262 R268	Y46-N264 PolarHBondContact OH-OD1 2.87Å; K70-N264 HydrophobicContact CB-CB 4.28Å; K70-N264 PolarHBondContact O-OD1 2.95Å; L71-N264 HydrophobicContact CD2-CB 3.95Å; N74-N264 PolarHBondContact ND2-ND2 3.13Å; N74-N264 PolarHBondContact ND2-OD1 3.06Å; A260-N264 WeakPolarHBondContact O-CB 3.34Å; A260-N264 PolarHBondContact O-N 2.84Å; I262-N264 VanDerWaalsContact C-N 3.31Å; I262-N264 PolarHBondContact O-N 3.32Å; N264-R268 VanDerWaalsContact O-CB 3.32Å; N264-R268 WeakPolarHBondContact O-CB 3.36Å; N264-R268 PolarHBondContact O-N 3.33Å
265	A	89.2	Confident	87.4	Confident	58 Å²	58	44.5 Å²	44.5	48%	0.479	23%	0.225	S	C	.	.	H	α-helix	trans	-66.3	-39.8	175.1	0	0	0	0	0	112.1	M261 I262 R268 S269	M261-A265 WeakPolarHBondContact O-CB 3.35Å; M261-A265 PolarHBondContact O-N 3.49Å; I262-A265 WeakPolarHBondContact O-CB 3.23Å; I262-A265 PolarHBondContact O-N 2.85Å; I262-A265 VanDerWaalsContact O-N 3.07Å; A265-R268 PolarHBondContact O-N 3Å; A265-S269 WeakPolarHBondContact O-CB 3.29Å; A265-S269 PolarHBondContact O-N 3.44Å
266	I	90.8	Very high	86.8	Confident	36 Å²	36	46.1 Å²	46.1	19%	0.185	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-52.6	173.9	-67.1	169.9	0	0	0	110	W124 V161 I262 L263 R268 S269 L270	W124-I266 HydrophobicContact CH2-CG2 3.63Å; W124-I266 HydrophobicContact CZ2-CB 4.48Å; W124-I266 HydrophobicContact CZ2-CG2 3.85Å; W124-I266 HydrophobicContact CZ3-CG2 4.19Å; V161-I266 HydrophobicContact CG2-CD1 3.95Å; V161-I266 HydrophobicContact CG2-CG2 4.44Å; I262-I266 HydrophobicContact CG2-CD1 3.73Å; I262-I266 HydrophobicContact CG2-CG1 4.39Å; I262-I266 WeakPolarHBondContact O-CG1 3.34Å; I262-I266 PolarHBondContact O-N 2.88Å; L263-I266 PolarHBondContact O-N 3.48Å; I266-R268 PolarHBondContact O-N 3.15Å; I266-S269 WeakPolarHBondContact O-CA 3.2Å; I266-S269 WeakPolarHBondContact O-CB 3.42Å; I266-S269 PolarHBondContact O-N 3.41Å; I266-L270 HydrophobicContact CG2-CD1 3.86Å; I266-L270 HydrophobicContact CG2-CG 4.37Å; I266-L270 WeakPolarHBondContact O-CG 3.32Å; I266-L270 PolarHBondContact O-N 2.83Å
267	T	89.3	Confident	85.9	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-53.1	-41.7	176.6	-55.1	0	0	0	0	111.6	Y46 I49 C51 W124 L263 A271	Y46-T267 HydrophobicContact CD2-CG2 4.36Å; Y46-T267 HydrophobicContact CE2-CG2 3.64Å; I49-T267 HydrophobicContact CG2-CG2 4.33Å; C51-T267 VanDerWaalsContact SG-CG2 3.55Å; W124-T267 PolarHBondContact NE1-OG1 3.01Å; L263-T267 WeakPolarHBondContact O-CB 3.3Å; L263-T267 PolarHBondContact O-N 3.36Å; L263-T267 PolarHBondContact O-OG1 2.85Å; T267-A271 WeakPolarHBondContact O-CB 3.4Å; T267-A271 PolarHBondContact O-N 2.9Å
268	R	86.7	Confident	84.8	Confident	128 Å²	128	47 Å²	47	48%	0.483	24%	0.236	S	C	.	.	H	α-helix	trans	-70.4	-40.5	176	-177.1	175.3	173.2	-176.8	-4.9	113.1	Y46 N264 A265 I266 L270 A271 E272	Y46-R268 HydrophobicContact CD2-CB 4.43Å; Y46-R268 HydrophobicContact CE2-CB 4.2Å; N264-R268 VanDerWaalsContact O-CB 3.32Å; N264-R268 WeakPolarHBondContact O-CB 3.36Å; N264-R268 PolarHBondContact O-N 3.33Å; A265-R268 PolarHBondContact O-N 3Å; I266-R268 PolarHBondContact O-N 3.15Å; R268-L270 VanDerWaalsContact C-N 3.29Å; R268-L270 PolarHBondContact O-N 3.47Å; R268-A271 PolarHBondContact O-N 3.44Å; R268-E272 IonicContact CZ-OE1 3.96Å; R268-E272 VanDerWaalsContact CZ-OE1 3.26Å; R268-E272 IonicContact NE-OE1 3.29Å; R268-E272 PolarHBondContact NE-OE1 3.14Å; R268-E272 IonicContact NH2-OE1 3.56Å; R268-E272 PolarHBondContact NH2-OE1 3.03Å; R268-E272 WeakPolarHBondContact O-CB 3.39Å; R268-E272 WeakPolarHBondContact O-CG 3.34Å; R268-E272 PolarHBondContact O-N 3.31Å
269	S	87.7	Confident	83.6	Confident	68 Å²	68	51.6 Å²	51.6	48%	0.476	25%	0.25	S	C	.	.	H	α-helix	trans	-61.9	-41.7	175.8	-160.6	0	0	0	0	110.9	A265 I266 E272 R273	A265-S269 WeakPolarHBondContact O-CB 3.29Å; A265-S269 PolarHBondContact O-N 3.44Å; I266-S269 WeakPolarHBondContact O-CA 3.2Å; I266-S269 WeakPolarHBondContact O-CB 3.42Å; I266-S269 PolarHBondContact O-N 3.41Å; S269-E272 CarbonylContact O-C 3.56Å; S269-E272 PolarHBondContact O-N 2.97Å; S269-R273 PolarHBondContact O-N 3.28Å
270	L	88.8	Confident	82.1	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-52.9	171.8	-70.4	168.5	0	0	0	111.4	I49 W124 R126 E157 E159 I266 R268 E272 R273	I49-L270 HydrophobicContact CD1-CB 4.19Å; W124-L270 HydrophobicContact CB-CD1 4.33Å; W124-L270 HydrophobicContact CD2-CD1 3.33Å; W124-L270 HydrophobicContact CE3-CD1 3.44Å; W124-L270 VanDerWaalsContact CE3-CD1 3.44Å; W124-L270 HydrophobicContact CG-CD1 3.74Å; W124-L270 HydrophobicContact CH2-CD1 4.4Å; W124-L270 HydrophobicContact CZ2-CD1 4.29Å; W124-L270 HydrophobicContact CZ3-CD1 4Å; R126-L270 PolarHBondContact NH2-O 3.2Å; E157-L270 HydrophobicContact CB-CD2 4.47Å; E157-L270 HydrophobicContact CG-CD2 4.3Å; E157-L270 WeakPolarHBondContact OE2-CD2 3.42Å; E159-L270 HydrophobicContact CG-CD1 4.4Å; E159-L270 HydrophobicContact CG-CD2 3.63Å; I266-L270 HydrophobicContact CG2-CD1 3.86Å; I266-L270 HydrophobicContact CG2-CG 4.37Å; I266-L270 WeakPolarHBondContact O-CG 3.32Å; I266-L270 PolarHBondContact O-N 2.83Å; R268-L270 VanDerWaalsContact C-N 3.29Å; R268-L270 PolarHBondContact O-N 3.47Å; L270-E272 PolarHBondContact O-N 2.95Å; L270-R273 VanDerWaalsContact CD2-CZ 3.47Å; L270-R273 WeakPolarHBondContact O-CB 3.37Å; L270-R273 PolarHBondContact O-N 3.12Å
271	A	85.5	Confident	80.7	Confident	3 Å²	3	65.1 Å²	65.1	3%	0.025	32%	0.317	C	S	.	.	H	α-helix	trans	-50.5	-46.5	176.3	0	0	0	0	0	112	A45 Y46 I49 R126 T267 R268 R273	A45-A271 HydrophobicContact CB-CB 4.34Å; A45-A271 WeakPolarHBondContact CB-O 3Å; Y46-A271 HydrophobicContact CD2-CB 3.98Å; Y46-A271 HydrophobicContact CG-CB 4.48Å; I49-A271 VanDerWaalsContact CD1-CA 3.49Å; I49-A271 HydrophobicContact CD1-CB 4.01Å; R126-A271 PolarHBondContact NH1-O 3.4Å; T267-A271 WeakPolarHBondContact O-CB 3.4Å; T267-A271 PolarHBondContact O-N 2.9Å; R268-A271 PolarHBondContact O-N 3.44Å; A271-R273 VanDerWaalsContact C-N 3.32Å; A271-R273 PolarHBondContact O-N 3.01Å
272	E	83.2	Confident	79.2	Confident	47 Å²	47	67.5 Å²	67.5	22%	0.22	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-4.8	179.1	-63.3	175.4	-177.7	0	0	114.5	R268 S269 L270 F275 K276	R268-E272 IonicContact CZ-OE1 3.96Å; R268-E272 VanDerWaalsContact CZ-OE1 3.26Å; R268-E272 IonicContact NE-OE1 3.29Å; R268-E272 PolarHBondContact NE-OE1 3.14Å; R268-E272 IonicContact NH2-OE1 3.56Å; R268-E272 PolarHBondContact NH2-OE1 3.03Å; R268-E272 WeakPolarHBondContact O-CB 3.39Å; R268-E272 WeakPolarHBondContact O-CG 3.34Å; R268-E272 PolarHBondContact O-N 3.31Å; S269-E272 CarbonylContact O-C 3.56Å; S269-E272 PolarHBondContact O-N 2.97Å; L270-E272 PolarHBondContact O-N 2.95Å; E272-F275 WeakPolarHBondContact O-CB 3.17Å; E272-F275 PolarHBondContact O-N 2.95Å; E272-K276 HydrophobicContact CB-CD 4.14Å; E272-K276 WeakPolarHBondContact O-CG 3.45Å; E272-K276 PolarHBondContact O-N 2.78Å; E272-K276 WeakPolarHBondContact OE2-CE 3.45Å; E272-K276 IonicContact OE2-NZ 3.73Å; E272-K276 PolarHBondContact OE2-NZ 3.07Å
273	R	83.5	Confident	77.4	Confident	69 Å²	69	73 Å²	73	26%	0.26	35%	0.351	S	S	.	.	H	α-helix	trans	-54.8	-61	-175.2	174	175	-86.3	177.7	-14.1	113	E157 E159 S269 L270 A271 F275 K276 Q277	E157-R273 IonicContact OE2-CZ 2.7Å; E157-R273 IonicContact OE2-NH1 2.68Å; E157-R273 PolarHBondContact OE2-NH1 3.35Å; E159-R273 IonicContact OE1-CZ 2.66Å; E159-R273 IonicContact OE1-NH1 3.19Å; E159-R273 PolarHBondContact OE1-NH1 2.89Å; E159-R273 IonicContact OE1-NH2 2.8Å; E159-R273 PolarHBondContact OE1-NH2 3.17Å; S269-R273 PolarHBondContact O-N 3.28Å; L270-R273 VanDerWaalsContact CD2-CZ 3.47Å; L270-R273 WeakPolarHBondContact O-CB 3.37Å; L270-R273 PolarHBondContact O-N 3.12Å; A271-R273 VanDerWaalsContact C-N 3.32Å; A271-R273 PolarHBondContact O-N 3.01Å; R273-F275 PolarHBondContact O-N 2.86Å; R273-K276 PolarHBondContact O-N 3.29Å; R273-Q277 WeakPolarHBondContact O-CB 3.33Å; R273-Q277 PolarHBondContact O-N 3.24Å
274	Q	79.1	Confident	75.8	Confident	91 Å²	91	79.8 Å²	79.8	43%	0.425	38%	0.382	S	S	.	.	H	α-helix	trans	-55.7	-25.2	-180	-69.1	175.4	-48.1	0	0	113.1	R126	R126-Q274 VanDerWaalsContact CD-OE1 3.26Å
275	F	75.1	Confident	73.9	Confident	47 Å²	47	81.8 Å²	81.8	21%	0.206	41%	0.408	C	S	.	.	H	α-helix	trans	-87.4	-16.2	179.7	-59.9	-75.8	0	0	0	113.7	E40 P42 A45 E272 R273 R279	E40-F275 WeakPolarHBondContact O-CE1 3.48Å; E40-F275 VanDerWaalsContact O-CZ 3.22Å; E40-F275 WeakPolarHBondContact O-CZ 3.36Å; P42-F275 HydrophobicContact CB-CB 4.27Å; P42-F275 HydrophobicContact CB-CD1 3.79Å; P42-F275 HydrophobicContact CB-CD2 4.11Å; P42-F275 HydrophobicContact CB-CE1 4.22Å; P42-F275 HydrophobicContact CB-CG 3.73Å; P42-F275 HydrophobicContact CG-CD1 4.19Å; A45-F275 HydrophobicContact CB-CD2 4.09Å; A45-F275 HydrophobicContact CB-CE2 3.46Å; A45-F275 VanDerWaalsContact CB-CE2 3.46Å; A45-F275 HydrophobicContact CB-CZ 4.29Å; E272-F275 WeakPolarHBondContact O-CB 3.17Å; E272-F275 PolarHBondContact O-N 2.95Å; R273-F275 PolarHBondContact O-N 2.86Å; F275-R279 PolarHBondContact O-NE 3.45Å; F275-R279 PolarHBondContact O-NH2 3.38Å
276	K	75.9	Confident	72.3	Confident	98 Å²	98	85.8 Å²	85.8	43%	0.426	42%	0.421	S	S	.	.	H	α-helix	trans	-106.4	-33.5	-179.9	-70.2	169.1	-179.1	164.8	0	112.6	E272 R273 R279	E272-K276 HydrophobicContact CB-CD 4.14Å; E272-K276 WeakPolarHBondContact O-CG 3.45Å; E272-K276 PolarHBondContact O-N 2.78Å; E272-K276 WeakPolarHBondContact OE2-CE 3.45Å; E272-K276 IonicContact OE2-NZ 3.73Å; E272-K276 PolarHBondContact OE2-NZ 3.07Å; R273-K276 PolarHBondContact O-N 3.29Å; K276-R279 VanDerWaalsContact O-CB 3.26Å; K276-R279 WeakPolarHBondContact O-CB 3.12Å; K276-R279 PolarHBondContact O-N 3.24Å
277	Q	70.2	Confident	70.4	Confident	130 Å²	130	86.6 Å²	86.6	61%	0.607	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	138.4	174.1	-166.4	165.8	-3.2	0	0	109.4	R273 R279	R273-Q277 WeakPolarHBondContact O-CB 3.33Å; R273-Q277 PolarHBondContact O-N 3.24Å; Q277-R279 PolarHBondContact O-N 3.11Å; Q277-R279 VanDerWaalsContact O-N 3.11Å
278	G	64.7	Low	68.7	Low	13 Å²	13	93.7 Å²	93.7	13%	0.134	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	6	-169.1	0	0	0	0	0	116.1	E281 R282	G278-E281 VanDerWaalsContact CA-OE2 3.28Å; G278-E281 WeakPolarHBondContact CA-OE2 3.14Å; G278-R282 VanDerWaalsContact O-CG 3.22Å; G278-R282 WeakPolarHBondContact O-CG 3.47Å; G278-R282 PolarHBondContact O-N 3.18Å; G278-R282 PolarHBondContact O-NH1 3.14Å
279	R	65.6	Low	67.2	Low	142 Å²	142	90.9 Å²	90.9	54%	0.536	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-36.7	165.9	-71.8	-162.4	-172	-151.5	-1.3	111.8	F275 K276 Q277 E281 R282 S287	F275-R279 PolarHBondContact O-NE 3.45Å; F275-R279 PolarHBondContact O-NH2 3.38Å; K276-R279 VanDerWaalsContact O-CB 3.26Å; K276-R279 WeakPolarHBondContact O-CB 3.12Å; K276-R279 PolarHBondContact O-N 3.24Å; Q277-R279 PolarHBondContact O-N 3.11Å; Q277-R279 VanDerWaalsContact O-N 3.11Å; R279-E281 VanDerWaalsContact C-N 3.25Å; R279-R282 PolarHBondContact O-N 3.07Å; R279-S287 WeakPolarHBondContact O-CB 3.49Å
280	L	58.8	Low	65.5	Low	138 Å²	138	90.2 Å²	90.2	72%	0.723	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-23.1	178.1	-142.1	78.8	0	0	0	112.3	F288	L280-F288 HydrophobicContact CD1-CD2 4.47Å
281	E	59	Low	63.7	Low	146 Å²	146	95.9 Å²	95.9	68%	0.682	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-5.7	177.7	-60.8	145.3	-151.6	0	0	112.6	G278 R279 D283	G278-E281 VanDerWaalsContact CA-OE2 3.28Å; G278-E281 WeakPolarHBondContact CA-OE2 3.14Å; R279-E281 VanDerWaalsContact C-N 3.25Å; E281-D283 PolarHBondContact O-N 3.19Å
282	R	58.2	Low	61.9	Low	131 Å²	131	100.4 Å²	100.4	49%	0.494	51%	0.507	S	S	.	.			trans	-85	97.9	171.6	-84.2	172.4	-171.4	99.9	-4.9	108.2	G278 R279 E284 S287	G278-R282 VanDerWaalsContact O-CG 3.22Å; G278-R282 WeakPolarHBondContact O-CG 3.47Å; G278-R282 PolarHBondContact O-N 3.18Å; G278-R282 PolarHBondContact O-NH1 3.14Å; R279-R282 PolarHBondContact O-N 3.07Å; R282-E284 PolarHBondContact O-N 3.47Å; R282-S287 WeakPolarHBondContact O-CB 3.39Å; R282-S287 PolarHBondContact O-OG 2.7Å
283	D	53.7	Low	60.3	Low	156 Å²	156	100.6 Å²	100.6	83%	0.834	51%	0.509	S	S	*	.			trans	-67.5	10.9	175	-69.3	-35.1	0	0	0	114.3	E281 G285	E281-D283 PolarHBondContact O-N 3.19Å; D283-G285 VanDerWaalsContact C-N 3.25Å; D283-G285 PolarHBondContact O-N 3.46Å
284	E	57.3	Low	58.7	Low	145 Å²	145	102.9 Å²	102.9	68%	0.678	52%	0.522	S	S	*	.			trans	-56.7	90.6	153.3	-69	174.7	-132.3	0	0	108.6	R282 L286 S287	R282-E284 PolarHBondContact O-N 3.47Å; E284-L286 PolarHBondContact O-N 3.24Å; E284-S287 WeakPolarHBondContact O-CB 3.42Å; E284-S287 PolarHBondContact O-N 3.43Å; E284-S287 PolarHBondContact O-OG 2.88Å
285	G	48.9	Very low	57.3	Low	65 Å²	65	101.4 Å²	101.4	67%	0.67	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	3.1	-164.6	0	0	0	0	0	118.6	D283	D283-G285 VanDerWaalsContact C-N 3.25Å; D283-G285 PolarHBondContact O-N 3.46Å
286	L	55.3	Low	56.2	Low	143 Å²	143	99.9 Å²	99.9	75%	0.749	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-13	165.5	-57.3	175.7	0	0	0	112.8	E284 L289	E284-L286 PolarHBondContact O-N 3.24Å; L286-L289 HydrophobicContact CD2-CD1 4.33Å; L286-L289 WeakPolarHBondContact O-CG 3.2Å
287	S	52.7	Low	55.3	Low	52 Å²	52	96.5 Å²	96.5	36%	0.364	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-34.1	-176.5	64.3	0	0	0	0	113.6	R279 R282 E284	R279-S287 WeakPolarHBondContact O-CB 3.49Å; R282-S287 WeakPolarHBondContact O-CB 3.39Å; R282-S287 PolarHBondContact O-OG 2.7Å; E284-S287 WeakPolarHBondContact O-CB 3.42Å; E284-S287 PolarHBondContact O-N 3.43Å; E284-S287 PolarHBondContact O-OG 2.88Å
288	F	52.7	Low	54.4	Low	151 Å²	151	92.6 Å²	92.6	66%	0.662	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-5.5	-176.4	-173.9	-105.4	0	0	0	114.2	L280 P290	L280-F288 HydrophobicContact CD1-CD2 4.47Å; F288-P290 HydrophobicContact CE1-CG 4.41Å; F288-P290 WeakPolarHBondContact O-CD 3.46Å; F288-P290 WeakPolarHBondContact O-CG 3.11Å
289	L	56.1	Low	53.8	Low	69 Å²	69	95 Å²	95	36%	0.361	51%	0.511	S	S	.	.			trans	-53.6	107.2	-177.3	-64	-179.3	0	0	0	110.9	L286 I293	L286-L289 HydrophobicContact CD2-CD1 4.33Å; L286-L289 WeakPolarHBondContact O-CG 3.2Å; L289-I293 HydrophobicContact CD2-CD1 3.72Å; L289-I293 HydrophobicContact CD2-CG2 4.35Å
290	P	52.3	Low	53	Low	54 Å²	54	89.1 Å²	89.1	35%	0.351	49%	0.491	S	S	.	.			trans	-72.1	163.6	-170.9	-17.2	31.6	0	0	0	110.6	F288 T292 I293	F288-P290 HydrophobicContact CE1-CG 4.41Å; F288-P290 WeakPolarHBondContact O-CD 3.46Å; F288-P290 WeakPolarHBondContact O-CG 3.11Å; P290-T292 PolarHBondContact O-N 2.92Å; P290-I293 PolarHBondContact O-N 3.11Å
291	N	50.8	Low	52.3	Low	124 Å²	124	83 Å²	83	66%	0.663	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-5	176.2	-77.2	-59	0	0	0	114.5	K295	N291-K295 WeakPolarHBondContact O-CD 3.45Å; N291-K295 WeakPolarHBondContact O-CE 3.32Å; N291-K295 WeakPolarHBondContact O-CG 3.36Å
292	T	47.5	Very low	51.5	Low	97 Å²	97	80.3 Å²	80.3	60%	0.595	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-44.8	166.6	48.6	0	0	0	0	112.4	P290 H294 K295 G296	P290-T292 PolarHBondContact O-N 2.92Å; T292-H294 VanDerWaalsContact C-N 3.31Å; T292-H294 PolarHBondContact O-N 3.15Å; T292-K295 WeakPolarHBondContact O-CB 3.21Å; T292-K295 PolarHBondContact O-N 2.91Å; T292-G296 PolarHBondContact O-N 2.83Å
293	I	49.7	Very low	50.8	Low	51 Å²	51	83.1 Å²	83.1	26%	0.262	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-64.3	-38.2	179.8	-63.8	179.3	0	0	0	110.5	L289 P290 K295 G296 Q343	L289-I293 HydrophobicContact CD2-CD1 3.72Å; L289-I293 HydrophobicContact CD2-CG2 4.35Å; P290-I293 PolarHBondContact O-N 3.11Å; I293-K295 PolarHBondContact O-N 3.08Å; I293-G296 PolarHBondContact O-N 3.25Å; I293-Q343 HydrophobicContact CG2-CG 4.28Å
294	H	48.8	Very low	50.5	Low	118 Å²	118	76 Å²	76	55%	0.546	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-60.8	-13.1	171.8	-71	-27.1	0	0	0	115.1	T292	T292-H294 VanDerWaalsContact C-N 3.31Å; T292-H294 PolarHBondContact O-N 3.15Å
295	K	49.8	Very low	50	Low	60 Å²	60	75.5 Å²	75.5	26%	0.261	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-102	-21	178.7	-64.8	173.9	-168.4	-169.9	0	113.4	V13 N291 T292 I293	V13-K295 WeakPolarHBondContact O-CD 3.38Å; V13-K295 WeakPolarHBondContact O-CE 3.34Å; V13-K295 PolarHBondContact O-NZ 3.15Å; N291-K295 WeakPolarHBondContact O-CD 3.45Å; N291-K295 WeakPolarHBondContact O-CE 3.32Å; N291-K295 WeakPolarHBondContact O-CG 3.36Å; T292-K295 WeakPolarHBondContact O-CB 3.21Å; T292-K295 PolarHBondContact O-N 2.91Å; I293-K295 PolarHBondContact O-N 3.08Å
296	G	52.6	Low	50.4	Low	15 Å²	15	73 Å²	73	16%	0.155	40%	0.397	C	S	.	.			trans	56	-147.1	-168.6	0	0	0	0	0	111.6	T292 I293 S298	T292-G296 PolarHBondContact O-N 2.83Å; I293-G296 PolarHBondContact O-N 3.25Å; G296-S298 PolarHBondContact O-N 3.18Å
297	L	56.2	Low	50.4	Low	26 Å²	26	67.6 Å²	67.6	14%	0.136	37%	0.371	C	S	.	.	S	Bend	trans	-66.2	118.6	167.8	-74.1	177.5	0	0	0	110.9	G299 C300 A352	L297-G299 PolarHBondContact O-N 2.87Å; L297-C300 WeakPolarHBondContact O-CB 3.06Å; L297-C300 PolarHBondContact O-N 2.83Å; L297-A352 HydrophobicContact CD1-CB 3.45Å; L297-A352 VanDerWaalsContact CD1-CB 3.45Å
298	S	52.7	Low	50.9	Low	48 Å²	48	66.5 Å²	66.5	34%	0.336	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	133.1	167.5	-171.9	0	0	0	0	110.5	S12 G296	S12-S298 VanDerWaalsContact CA-OG 3.28Å; S12-S298 WeakPolarHBondContact CA-OG 3.35Å; S12-S298 PolarHBondContact N-OG 3.04Å; S12-S298 WeakPolarHBondContact O-CB 3.42Å; S12-S298 PolarHBondContact O-OG 3.24Å; S12-S298 PolarHBondContact OG-OG 3.33Å; S12-S298 VanDerWaalsContact OG-OG 3.09Å; G296-S298 PolarHBondContact O-N 3.18Å
299	G	50.6	Low	51.6	Low	65 Å²	65	68.3 Å²	68.3	67%	0.67	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	-29.3	-172.9	0	0	0	0	0	114.5	L297 A301	L297-G299 PolarHBondContact O-N 2.87Å; G299-A301 PolarHBondContact O-N 3.07Å
300	C	48.4	Very low	52.1	Low	18 Å²	18	67.1 Å²	67.1	12%	0.122	38%	0.375	C	S	.	.	S	Bend	trans	-73.2	-11.6	174.8	-63.8	0	0	0	0	113.2	L297 L338	L297-C300 WeakPolarHBondContact O-CB 3.06Å; L297-C300 PolarHBondContact O-N 2.83Å; C300-L338 VanDerWaalsContact SG-CB 3.56Å
301	A	45	Very low	52.9	Low	8 Å²	8	66.7 Å²	66.7	7%	0.066	37%	0.372	C	S	.	.	S	Bend	trans	-128.4	118.5	-166.4	0	0	0	0	0	112.8	G299 R303 G304 G306	G299-A301 PolarHBondContact O-N 3.07Å; A301-R303 PolarHBondContact O-N 2.95Å; A301-R303 VanDerWaalsContact O-N 3.14Å; A301-G304 PolarHBondContact O-N 3.39Å; A301-G306 WeakPolarHBondContact CA-O 3.02Å; A301-G306 WeakPolarHBondContact CB-O 3.36Å
302	S	41.4	Very low	53.4	Low	90 Å²	90	67.1 Å²	67.1	63%	0.629	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-64.6	118.3	169.8	63.8	0	0	0	0	109.5	G304	S302-G304 PolarHBondContact O-N 2.76Å
303	R	44.6	Very low	53.9	Low	191 Å²	191	65.3 Å²	65.3	72%	0.721	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	52.1	37.7	-174.5	-67.4	177.3	165.9	154.4	-5.2	113.6	V14 A301 R305	V14-R303 CarbonylContact C-O 3.37Å; V14-R303 CarbonylContact O-C 3.59Å; A301-R303 PolarHBondContact O-N 2.95Å; A301-R303 VanDerWaalsContact O-N 3.14Å; R303-R305 VanDerWaalsContact C-N 3.3Å; R303-R305 WeakPolarHBondContact O-CG 3.13Å; R303-R305 PolarHBondContact O-N 3.24Å
304	G	47.5	Very low	54.2	Low	5 Å²	5	69.6 Å²	69.6	5%	0.052	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	57.1	39	171.2	0	0	0	0	0	114.5	A301 S302	A301-G304 PolarHBondContact O-N 3.39Å; S302-G304 PolarHBondContact O-N 2.76Å
305	R	47.4	Very low	54.2	Low	136 Å²	136	68.1 Å²	68.1	51%	0.513	38%	0.38	S	S	.	.	S	Bend	trans	-110.9	30.9	178.6	-64.2	-177.5	176.9	-167.9	1.4	112.5	P15 C16 R303	P15-R305 HydrophobicContact CB-CG 3.88Å; P15-R305 PolarHBondContact O-NE 3.19Å; P15-R305 PolarHBondContact O-NH2 3.42Å; C16-R305 VanDerWaalsContact SG-CZ 3.58Å; R303-R305 VanDerWaalsContact C-N 3.3Å; R303-R305 WeakPolarHBondContact O-CG 3.13Å; R303-R305 PolarHBondContact O-N 3.24Å
306	G	55.5	Low	54.3	Low	13 Å²	13	72.8 Å²	72.8	13%	0.134	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	-164.7	-163	0	0	0	0	0	112.3	A301 G308	A301-G306 WeakPolarHBondContact CA-O 3.02Å; A301-G306 WeakPolarHBondContact CB-O 3.36Å; G306-G308 PolarHBondContact O-N 3.41Å
307	P	56.7	Low	54.2	Low	29 Å²	29	76.8 Å²	76.8	19%	0.188	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	7.3	-168.1	27.3	-37.2	0	0	0	116.4	R335 V336	P307-R335 HydrophobicContact CB-CB 3.91Å; P307-V336 HydrophobicContact CB-CG2 3.89Å; P307-V336 HydrophobicContact CG-CB 4.22Å; P307-V336 HydrophobicContact CG-CG2 3.52Å
308	G	62.1	Low	54.1	Low	28 Å²	28	80 Å²	80	29%	0.289	45%	0.45	S	S	.	.			trans	84.9	173.8	-169.9	0	0	0	0	0	112.1	G306 W332	G306-G308 PolarHBondContact O-N 3.41Å; G308-W332 PolarHBondContact O-NE1 3.05Å
309	K	67.2	Low	54.4	Low	190 Å²	190	86.9 Å²	86.9	83%	0.826	48%	0.477	S	S	*	.	S	Bend	trans	-61.2	144.9	167.3	-68.7	-174	174.4	-171.6	0	108.9	W332	K309-W332 PolarHBondContact O-NE1 3.14Å
310	A	68.4	Low	54.5	Low	44 Å²	44	87.3 Å²	87.3	36%	0.364	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-54.1	143.3	164.9	0	0	0	0	0	109.9	I312 W332	A310-I312 PolarHBondContact O-N 2.8Å; A310-W332 HydrophobicContact CB-CD2 4.14Å; A310-W332 HydrophobicContact CB-CE3 4.25Å; A310-W332 HydrophobicContact CB-CH2 3.86Å; A310-W332 HydrophobicContact CB-CZ2 3.72Å; A310-W332 HydrophobicContact CB-CZ3 4.12Å
311	P	67.2	Low	55.2	Low	45 Å²	45	88.6 Å²	88.6	29%	0.292	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-51.1	125.6	163.4	-23.1	32.6	0	0	0	109	T313 N328 L329 W332	P311-T313 PolarHBondContact O-N 3.23Å; P311-N328 HydrophobicContact CG-CB 4.3Å; P311-L329 HydrophobicContact CB-CD2 3.96Å; P311-L329 HydrophobicContact CB-CG 4.25Å; P311-L329 HydrophobicContact CG-CD2 3.93Å; P311-L329 HydrophobicContact CG-CG 4.23Å; P311-W332 HydrophobicContact CG-CB 4.19Å
312	I	62.7	Low	56.3	Low	133 Å²	133	91.9 Å²	91.9	68%	0.682	50%	0.495	S	S	*	.			trans	-76.6	109.4	177.9	-59.7	174.7	0	0	0	106.8	A310 I314	A310-I312 PolarHBondContact O-N 2.8Å; I312-I314 PolarHBondContact O-N 3.2Å
313	T	57.8	Low	57.9	Low	58 Å²	58	91 Å²	91	36%	0.356	49%	0.492	S	S	.	.			trans	-65.3	109.1	162.1	52.9	0	0	0	0	106.7	P311 N315 L321 L329	P311-T313 PolarHBondContact O-N 3.23Å; T313-N315 CarbonylContact C-O 3.49Å; T313-N315 WeakPolarHBondContact CB-O 3.38Å; T313-N315 PolarHBondContact O-N 3.24Å; T313-L321 HydrophobicContact CG2-CD2 3.82Å; T313-L329 HydrophobicContact CG2-CD1 4.1Å
314	I	55.5	Low	59.5	Low	142 Å²	142	87.3 Å²	87.3	73%	0.728	49%	0.487	S	S	*	.	S	Bend	trans	-68	-29.6	-170.8	-67.5	177	0	0	0	111	I312	I312-I314 PolarHBondContact O-N 3.2Å
315	N	48.7	Very low	60.8	Low	86 Å²	86	90.3 Å²	90.3	46%	0.46	50%	0.5	S	S	.	.	S	Bend	trans	-105.1	155.8	164.9	-58.7	-1.5	0	0	0	109.1	T313 D317	T313-N315 CarbonylContact C-O 3.49Å; T313-N315 WeakPolarHBondContact CB-O 3.38Å; T313-N315 PolarHBondContact O-N 3.24Å; N315-D317 HydrophobicContact CB-CB 4.33Å; N315-D317 WeakPolarHBondContact CB-OD2 3.38Å; N315-D317 PolarHBondContact O-N 3.14Å
316	N	52.7	Low	62.3	Low	159 Å²	159	88.2 Å²	88.2	85%	0.85	50%	0.496	S	S	*	.	S	Bend	trans	-76.8	-7.2	169.8	-74.9	-26.3	0	0	0	112.5	S318	N316-S318 PolarHBondContact O-N 3.47Å; N316-S318 VanDerWaalsContact O-N 3.11Å
317	D	49.6	Very low	63.5	Low	98 Å²	98	93.2 Å²	93.2	52%	0.524	52%	0.516	S	S	.	.			trans	-77.4	97.2	-175.2	-45.3	-48.8	0	0	0	109.6	N315 E319 S320	N315-D317 HydrophobicContact CB-CB 4.33Å; N315-D317 WeakPolarHBondContact CB-OD2 3.38Å; N315-D317 PolarHBondContact O-N 3.14Å; D317-E319 PolarHBondContact O-N 3.26Å; D317-E319 VanDerWaalsContact O-N 3.07Å; D317-S320 PolarHBondContact O-N 3.07Å
318	S	55.5	Low	64.5	Low	93 Å²	93	95.9 Å²	95.9	65%	0.65	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-61.2	-15.5	179.6	46.9	0	0	0	0	114	N316	N316-S318 PolarHBondContact O-N 3.47Å; N316-S318 VanDerWaalsContact O-N 3.11Å
319	E	57.2	Low	65.3	Low	194 Å²	194	96.5 Å²	96.5	91%	0.907	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-83.1	-13.8	-177.8	-57.9	-175.4	153.8	0	0	113.5	D317	D317-E319 PolarHBondContact O-N 3.26Å; D317-E319 VanDerWaalsContact O-N 3.07Å
320	S	54.7	Low	65.9	Low	73 Å²	73	93.8 Å²	93.8	51%	0.51	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-106.6	26.5	-179.3	87.5	0	0	0	0	113.7	D317 T322	D317-S320 PolarHBondContact O-N 3.07Å; S320-T322 PolarHBondContact O-N 3.48Å
321	L	61.4	Low	66.4	Low	45 Å²	45	95.3 Å²	95.3	24%	0.236	52%	0.517	C	S	.	.			trans	-74.4	123.2	175.6	-66.6	173.1	0	0	0	110.2	T313 Q325 E326 L329	T313-L321 HydrophobicContact CG2-CD2 3.82Å; L321-Q325 HydrophobicContact CD2-CB 4.14Å; L321-E326 HydrophobicContact CB-CG 3.65Å; L321-E326 HydrophobicContact CD1-CG 4.26Å; L321-L329 HydrophobicContact CD1-CD1 3.86Å; L321-L329 HydrophobicContact CD2-CD1 4.04Å
322	T	69.6	Low	67	Low	78 Å²	78	96.6 Å²	96.6	48%	0.479	52%	0.516	S	S	.	.			trans	-66.9	148	166.8	60.9	0	0	0	0	109.7	S320 N324 Q325 E326	S320-T322 PolarHBondContact O-N 3.48Å; T322-N324 PolarHBondContact O-N 2.73Å; T322-Q325 WeakPolarHBondContact O-CA 3.33Å; T322-Q325 WeakPolarHBondContact O-CB 3.39Å; T322-Q325 PolarHBondContact O-N 2.72Å; T322-Q325 VanDerWaalsContact OG1-CD 3.29Å; T322-Q325 WeakPolarHBondContact OG1-CG 3.24Å; T322-Q325 PolarHBondContact OG1-N 3.3Å; T322-Q325 PolarHBondContact OG1-OE1 2.92Å; T322-E326 PolarHBondContact O-N 2.91Å
323	A	75.3	Confident	67.9	Low	70 Å²	70	92.4 Å²	92.4	58%	0.579	50%	0.498	S	S	*	.	H	α-helix	trans	-52.8	-31.7	179.3	0	0	0	0	0	113.4	E326 Q327	A323-E326 PolarHBondContact O-N 3.46Å; A323-Q327 WeakPolarHBondContact O-CB 2.91Å; A323-Q327 PolarHBondContact O-N 2.91Å
324	N	76.9	Confident	69	Low	115 Å²	115	91.8 Å²	91.8	62%	0.615	50%	0.496	S	S	*	.	H	α-helix	trans	-66.1	-37.8	172.4	-74	-31.3	0	0	0	112.9	T322 N328	T322-N324 PolarHBondContact O-N 2.73Å; N324-N328 WeakPolarHBondContact O-CB 3.37Å; N324-N328 PolarHBondContact O-N 3.4Å; N324-N328 VanDerWaalsContact O-N 3.1Å; N324-N328 PolarHBondContact O-ND2 2.63Å
325	Q	75.9	Confident	70.1	Confident	67 Å²	67	90.8 Å²	90.8	31%	0.313	48%	0.483	S	S	.	.	H	α-helix	trans	-70.3	-42.5	174.6	-72.6	161.2	-48.9	0	0	111.2	L321 T322 N328 L329	L321-Q325 HydrophobicContact CD2-CB 4.14Å; T322-Q325 WeakPolarHBondContact O-CA 3.33Å; T322-Q325 WeakPolarHBondContact O-CB 3.39Å; T322-Q325 PolarHBondContact O-N 2.72Å; T322-Q325 VanDerWaalsContact OG1-CD 3.29Å; T322-Q325 WeakPolarHBondContact OG1-CG 3.24Å; T322-Q325 PolarHBondContact OG1-N 3.3Å; T322-Q325 PolarHBondContact OG1-OE1 2.92Å; Q325-N328 PolarHBondContact O-N 3.04Å; Q325-L329 WeakPolarHBondContact O-CG 3.17Å; Q325-L329 PolarHBondContact O-N 3.2Å
326	E	77.8	Confident	71.7	Confident	92 Å²	92	88.2 Å²	88.2	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-58.2	-50.6	174	-60.9	-173.8	127.2	0	0	111.3	L321 T322 A323 N328 L329 H330	L321-E326 HydrophobicContact CB-CG 3.65Å; L321-E326 HydrophobicContact CD1-CG 4.26Å; T322-E326 PolarHBondContact O-N 2.91Å; A323-E326 PolarHBondContact O-N 3.46Å; E326-N328 VanDerWaalsContact C-N 3.27Å; E326-N328 PolarHBondContact O-N 3.3Å; E326-L329 WeakPolarHBondContact O-CB 3.1Å; E326-L329 PolarHBondContact O-N 3.5Å; E326-H330 PolarHBondContact O-CD2 2.91Å; E326-H330 PolarHBondContact O-N 3.11Å
327	Q	80.7	Confident	73.4	Confident	118 Å²	118	80.9 Å²	80.9	55%	0.551	43%	0.431	S	S	*	.	H	α-helix	trans	-58.7	-39.4	177.4	-167.2	-177.2	29.2	0	0	111.7	A323 H330 L331	A323-Q327 WeakPolarHBondContact O-CB 2.91Å; A323-Q327 PolarHBondContact O-N 2.91Å; Q327-H330 PolarHBondContact O-N 3.27Å; Q327-L331 HydrophobicContact CG-CD1 4.2Å; Q327-L331 WeakPolarHBondContact O-CB 3.35Å; Q327-L331 WeakPolarHBondContact O-CG 3.49Å; Q327-L331 PolarHBondContact O-N 3.02Å
328	N	78.1	Confident	75	Confident	85 Å²	85	77.4 Å²	77.4	46%	0.455	41%	0.412	S	S	.	.	H	α-helix	trans	-67.8	-35.3	174.9	-84.7	-69.4	0	0	0	113.1	P311 N324 Q325 E326 W332	P311-N328 HydrophobicContact CG-CB 4.3Å; N324-N328 WeakPolarHBondContact O-CB 3.37Å; N324-N328 PolarHBondContact O-N 3.4Å; N324-N328 VanDerWaalsContact O-N 3.1Å; N324-N328 PolarHBondContact O-ND2 2.63Å; Q325-N328 PolarHBondContact O-N 3.04Å; E326-N328 VanDerWaalsContact C-N 3.27Å; E326-N328 PolarHBondContact O-N 3.3Å; N328-W332 WeakPolarHBondContact O-CB 3.49Å; N328-W332 PolarHBondContact O-N 2.93Å
329	L	79.6	Confident	76.1	Confident	42 Å²	42	73.3 Å²	73.3	22%	0.22	38%	0.384	C	S	.	.	H	α-helix	trans	-69.7	-40.3	174.5	-74.3	162.3	0	0	0	111.9	P311 T313 L321 Q325 E326 W332 S333	P311-L329 HydrophobicContact CB-CD2 3.96Å; P311-L329 HydrophobicContact CB-CG 4.25Å; P311-L329 HydrophobicContact CG-CD2 3.93Å; P311-L329 HydrophobicContact CG-CG 4.23Å; T313-L329 HydrophobicContact CG2-CD1 4.1Å; L321-L329 HydrophobicContact CD1-CD1 3.86Å; L321-L329 HydrophobicContact CD2-CD1 4.04Å; Q325-L329 WeakPolarHBondContact O-CG 3.17Å; Q325-L329 PolarHBondContact O-N 3.2Å; E326-L329 WeakPolarHBondContact O-CB 3.1Å; E326-L329 PolarHBondContact O-N 3.5Å; L329-W332 PolarHBondContact O-N 2.95Å; L329-S333 WeakPolarHBondContact O-CB 3.39Å; L329-S333 PolarHBondContact O-N 2.84Å; L329-S333 PolarHBondContact O-OG 2.93Å
330	H	79.8	Confident	77.3	Confident	132 Å²	132	68 Å²	68	61%	0.611	36%	0.359	S	S	*	.	H	α-helix	trans	-64.3	-44	172	-77.5	-66.9	0	0	0	112.2	E326 Q327 W332 S333 S334	E326-H330 PolarHBondContact O-CD2 2.91Å; E326-H330 PolarHBondContact O-N 3.11Å; Q327-H330 PolarHBondContact O-N 3.27Å; H330-W332 PolarHBondContact O-N 3.24Å; H330-S333 WeakPolarHBondContact CA-OG 3.44Å; H330-S333 PolarHBondContact O-N 3.48Å; H330-S333 PolarHBondContact O-OG 3.31Å; H330-S333 VanDerWaalsContact O-OG 3.13Å; H330-S334 VanDerWaalsContact O-CB 3.25Å; H330-S334 WeakPolarHBondContact O-CB 3.39Å; H330-S334 PolarHBondContact O-N 2.93Å
331	L	78.8	Confident	78.7	Confident	77 Å²	77	64.5 Å²	64.5	40%	0.403	34%	0.335	S	S	.	.	H	α-helix	trans	-65.6	-36.2	175	-72.7	170.1	0	0	0	112.5	Q327 R335	Q327-L331 HydrophobicContact CG-CD1 4.2Å; Q327-L331 WeakPolarHBondContact O-CB 3.35Å; Q327-L331 WeakPolarHBondContact O-CG 3.49Å; Q327-L331 PolarHBondContact O-N 3.02Å; L331-R335 WeakPolarHBondContact O-CD 3.31Å; L331-R335 VanDerWaalsContact O-CG 3.24Å; L331-R335 WeakPolarHBondContact O-CG 3.42Å; L331-R335 PolarHBondContact O-N 3.36Å
332	W	80	Confident	79.6	Confident	71 Å²	71	63.2 Å²	63.2	27%	0.269	33%	0.332	S	S	.	.	H	α-helix	trans	-68.9	-48.9	174.6	177.8	80.1	0	0	0	111.8	G308 K309 A310 P311 N328 L329 H330 S334 R335 V336	G308-W332 PolarHBondContact O-NE1 3.05Å; K309-W332 PolarHBondContact O-NE1 3.14Å; A310-W332 HydrophobicContact CB-CD2 4.14Å; A310-W332 HydrophobicContact CB-CE3 4.25Å; A310-W332 HydrophobicContact CB-CH2 3.86Å; A310-W332 HydrophobicContact CB-CZ2 3.72Å; A310-W332 HydrophobicContact CB-CZ3 4.12Å; P311-W332 HydrophobicContact CG-CB 4.19Å; N328-W332 WeakPolarHBondContact O-CB 3.49Å; N328-W332 PolarHBondContact O-N 2.93Å; L329-W332 PolarHBondContact O-N 2.95Å; H330-W332 PolarHBondContact O-N 3.24Å; W332-S334 PolarHBondContact O-N 3.05Å; W332-R335 CarbonylContact O-C 3.58Å; W332-R335 WeakPolarHBondContact O-CB 3.28Å; W332-R335 PolarHBondContact O-N 3.01Å; W332-R335 VanDerWaalsContact O-N 3.1Å; W332-V336 HydrophobicContact CD2-CG2 3.83Å; W332-V336 HydrophobicContact CE3-CG2 4.02Å; W332-V336 HydrophobicContact CH2-CG2 3.74Å; W332-V336 HydrophobicContact CZ2-CG2 3.52Å; W332-V336 HydrophobicContact CZ3-CG2 3.98Å; W332-V336 WeakPolarHBondContact O-CG2 3.4Å; W332-V336 PolarHBondContact O-N 3.04Å
333	S	81.3	Confident	80	Confident	46 Å²	46	63.6 Å²	63.6	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-36.1	179.6	52.1	0	0	0	0	112.9	L329 H330 R335 V336 W337	L329-S333 WeakPolarHBondContact O-CB 3.39Å; L329-S333 PolarHBondContact O-N 2.84Å; L329-S333 PolarHBondContact O-OG 2.93Å; H330-S333 WeakPolarHBondContact CA-OG 3.44Å; H330-S333 PolarHBondContact O-N 3.48Å; H330-S333 PolarHBondContact O-OG 3.31Å; H330-S333 VanDerWaalsContact O-OG 3.13Å; S333-R335 PolarHBondContact O-N 3.36Å; S333-V336 WeakPolarHBondContact O-CB 3.12Å; S333-V336 PolarHBondContact O-N 3.15Å; S333-W337 PolarHBondContact O-N 3.09Å
334	S	80.7	Confident	80.1	Confident	44 Å²	44	65.3 Å²	65.3	31%	0.308	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-43.2	169.7	178.9	0	0	0	0	112.1	H330 W332 W337 L338	H330-S334 VanDerWaalsContact O-CB 3.25Å; H330-S334 WeakPolarHBondContact O-CB 3.39Å; H330-S334 PolarHBondContact O-N 2.93Å; W332-S334 PolarHBondContact O-N 3.05Å; S334-W337 PolarHBondContact O-N 2.92Å; S334-L338 WeakPolarHBondContact O-CG 3.43Å; S334-L338 PolarHBondContact O-N 3.23Å
335	R	78.7	Confident	80.1	Confident	121 Å²	121	71.2 Å²	71.2	46%	0.457	33%	0.334	S	S	.	.	H	α-helix	trans	-66.5	-35.2	173.8	-70.2	167.5	-174.6	163.3	4	112.9	P307 L331 W332 S333 S339	P307-R335 HydrophobicContact CB-CB 3.91Å; L331-R335 WeakPolarHBondContact O-CD 3.31Å; L331-R335 VanDerWaalsContact O-CG 3.24Å; L331-R335 WeakPolarHBondContact O-CG 3.42Å; L331-R335 PolarHBondContact O-N 3.36Å; W332-R335 CarbonylContact O-C 3.58Å; W332-R335 WeakPolarHBondContact O-CB 3.28Å; W332-R335 PolarHBondContact O-N 3.01Å; W332-R335 VanDerWaalsContact O-N 3.1Å; S333-R335 PolarHBondContact O-N 3.36Å; R335-S339 WeakPolarHBondContact O-CB 3.24Å; R335-S339 PolarHBondContact O-N 3.5Å
336	V	82	Confident	80.2	Confident	32 Å²	32	70.7 Å²	70.7	19%	0.194	35%	0.346	C	S	.	.	H	α-helix	trans	-60	-49.9	171.7	175.5	0	0	0	0	109.6	P307 W332 S333 S339 Q340	P307-V336 HydrophobicContact CB-CG2 3.89Å; P307-V336 HydrophobicContact CG-CB 4.22Å; P307-V336 HydrophobicContact CG-CG2 3.52Å; W332-V336 HydrophobicContact CD2-CG2 3.83Å; W332-V336 HydrophobicContact CE3-CG2 4.02Å; W332-V336 HydrophobicContact CH2-CG2 3.74Å; W332-V336 HydrophobicContact CZ2-CG2 3.52Å; W332-V336 HydrophobicContact CZ3-CG2 3.98Å; W332-V336 WeakPolarHBondContact O-CG2 3.4Å; W332-V336 PolarHBondContact O-N 3.04Å; S333-V336 WeakPolarHBondContact O-CB 3.12Å; S333-V336 PolarHBondContact O-N 3.15Å; V336-S339 CarbonylContact O-C 3.47Å; V336-S339 PolarHBondContact O-N 2.87Å; V336-S339 VanDerWaalsContact O-N 3.15Å; V336-Q340 HydrophobicContact CG1-CG 4.4Å; V336-Q340 WeakPolarHBondContact O-CG 3.42Å; V336-Q340 PolarHBondContact O-N 3.22Å
337	W	87.2	Confident	80.3	Confident	5 Å²	5	66.8 Å²	66.8	2%	0.019	33%	0.328	C	S	.	.	H	α-helix	trans	-64.1	-47.3	-177.5	-178.9	-142.1	0	0	0	112.4	S333 S334 S339 Q340 L341 I355 T356 Y359 P360 A362 F365 F432	S333-W337 PolarHBondContact O-N 3.09Å; S334-W337 PolarHBondContact O-N 2.92Å; W337-S339 VanDerWaalsContact C-N 3.3Å; W337-S339 PolarHBondContact O-N 3.1Å; W337-Q340 HydrophobicContact CE3-CB 4.31Å; W337-Q340 PolarHBondContact O-N 3.27Å; W337-Q340 VanDerWaalsContact O-N 3.14Å; W337-L341 HydrophobicContact CD2-CD1 4.15Å; W337-L341 HydrophobicContact CD2-CG 4.25Å; W337-L341 HydrophobicContact CE3-CG 4.19Å; W337-L341 HydrophobicContact CH2-CD2 3.79Å; W337-L341 HydrophobicContact CH2-CG 4.16Å; W337-L341 HydrophobicContact CZ2-CD1 4.06Å; W337-L341 HydrophobicContact CZ2-CD2 4.06Å; W337-L341 HydrophobicContact CZ2-CG 4.22Å; W337-L341 HydrophobicContact CZ3-CD2 4.12Å; W337-L341 HydrophobicContact CZ3-CG 4.16Å; W337-L341 WeakPolarHBondContact O-CG 3.33Å; W337-L341 PolarHBondContact O-N 3.49Å; W337-I355 HydrophobicContact CZ2-CG2 4.29Å; W337-T356 VanDerWaalsContact CD1-CG2 3.41Å; W337-T356 HydrophobicContact CG-CG2 4.18Å; W337-Y359 PolarHBondContact NE1-O 3.44Å; W337-P360 VanDerWaalsContact CD1-O 3.28Å; W337-A362 HydrophobicContact CD2-CB 4.26Å; W337-A362 HydrophobicContact CE3-CB 3.69Å; W337-A362 HydrophobicContact CH2-CB 4.03Å; W337-A362 HydrophobicContact CZ3-CB 3.56Å; W337-F365 HydrophobicContact CH2-CB 4.23Å; W337-F365 HydrophobicContact CH2-CG 4.47Å; W337-F365 HydrophobicContact CZ2-CB 3.89Å; W337-F365 HydrophobicContact CZ2-CG 4.33Å; W337-F432 HydrophobicContact CH2-CE1 4.02Å; W337-F432 AromaticContact CH2-CE2 3.99Å; W337-F432 HydrophobicContact CH2-CE2 3.99Å; W337-F432 AromaticContact CH2-CZ 3.5Å; W337-F432 HydrophobicContact CH2-CZ 3.5Å; W337-F432 AromaticContact CZ3-CE1 3.91Å; W337-F432 HydrophobicContact CZ3-CE1 3.91Å; W337-F432 HydrophobicContact CZ3-CE2 4.4Å; W337-F432 AromaticContact CZ3-CZ 3.51Å; W337-F432 HydrophobicContact CZ3-CZ 3.51Å
338	L	83.8	Confident	80.2	Confident	26 Å²	26	63.4 Å²	63.4	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-56.5	-41.8	170.3	-75.2	164.2	0	0	0	112.3	C300 S334 Q340 L341 G342 A352 T356	C300-L338 VanDerWaalsContact SG-CB 3.56Å; S334-L338 WeakPolarHBondContact O-CG 3.43Å; S334-L338 PolarHBondContact O-N 3.23Å; L338-Q340 VanDerWaalsContact C-N 3.32Å; L338-Q340 PolarHBondContact O-N 2.78Å; L338-L341 PolarHBondContact O-N 3.49Å; L338-G342 PolarHBondContact O-N 2.85Å; L338-A352 HydrophobicContact CD2-CB 3.95Å; L338-T356 HydrophobicContact CD2-CG2 3.59Å; L338-T356 HydrophobicContact CG-CG2 3.81Å
339	S	78.3	Confident	80.3	Confident	7 Å²	7	61.1 Å²	61.1	5%	0.049	31%	0.312	C	S	.	.	H	α-helix	trans	-74.3	-18.1	178.9	-171.3	0	0	0	0	114	R335 V336 W337 Q343	R335-S339 WeakPolarHBondContact O-CB 3.24Å; R335-S339 PolarHBondContact O-N 3.5Å; V336-S339 CarbonylContact O-C 3.47Å; V336-S339 PolarHBondContact O-N 2.87Å; V336-S339 VanDerWaalsContact O-N 3.15Å; W337-S339 VanDerWaalsContact C-N 3.3Å; W337-S339 PolarHBondContact O-N 3.1Å; S339-Q343 PolarHBondContact O-NE2 2.9Å
340	Q	83.4	Confident	80.4	Confident	82 Å²	82	61.5 Å²	61.5	38%	0.383	31%	0.312	S	S	.	.	H	α-helix	trans	-81	-47.4	170.2	-77	172.8	-35.4	0	0	110.3	V336 W337 L338 G342 Q343 W344	V336-Q340 HydrophobicContact CG1-CG 4.4Å; V336-Q340 WeakPolarHBondContact O-CG 3.42Å; V336-Q340 PolarHBondContact O-N 3.22Å; W337-Q340 HydrophobicContact CE3-CB 4.31Å; W337-Q340 PolarHBondContact O-N 3.27Å; W337-Q340 VanDerWaalsContact O-N 3.14Å; L338-Q340 VanDerWaalsContact C-N 3.32Å; L338-Q340 PolarHBondContact O-N 2.78Å; Q340-G342 PolarHBondContact O-N 3.13Å; Q340-Q343 PolarHBondContact O-N 2.88Å; Q340-Q343 VanDerWaalsContact O-N 3.11Å; Q340-W344 PolarHBondContact O-NE1 3.04Å
341	L	84.4	Confident	80.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-55.9	-38.5	172.4	-69.1	170.8	0	0	0	111.1	W337 L338 Q343 W344 L347 A352 I355 T356 L428	W337-L341 HydrophobicContact CD2-CD1 4.15Å; W337-L341 HydrophobicContact CD2-CG 4.25Å; W337-L341 HydrophobicContact CE3-CG 4.19Å; W337-L341 HydrophobicContact CH2-CD2 3.79Å; W337-L341 HydrophobicContact CH2-CG 4.16Å; W337-L341 HydrophobicContact CZ2-CD1 4.06Å; W337-L341 HydrophobicContact CZ2-CD2 4.06Å; W337-L341 HydrophobicContact CZ2-CG 4.22Å; W337-L341 HydrophobicContact CZ3-CD2 4.12Å; W337-L341 HydrophobicContact CZ3-CG 4.16Å; W337-L341 WeakPolarHBondContact O-CG 3.33Å; W337-L341 PolarHBondContact O-N 3.49Å; L338-L341 PolarHBondContact O-N 3.49Å; L341-Q343 PolarHBondContact O-N 3.42Å; L341-W344 VanDerWaalsContact O-CD1 3.26Å; L341-W344 PolarHBondContact O-N 3.49Å; L341-L347 HydrophobicContact CB-CD1 4.19Å; L341-L347 HydrophobicContact CB-CD2 3.98Å; L341-L347 HydrophobicContact CD2-CD1 4.12Å; L341-L347 WeakPolarHBondContact O-CD1 3.48Å; L341-A352 HydrophobicContact CB-CB 3.85Å; L341-A352 HydrophobicContact CD1-CB 4.18Å; L341-I355 HydrophobicContact CD1-CB 4.09Å; L341-I355 HydrophobicContact CD1-CG2 3.82Å; L341-I355 HydrophobicContact CD2-CD1 4.37Å; L341-I355 HydrophobicContact CD2-CG2 4.28Å; L341-T356 HydrophobicContact CD1-CG2 3.74Å; L341-L428 HydrophobicContact CD2-CD1 4.48Å
342	G	79.5	Confident	81.1	Confident	17 Å²	17	52.2 Å²	52.2	18%	0.175	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-1.6	175.6	0	0	0	0	0	118.1	L338 Q340	L338-G342 PolarHBondContact O-N 2.85Å; Q340-G342 PolarHBondContact O-N 3.13Å
343	Q	77.3	Confident	81.3	Confident	87 Å²	87	53.6 Å²	53.6	41%	0.407	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-15.5	178.2	-66.1	170.7	39.9	0	0	112.5	I293 S339 Q340 L341	I293-Q343 HydrophobicContact CG2-CG 4.28Å; S339-Q343 PolarHBondContact O-NE2 2.9Å; Q340-Q343 PolarHBondContact O-N 2.88Å; Q340-Q343 VanDerWaalsContact O-N 3.11Å; L341-Q343 PolarHBondContact O-N 3.42Å
344	W	77.8	Confident	81.5	Confident	105 Å²	105	51.8 Å²	51.8	40%	0.398	27%	0.265	S	S	.	.	S	Bend	trans	-87.8	139.3	-171.6	-52	109.5	0	0	0	113	Q340 L341 G346 L347 L431	Q340-W344 PolarHBondContact O-NE1 3.04Å; L341-W344 VanDerWaalsContact O-CD1 3.26Å; L341-W344 PolarHBondContact O-N 3.49Å; W344-G346 PolarHBondContact O-N 2.89Å; W344-G346 VanDerWaalsContact O-N 3.17Å; W344-L347 HydrophobicContact CB-CB 4.21Å; W344-L347 HydrophobicContact CB-CD1 4.21Å; W344-L347 WeakPolarHBondContact O-CB 3.42Å; W344-L347 PolarHBondContact O-N 3.24Å; W344-L431 HydrophobicContact CD2-CD1 4.44Å; W344-L431 HydrophobicContact CD2-CD2 3.5Å; W344-L431 VanDerWaalsContact CD2-CD2 3.5Å; W344-L431 HydrophobicContact CE3-CD1 4.11Å; W344-L431 HydrophobicContact CE3-CD2 3.93Å; W344-L431 HydrophobicContact CG-CD2 3.96Å; W344-L431 HydrophobicContact CH2-CD1 3.48Å; W344-L431 VanDerWaalsContact CH2-CD1 3.48Å; W344-L431 HydrophobicContact CH2-CD2 4.14Å; W344-L431 HydrophobicContact CH2-CG 4.41Å; W344-L431 HydrophobicContact CZ2-CD1 3.84Å; W344-L431 HydrophobicContact CZ2-CD2 3.71Å; W344-L431 HydrophobicContact CZ2-CG 4.31Å; W344-L431 HydrophobicContact CZ3-CD1 3.62Å; W344-L431 HydrophobicContact CZ3-CD2 4.23Å
345	R	77.4	Confident	81.9	Confident	240 Å²	240	49.7 Å²	49.7	91%	0.906	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	118.3	-175.3	-173.3	179.8	178.8	109.5	-1.6	111
346	G	76.6	Confident	82.3	Confident	55 Å²	55	44.6 Å²	44.6	57%	0.567	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.2	-2.8	179.4	0	0	0	0	0	115.3	W344 T348	W344-G346 PolarHBondContact O-N 2.89Å; W344-G346 VanDerWaalsContact O-N 3.17Å; G346-T348 PolarHBondContact O-N 3.3Å
347	L	80.1	Confident	82.5	Confident	11 Å²	11	49 Å²	49	6%	0.058	25%	0.254	C	S	.	.			trans	-81.8	99.4	179.9	-149	156.9	0	0	0	110.5	L341 W344 I351 A352 I355 F424 L428	L341-L347 HydrophobicContact CB-CD1 4.19Å; L341-L347 HydrophobicContact CB-CD2 3.98Å; L341-L347 HydrophobicContact CD2-CD1 4.12Å; L341-L347 WeakPolarHBondContact O-CD1 3.48Å; W344-L347 HydrophobicContact CB-CB 4.21Å; W344-L347 HydrophobicContact CB-CD1 4.21Å; W344-L347 WeakPolarHBondContact O-CB 3.42Å; W344-L347 PolarHBondContact O-N 3.24Å; L347-I351 HydrophobicContact CD2-CB 4.08Å; L347-I351 HydrophobicContact CD2-CG2 3.89Å; L347-I351 HydrophobicContact CG-CB 4.36Å; L347-I351 HydrophobicContact CG-CG2 3.81Å; L347-A352 HydrophobicContact CD2-CB 3.52Å; L347-I355 HydrophobicContact CD1-CD1 4.37Å; L347-F424 HydrophobicContact CB-CZ 3.81Å; L347-F424 HydrophobicContact CD1-CE1 4.07Å; L347-F424 HydrophobicContact CD1-CZ 3.98Å; L347-F424 HydrophobicContact CG-CE1 4.12Å; L347-F424 HydrophobicContact CG-CZ 3.76Å; L347-L428 HydrophobicContact CD1-CD1 3.66Å
348	T	80.4	Confident	82.5	Confident	46 Å²	46	52.3 Å²	52.3	28%	0.282	28%	0.275	S	S	.	.			trans	-80.4	165.3	179.2	70.2	0	0	0	0	112.2	G346 E350 I351 A352 R409	G346-T348 PolarHBondContact O-N 3.3Å; T348-E350 VanDerWaalsContact CB-OE2 3.25Å; T348-E350 WeakPolarHBondContact CB-OE2 3.42Å; T348-E350 PolarHBondContact O-N 2.91Å; T348-E350 PolarHBondContact OG1-OE2 3.1Å; T348-I351 WeakPolarHBondContact O-CB 3.38Å; T348-I351 PolarHBondContact O-N 2.75Å; T348-A352 PolarHBondContact O-N 2.65Å; T348-R409 PolarHBondContact OG1-NH2 2.96Å
349	G	79.9	Confident	82.8	Confident	37 Å²	37	52 Å²	52	38%	0.381	27%	0.272	S	S	.	.	H	α-helix	trans	-56.1	-36.9	179.7	0	0	0	0	0	113.9	H353	G349-H353 WeakPolarHBondContact O-CB 3.4Å; G349-H353 PolarHBondContact O-N 3.08Å
350	E	82	Confident	83.1	Confident	50 Å²	50	55.3 Å²	55.3	23%	0.234	29%	0.294	C	S	.	.	H	α-helix	trans	-69.6	-35.3	177	-43.4	110.5	124.1	0	0	111.9	T348 H353 A354 I407 R409	T348-E350 VanDerWaalsContact CB-OE2 3.25Å; T348-E350 WeakPolarHBondContact CB-OE2 3.42Å; T348-E350 PolarHBondContact O-N 2.91Å; T348-E350 PolarHBondContact OG1-OE2 3.1Å; E350-H353 PolarHBondContact O-N 3.2Å; E350-A354 WeakPolarHBondContact O-CB 3.13Å; E350-A354 PolarHBondContact O-N 3.03Å; E350-I407 HydrophobicContact CB-CG2 3.84Å; E350-R409 HydrophobicContact CB-CG 4.12Å; E350-R409 HydrophobicContact CG-CB 4.37Å; E350-R409 HydrophobicContact CG-CG 3.97Å; E350-R409 WeakPolarHBondContact OE1-CB 3.42Å; E350-R409 WeakPolarHBondContact OE1-CD 3.33Å; E350-R409 WeakPolarHBondContact OE1-CG 3.39Å; E350-R409 IonicContact OE1-CZ 3.91Å; E350-R409 VanDerWaalsContact OE1-CZ 3.26Å; E350-R409 IonicContact OE1-NE 2.65Å; E350-R409 PolarHBondContact OE1-NE 3.22Å; E350-R409 IonicContact OE1-NH1 2.72Å; E350-R409 PolarHBondContact OE1-NH1 3.28Å; E350-R409 IonicContact OE2-CZ 3.55Å; E350-R409 VanDerWaalsContact OE2-CZ 3.25Å; E350-R409 IonicContact OE2-NE 2.7Å; E350-R409 IonicContact OE2-NH1 3.26Å; E350-R409 PolarHBondContact OE2-NH1 3.5Å; E350-R409 IonicContact OE2-NH2 2.7Å
351	I	85	Confident	83.3	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.077	29%	0.293	C	S	.	.	H	α-helix	trans	-67.4	-47.8	177.1	-64.5	173.3	0	0	0	110	L347 T348 H353 A354 I355 I407 L420 F424	L347-I351 HydrophobicContact CD2-CB 4.08Å; L347-I351 HydrophobicContact CD2-CG2 3.89Å; L347-I351 HydrophobicContact CG-CB 4.36Å; L347-I351 HydrophobicContact CG-CG2 3.81Å; T348-I351 WeakPolarHBondContact O-CB 3.38Å; T348-I351 PolarHBondContact O-N 2.75Å; I351-H353 VanDerWaalsContact C-N 3.3Å; I351-H353 PolarHBondContact O-N 3.48Å; I351-A354 PolarHBondContact O-N 2.76Å; I351-I355 HydrophobicContact CG2-CD1 3.88Å; I351-I355 VanDerWaalsContact O-CG1 3.3Å; I351-I355 WeakPolarHBondContact O-CG1 3.12Å; I351-I355 PolarHBondContact O-N 3.01Å; I351-I407 HydrophobicContact CD1-CD1 4.45Å; I351-I407 HydrophobicContact CG1-CD1 3.8Å; I351-I407 HydrophobicContact CG1-CG1 4.21Å; I351-I407 HydrophobicContact CG1-CG2 4.17Å; I351-L420 HydrophobicContact CG2-CD1 3.48Å; I351-L420 VanDerWaalsContact CG2-CD1 3.48Å; I351-F424 HydrophobicContact CG2-CE1 4.1Å
352	A	86.3	Confident	83.4	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.5	-44.9	175.8	0	0	0	0	0	110.8	L297 L338 L341 L347 T348 I355 T356	L297-A352 HydrophobicContact CD1-CB 3.45Å; L297-A352 VanDerWaalsContact CD1-CB 3.45Å; L338-A352 HydrophobicContact CD2-CB 3.95Å; L341-A352 HydrophobicContact CB-CB 3.85Å; L341-A352 HydrophobicContact CD1-CB 4.18Å; L347-A352 HydrophobicContact CD2-CB 3.52Å; T348-A352 PolarHBondContact O-N 2.65Å; A352-I355 PolarHBondContact O-N 2.86Å; A352-T356 VanDerWaalsContact O-CG2 3.32Å; A352-T356 WeakPolarHBondContact O-CG2 3.35Å; A352-T356 PolarHBondContact O-N 3.42Å; A352-T356 PolarHBondContact O-OG1 3.09Å
353	H	85.3	Confident	83.8	Confident	100 Å²	100	64.2 Å²	64.2	46%	0.463	33%	0.333	S	S	.	.	H	α-helix	trans	-62.1	-47.5	-179.6	-170.6	38.7	0	0	0	111.8	G349 E350 I351 I355 T356 L357	G349-H353 WeakPolarHBondContact O-CB 3.4Å; G349-H353 PolarHBondContact O-N 3.08Å; E350-H353 PolarHBondContact O-N 3.2Å; I351-H353 VanDerWaalsContact C-N 3.3Å; I351-H353 PolarHBondContact O-N 3.48Å; H353-I355 VanDerWaalsContact C-N 3.32Å; H353-I355 PolarHBondContact O-N 2.98Å; H353-T356 WeakPolarHBondContact CA-OG1 3.35Å; H353-T356 CarbonylContact O-C 3.58Å; H353-T356 PolarHBondContact O-N 3.15Å; H353-T356 PolarHBondContact O-OG1 3.44Å; H353-L357 WeakPolarHBondContact O-CG 3.27Å; H353-L357 PolarHBondContact O-N 3.45Å
354	A	86.4	Confident	84.4	Confident	8 Å²	8	61.7 Å²	61.7	7%	0.066	33%	0.325	C	S	.	.	H	α-helix	trans	-56.5	-43.3	175	0	0	0	0	0	112.4	E350 I351 L357 L405 I407	E350-A354 WeakPolarHBondContact O-CB 3.13Å; E350-A354 PolarHBondContact O-N 3.03Å; I351-A354 PolarHBondContact O-N 2.76Å; A354-L357 PolarHBondContact O-N 3.46Å; A354-L405 HydrophobicContact CB-CD2 4.32Å; A354-L405 HydrophobicContact CB-CG 4.43Å; A354-I407 HydrophobicContact CB-CG1 4.25Å
355	I	87.5	Confident	85	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-44.2	174.3	-66.3	164.8	0	0	0	110.7	W337 L341 L347 I351 A352 H353 L357 V358 Y359 F365 L405 L428	W337-I355 HydrophobicContact CZ2-CG2 4.29Å; L341-I355 HydrophobicContact CD1-CB 4.09Å; L341-I355 HydrophobicContact CD1-CG2 3.82Å; L341-I355 HydrophobicContact CD2-CD1 4.37Å; L341-I355 HydrophobicContact CD2-CG2 4.28Å; L347-I355 HydrophobicContact CD1-CD1 4.37Å; I351-I355 HydrophobicContact CG2-CD1 3.88Å; I351-I355 VanDerWaalsContact O-CG1 3.3Å; I351-I355 WeakPolarHBondContact O-CG1 3.12Å; I351-I355 PolarHBondContact O-N 3.01Å; A352-I355 PolarHBondContact O-N 2.86Å; H353-I355 VanDerWaalsContact C-N 3.32Å; H353-I355 PolarHBondContact O-N 2.98Å; I355-L357 VanDerWaalsContact C-N 3.32Å; I355-L357 PolarHBondContact O-N 3.42Å; I355-V358 PolarHBondContact O-N 3.18Å; I355-Y359 HydrophobicContact CG2-CD2 4.46Å; I355-Y359 WeakPolarHBondContact O-CA 3.43Å; I355-Y359 PolarHBondContact O-N 3.03Å; I355-F365 HydrophobicContact CG2-CD2 4.43Å; I355-L405 HydrophobicContact CB-CD2 4.44Å; I355-L405 HydrophobicContact CG1-CD2 3.59Å; I355-L428 HydrophobicContact CD1-CD1 3.6Å
356	T	87.2	Confident	85.5	Confident	14 Å²	14	50 Å²	50	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-71.5	-19.7	179.9	61.4	0	0	0	0	115.2	W337 L338 L341 A352 H353 P360	W337-T356 VanDerWaalsContact CD1-CG2 3.41Å; W337-T356 HydrophobicContact CG-CG2 4.18Å; L338-T356 HydrophobicContact CD2-CG2 3.59Å; L338-T356 HydrophobicContact CG-CG2 3.81Å; L341-T356 HydrophobicContact CD1-CG2 3.74Å; A352-T356 VanDerWaalsContact O-CG2 3.32Å; A352-T356 WeakPolarHBondContact O-CG2 3.35Å; A352-T356 PolarHBondContact O-N 3.42Å; A352-T356 PolarHBondContact O-OG1 3.09Å; H353-T356 WeakPolarHBondContact CA-OG1 3.35Å; H353-T356 CarbonylContact O-C 3.58Å; H353-T356 PolarHBondContact O-N 3.15Å; H353-T356 PolarHBondContact O-OG1 3.44Å; T356-P360 VanDerWaalsContact O-CA 3.29Å; T356-P360 WeakPolarHBondContact O-CA 3.48Å
357	L	86.5	Confident	86.1	Confident	123 Å²	123	50.9 Å²	50.9	64%	0.644	27%	0.273	S	S	*	.	H	α-helix	trans	-73.7	-33.1	174.6	-73.8	170.7	0	0	0	111.9	H353 A354 I355	H353-L357 WeakPolarHBondContact O-CG 3.27Å; H353-L357 PolarHBondContact O-N 3.45Å; A354-L357 PolarHBondContact O-N 3.46Å; I355-L357 VanDerWaalsContact C-N 3.32Å; I355-L357 PolarHBondContact O-N 3.42Å
358	V	87.4	Confident	86.5	Confident	76 Å²	76	51.2 Å²	51.2	46%	0.461	28%	0.277	S	S	.	.	H	α-helix	trans	-92.5	-39.9	177.1	-173.4	0	0	0	0	111.4	I355 P360 L405	I355-V358 PolarHBondContact O-N 3.18Å; V358-P360 WeakPolarHBondContact O-CD 3.26Å; V358-L405 HydrophobicContact CB-CD1 4.47Å; V358-L405 HydrophobicContact CG2-CD1 3.63Å
359	Y	89.6	Confident	86.8	Confident	18 Å²	18	49 Å²	49	7%	0.071	26%	0.263	C	S	.	.			trans	-121.4	83.7	-178.8	-50.2	-73.6	0	0	0	109.5	W337 I355 T361 F365 A368 F398 E401	W337-Y359 PolarHBondContact NE1-O 3.44Å; I355-Y359 HydrophobicContact CG2-CD2 4.46Å; I355-Y359 WeakPolarHBondContact O-CA 3.43Å; I355-Y359 PolarHBondContact O-N 3.03Å; Y359-T361 PolarHBondContact O-N 2.65Å; Y359-F365 AromaticContact CD2-CD2 3.78Å; Y359-F365 HydrophobicContact CD2-CD2 3.78Å; Y359-F365 HydrophobicContact CD2-CE2 4.38Å; Y359-F365 HydrophobicContact CE2-CD2 4.34Å; Y359-F365 HydrophobicContact CG-CB 4.29Å; Y359-F365 AromaticContact CG-CD2 3.91Å; Y359-F365 HydrophobicContact CG-CD2 3.91Å; Y359-A368 HydrophobicContact CD1-CB 4.11Å; Y359-A368 HydrophobicContact CE1-CB 3.6Å; Y359-F398 HydrophobicContact CE1-CE2 4.34Å; Y359-F398 AromaticContact CE1-CZ 3.95Å; Y359-F398 HydrophobicContact CE1-CZ 3.95Å; Y359-F398 HydrophobicContact CE2-CZ 4.05Å; Y359-F398 AromaticContact CZ-CE2 3.9Å; Y359-F398 AromaticContact CZ-CZ 3.53Å; Y359-F398 VanDerWaalsContact OH-CE2 3.3Å; Y359-F398 WeakPolarHBondContact OH-CE2 3.5Å; Y359-F398 WeakPolarHBondContact OH-CZ 3.25Å; Y359-E401 PolarHBondContact OH-OE1 3.4Å
360	P	85.5	Confident	87	Confident	78 Å²	78	49.7 Å²	49.7	51%	0.506	26%	0.256	S	S	.	.	S	Bend	trans	-65.8	-11.5	-172.3	25.5	-35.5	0	0	0	114.8	W337 T356 V358	W337-P360 VanDerWaalsContact CD1-O 3.28Å; T356-P360 VanDerWaalsContact O-CA 3.29Å; T356-P360 WeakPolarHBondContact O-CA 3.48Å; V358-P360 WeakPolarHBondContact O-CD 3.26Å
361	T	86.9	Confident	87.1	Confident	62 Å²	62	52.2 Å²	52.2	38%	0.38	27%	0.27	S	S	.	.	S	Bend	trans	-138	158.3	174.8	69.2	0	0	0	0	112.1	Y359 R363 S364 F365	Y359-T361 PolarHBondContact O-N 2.65Å; T361-R363 PolarHBondContact O-N 2.64Å; T361-R363 PolarHBondContact OG1-N 3.46Å; T361-S364 PolarHBondContact N-OG 3.05Å; T361-S364 PolarHBondContact O-N 2.94Å; T361-S364 PolarHBondContact O-OG 3.17Å; T361-S364 PolarHBondContact OG1-N 3.28Å; T361-S364 PolarHBondContact OG1-OG 2.87Å; T361-F365 PolarHBondContact O-N 3.32Å; T361-F365 VanDerWaalsContact O-N 3.12Å
362	A	87.5	Confident	86.9	Confident	34 Å²	34	51.9 Å²	51.9	28%	0.281	27%	0.27	S	S	.	.	H	α-helix	trans	-55	-35.1	168.5	0	0	0	0	0	112.5	W337 F365 Y366	W337-A362 HydrophobicContact CD2-CB 4.26Å; W337-A362 HydrophobicContact CE3-CB 3.69Å; W337-A362 HydrophobicContact CH2-CB 4.03Å; W337-A362 HydrophobicContact CZ3-CB 3.56Å; A362-F365 PolarHBondContact O-N 3.47Å; A362-Y366 WeakPolarHBondContact O-CB 3.5Å; A362-Y366 PolarHBondContact O-N 3.08Å
363	R	88.3	Confident	86.5	Confident	190 Å²	190	54.7 Å²	54.7	72%	0.717	28%	0.283	S	S	*	.	H	α-helix	trans	-68.8	-41.2	178	-168.9	176.7	-174.9	-175.3	1.1	112.2	T361 F365 Y366 N367	T361-R363 PolarHBondContact O-N 2.64Å; T361-R363 PolarHBondContact OG1-N 3.46Å; R363-F365 VanDerWaalsContact C-N 3.31Å; R363-F365 PolarHBondContact O-N 3.33Å; R363-Y366 PolarHBondContact O-N 3.27Å; R363-N367 VanDerWaalsContact O-CB 3.22Å; R363-N367 WeakPolarHBondContact O-CB 3.29Å; R363-N367 PolarHBondContact O-N 3.36Å; R363-N367 PolarHBondContact O-OD1 3.12Å
364	S	89.2	Confident	86.1	Confident	34 Å²	34	54.2 Å²	54.2	24%	0.238	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-38.5	173.1	40.1	0	0	0	0	112	T361 A368	T361-S364 PolarHBondContact N-OG 3.05Å; T361-S364 PolarHBondContact O-N 2.94Å; T361-S364 PolarHBondContact O-OG 3.17Å; T361-S364 PolarHBondContact OG1-N 3.28Å; T361-S364 PolarHBondContact OG1-OG 2.87Å; S364-A368 WeakPolarHBondContact O-CB 3.43Å; S364-A368 PolarHBondContact O-N 2.93Å
365	F	89.9	Confident	85.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-47.7	176.6	-174.8	-91.4	0	0	0	112.3	W337 I355 Y359 T361 A362 R363 A368 C369 F398 L402 L428 F432	W337-F365 HydrophobicContact CH2-CB 4.23Å; W337-F365 HydrophobicContact CH2-CG 4.47Å; W337-F365 HydrophobicContact CZ2-CB 3.89Å; W337-F365 HydrophobicContact CZ2-CG 4.33Å; I355-F365 HydrophobicContact CG2-CD2 4.43Å; Y359-F365 AromaticContact CD2-CD2 3.78Å; Y359-F365 HydrophobicContact CD2-CD2 3.78Å; Y359-F365 HydrophobicContact CD2-CE2 4.38Å; Y359-F365 HydrophobicContact CE2-CD2 4.34Å; Y359-F365 HydrophobicContact CG-CB 4.29Å; Y359-F365 AromaticContact CG-CD2 3.91Å; Y359-F365 HydrophobicContact CG-CD2 3.91Å; T361-F365 PolarHBondContact O-N 3.32Å; T361-F365 VanDerWaalsContact O-N 3.12Å; A362-F365 PolarHBondContact O-N 3.47Å; R363-F365 VanDerWaalsContact C-N 3.31Å; R363-F365 PolarHBondContact O-N 3.33Å; F365-A368 PolarHBondContact O-N 2.91Å; F365-C369 WeakPolarHBondContact CE1-SG 3.38Å; F365-C369 PolarHBondContact O-N 3.48Å; F365-C369 VanDerWaalsContact O-N 3.08Å; F365-C369 PolarHBondContact O-SG 2.69Å; F365-F398 HydrophobicContact CD2-CE1 4.36Å; F365-F398 AromaticContact CE2-CE1 3.69Å; F365-F398 HydrophobicContact CE2-CE1 3.69Å; F365-F398 HydrophobicContact CE2-CZ 4.21Å; F365-F398 AromaticContact CZ-CE1 3.79Å; F365-F398 HydrophobicContact CZ-CE1 3.79Å; F365-L402 HydrophobicContact CE2-CD1 3.97Å; F365-L402 HydrophobicContact CE2-CD2 3.8Å; F365-L402 HydrophobicContact CZ-CD2 3.66Å; F365-L428 HydrophobicContact CD1-CD2 4.31Å; F365-L428 HydrophobicContact CD2-CD2 4.45Å; F365-L428 HydrophobicContact CE1-CD2 3.52Å; F365-L428 HydrophobicContact CE2-CD2 3.67Å; F365-L428 HydrophobicContact CZ-CD2 3.15Å; F365-F432 HydrophobicContact CD1-CB 4.12Å; F365-F432 AromaticContact CD1-CD2 3.63Å; F365-F432 HydrophobicContact CD1-CD2 3.63Å; F365-F432 HydrophobicContact CD1-CE2 4.24Å; F365-F432 AromaticContact CD1-CG 3.83Å; F365-F432 HydrophobicContact CD1-CG 3.83Å; F365-F432 HydrophobicContact CE1-CB 3.97Å; F365-F432 AromaticContact CE1-CD2 3.48Å; F365-F432 HydrophobicContact CE1-CD2 3.48Å; F365-F432 VanDerWaalsContact CE1-CD2 3.48Å; F365-F432 HydrophobicContact CE1-CE2 4.29Å; F365-F432 AromaticContact CE1-CG 3.92Å; F365-F432 HydrophobicContact CE1-CG 3.92Å
366	Y	88.7	Confident	84.6	Confident	99 Å²	99	61.4 Å²	61.4	39%	0.388	32%	0.32	S	S	.	.	H	α-helix	trans	-62.8	-42.3	177.1	-180	-96.1	0	0	0	112.3	A362 R363 A368 C369 K370 F432	A362-Y366 WeakPolarHBondContact O-CB 3.5Å; A362-Y366 PolarHBondContact O-N 3.08Å; R363-Y366 PolarHBondContact O-N 3.27Å; Y366-A368 VanDerWaalsContact C-N 3.33Å; Y366-A368 PolarHBondContact O-N 3.23Å; Y366-C369 WeakPolarHBondContact O-CB 3.39Å; Y366-C369 PolarHBondContact O-N 3.47Å; Y366-K370 HydrophobicContact CD1-CG 4.17Å; Y366-K370 HydrophobicContact CE1-CG 3.73Å; Y366-K370 HydrophobicContact CE2-CG 4.33Å; Y366-K370 PolarHBondContact O-N 2.94Å; Y366-K370 WeakPolarHBondContact OH-CE 3.32Å; Y366-F432 VanDerWaalsContact CD2-O 3.31Å; Y366-F432 WeakPolarHBondContact CD2-O 3.44Å; Y366-F432 WeakPolarHBondContact CE2-O 3.44Å
367	N	88.9	Confident	83.5	Confident	73 Å²	73	64.3 Å²	64.3	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-40.7	175.4	-75.2	9.2	0	0	0	111.5	R363 K370 L371	R363-N367 VanDerWaalsContact O-CB 3.22Å; R363-N367 WeakPolarHBondContact O-CB 3.29Å; R363-N367 PolarHBondContact O-N 3.36Å; R363-N367 PolarHBondContact O-OD1 3.12Å; N367-K370 PolarHBondContact O-N 3Å; N367-L371 WeakPolarHBondContact O-CB 3.47Å; N367-L371 VanDerWaalsContact O-CG 3.25Å; N367-L371 WeakPolarHBondContact O-CG 3.22Å; N367-L371 PolarHBondContact O-N 3.41Å
368	A	87.6	Confident	82.2	Confident	18 Å²	18	63.6 Å²	63.6	15%	0.149	34%	0.337	C	S	.	.	H	α-helix	trans	-63.4	-43.9	176.4	0	0	0	0	0	111.8	Y359 S364 F365 Y366 K370 L371 A372 F398	Y359-A368 HydrophobicContact CD1-CB 4.11Å; Y359-A368 HydrophobicContact CE1-CB 3.6Å; S364-A368 WeakPolarHBondContact O-CB 3.43Å; S364-A368 PolarHBondContact O-N 2.93Å; F365-A368 PolarHBondContact O-N 2.91Å; Y366-A368 VanDerWaalsContact C-N 3.33Å; Y366-A368 PolarHBondContact O-N 3.23Å; A368-K370 PolarHBondContact O-N 3.19Å; A368-L371 PolarHBondContact O-N 3.25Å; A368-A372 PolarHBondContact O-N 3.04Å; A368-A372 VanDerWaalsContact O-N 3.11Å; A368-F398 HydrophobicContact CB-CE1 4.28Å; A368-F398 HydrophobicContact CB-CE2 3.68Å; A368-F398 HydrophobicContact CB-CZ 3.53Å
369	C	86.9	Confident	80.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-56.3	-50.7	172.1	-61	0	0	0	0	111.5	F365 Y366 A372 E373 H396 F398 T433	F365-C369 WeakPolarHBondContact CE1-SG 3.38Å; F365-C369 PolarHBondContact O-N 3.48Å; F365-C369 VanDerWaalsContact O-N 3.08Å; F365-C369 PolarHBondContact O-SG 2.69Å; Y366-C369 WeakPolarHBondContact O-CB 3.39Å; Y366-C369 PolarHBondContact O-N 3.47Å; C369-A372 WeakPolarHBondContact O-CB 3.33Å; C369-A372 PolarHBondContact O-N 2.78Å; C369-E373 PolarHBondContact O-N 2.95Å; C369-H396 PolarHBondContact O-CE1 3.47Å; C369-F398 HydrophobicContact CB-CD1 4.34Å; C369-F398 VanDerWaalsContact SG-CD1 3.5Å; C369-F398 WeakPolarHBondContact SG-CE1 3.47Å; C369-T433 HydrophobicContact CB-CG2 3.71Å
370	K	83.8	Confident	79	Confident	52 Å²	52	72.3 Å²	72.3	23%	0.226	38%	0.378	C	S	.	.	H	α-helix	trans	-68	-35.7	-177.5	-76.1	-76.7	170.9	-115.2	0	113.9	Y366 N367 A368 A372 E373 I374	Y366-K370 HydrophobicContact CD1-CG 4.17Å; Y366-K370 HydrophobicContact CE1-CG 3.73Å; Y366-K370 HydrophobicContact CE2-CG 4.33Å; Y366-K370 PolarHBondContact O-N 2.94Å; Y366-K370 WeakPolarHBondContact OH-CE 3.32Å; N367-K370 PolarHBondContact O-N 3Å; A368-K370 PolarHBondContact O-N 3.19Å; K370-A372 VanDerWaalsContact C-N 3.32Å; K370-E373 IonicContact NZ-OE1 3.72Å; K370-E373 PolarHBondContact NZ-OE1 3.05Å; K370-E373 IonicContact NZ-OE2 3.49Å; K370-E373 PolarHBondContact NZ-OE2 3.29Å; K370-E373 PolarHBondContact O-N 2.89Å; K370-I374 WeakPolarHBondContact O-CD1 3.22Å; K370-I374 VanDerWaalsContact O-CG1 3.26Å; K370-I374 WeakPolarHBondContact O-CG1 3.32Å; K370-I374 PolarHBondContact O-N 2.76Å
371	L	84.4	Confident	77.2	Confident	102 Å²	102	73.3 Å²	73.3	53%	0.534	39%	0.387	S	S	.	.	H	α-helix	trans	-64.6	-39.7	173.6	-75.3	168.8	0	0	0	110.9	N367 A368 I374 Q375	N367-L371 WeakPolarHBondContact O-CB 3.47Å; N367-L371 VanDerWaalsContact O-CG 3.25Å; N367-L371 WeakPolarHBondContact O-CG 3.22Å; N367-L371 PolarHBondContact O-N 3.41Å; A368-L371 PolarHBondContact O-N 3.25Å; L371-I374 PolarHBondContact O-N 2.77Å; L371-Q375 WeakPolarHBondContact O-CB 3.25Å; L371-Q375 VanDerWaalsContact O-CG 3.26Å; L371-Q375 WeakPolarHBondContact O-CG 3.35Å; L371-Q375 PolarHBondContact O-N 3.3Å
372	A	81.4	Confident	74.9	Confident	9 Å²	9	77.6 Å²	77.6	7%	0.074	41%	0.408	C	S	.	.	H	α-helix	trans	-66.6	-40.6	175.2	0	0	0	0	0	112.3	A368 C369 K370 I374 Q375 S376 P397 F398	A368-A372 PolarHBondContact O-N 3.04Å; A368-A372 VanDerWaalsContact O-N 3.11Å; C369-A372 WeakPolarHBondContact O-CB 3.33Å; C369-A372 PolarHBondContact O-N 2.78Å; K370-A372 VanDerWaalsContact C-N 3.32Å; A372-I374 PolarHBondContact O-N 2.72Å; A372-Q375 PolarHBondContact O-N 3.49Å; A372-S376 PolarHBondContact O-N 3.07Å; A372-S376 PolarHBondContact O-OG 3.4Å; A372-S376 VanDerWaalsContact O-OG 3.1Å; A372-P397 HydrophobicContact CB-CB 4.42Å; A372-P397 HydrophobicContact CB-CG 3.97Å; A372-P397 WeakPolarHBondContact O-CG 3.26Å; A372-F398 HydrophobicContact CB-CB 3.74Å; A372-F398 HydrophobicContact CB-CG 4.45Å
373	E	77.6	Confident	72.5	Confident	58 Å²	58	80.3 Å²	80.3	27%	0.271	42%	0.424	S	S	.	.	H	α-helix	trans	-55.8	-49.5	171.6	-70.3	173.7	-145.7	0	0	111.7	C369 K370 Q375 S376 S377 H396 T433	C369-E373 PolarHBondContact O-N 2.95Å; K370-E373 IonicContact NZ-OE1 3.72Å; K370-E373 PolarHBondContact NZ-OE1 3.05Å; K370-E373 IonicContact NZ-OE2 3.49Å; K370-E373 PolarHBondContact NZ-OE2 3.29Å; K370-E373 PolarHBondContact O-N 2.89Å; E373-Q375 VanDerWaalsContact C-N 3.32Å; E373-Q375 PolarHBondContact O-N 2.94Å; E373-S376 WeakPolarHBondContact CA-OG 3.43Å; E373-S376 PolarHBondContact O-N 3.12Å; E373-S376 PolarHBondContact O-OG 3.19Å; E373-S377 PolarHBondContact O-N 2.99Å; E373-S377 VanDerWaalsContact O-N 3.11Å; E373-S377 PolarHBondContact O-OG 3.49Å; E373-H396 VanDerWaalsContact CG-NE2 3.32Å; E373-H396 WeakPolarHBondContact CG-NE2 3.48Å; E373-H396 IonicContact OE1-NE2 2.63Å; E373-T433 WeakPolarHBondContact OE1-CG2 3.43Å
374	I	76	Confident	69.8	Low	90 Å²	90	80.9 Å²	80.9	46%	0.462	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-36.6	-179.8	-66.9	163.4	0	0	0	111.4	K370 L371 A372 S377 N378	K370-I374 WeakPolarHBondContact O-CD1 3.22Å; K370-I374 VanDerWaalsContact O-CG1 3.26Å; K370-I374 WeakPolarHBondContact O-CG1 3.32Å; K370-I374 PolarHBondContact O-N 2.76Å; L371-I374 PolarHBondContact O-N 2.77Å; A372-I374 PolarHBondContact O-N 2.72Å; I374-S377 WeakPolarHBondContact CA-OG 3.45Å; I374-S377 PolarHBondContact O-N 3.41Å; I374-S377 PolarHBondContact O-OG 3.11Å; I374-N378 VanDerWaalsContact O-CG 3.26Å; I374-N378 PolarHBondContact O-N 2.71Å; I374-N378 PolarHBondContact O-ND2 3.44Å
375	Q	74.7	Confident	67.4	Low	119 Å²	119	84 Å²	84	56%	0.556	45%	0.452	S	S	*	.	H	α-helix	trans	-66.2	-41.3	176.1	-76.4	172.6	4.5	0	0	111.9	L371 A372 E373 N378 Q379	L371-Q375 WeakPolarHBondContact O-CB 3.25Å; L371-Q375 VanDerWaalsContact O-CG 3.26Å; L371-Q375 WeakPolarHBondContact O-CG 3.35Å; L371-Q375 PolarHBondContact O-N 3.3Å; A372-Q375 PolarHBondContact O-N 3.49Å; E373-Q375 VanDerWaalsContact C-N 3.32Å; E373-Q375 PolarHBondContact O-N 2.94Å; Q375-N378 PolarHBondContact O-N 3.1Å; Q375-Q379 WeakPolarHBondContact O-CG 3.48Å; Q375-Q379 PolarHBondContact O-N 3.34Å
376	S	67.7	Low	64.7	Low	41 Å²	41	89.6 Å²	89.6	29%	0.287	49%	0.487	S	S	.	.	H	α-helix	trans	-59.7	-51.2	172.1	34.1	0	0	0	0	112.1	A372 E373 N378 Q379 D380	A372-S376 PolarHBondContact O-N 3.07Å; A372-S376 PolarHBondContact O-OG 3.4Å; A372-S376 VanDerWaalsContact O-OG 3.1Å; E373-S376 WeakPolarHBondContact CA-OG 3.43Å; E373-S376 PolarHBondContact O-N 3.12Å; E373-S376 PolarHBondContact O-OG 3.19Å; S376-N378 PolarHBondContact O-N 3.28Å; S376-Q379 PolarHBondContact O-N 2.8Å; S376-D380 PolarHBondContact O-N 2.87Å
377	S	64.3	Low	62.1	Low	74 Å²	74	91.8 Å²	91.8	52%	0.517	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-20.4	-177.6	56.6	0	0	0	0	114.4	E373 I374	E373-S377 PolarHBondContact O-N 2.99Å; E373-S377 VanDerWaalsContact O-N 3.11Å; E373-S377 PolarHBondContact O-OG 3.49Å; I374-S377 WeakPolarHBondContact CA-OG 3.45Å; I374-S377 PolarHBondContact O-N 3.41Å; I374-S377 PolarHBondContact O-OG 3.11Å
378	N	60.6	Low	59.2	Low	108 Å²	108	94.2 Å²	94.2	58%	0.578	53%	0.527	S	S	*	.	H	α-helix	trans	-88.9	-25.9	176.1	-69.6	-10.2	0	0	0	112.9	I374 Q375 S376 S381	I374-N378 VanDerWaalsContact O-CG 3.26Å; I374-N378 PolarHBondContact O-N 2.71Å; I374-N378 PolarHBondContact O-ND2 3.44Å; Q375-N378 PolarHBondContact O-N 3.1Å; S376-N378 PolarHBondContact O-N 3.28Å; N378-S381 PolarHBondContact O-OG 2.97Å
379	Q	55.5	Low	56.5	Low	139 Å²	139	96.7 Å²	96.7	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-85.2	-20.2	-178.7	-74.1	-174.5	-3.5	0	0	114.2	Q375 S376 S381 N382 C383	Q375-Q379 WeakPolarHBondContact O-CG 3.48Å; Q375-Q379 PolarHBondContact O-N 3.34Å; S376-Q379 PolarHBondContact O-N 2.8Å; Q379-S381 PolarHBondContact O-N 3.25Å; Q379-N382 PolarHBondContact O-N 3.24Å; Q379-C383 PolarHBondContact O-N 3.21Å
380	D	52.8	Low	53.9	Low	138 Å²	138	101.2 Å²	101.2	74%	0.738	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-15.3	174.2	-73.6	-33.6	0	0	0	113.8	S376	S376-D380 PolarHBondContact O-N 2.87Å
381	S	47.6	Very low	51.5	Low	100 Å²	100	107 Å²	107	70%	0.699	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-19.8	174.8	62.8	0	0	0	0	115	N378 Q379	N378-S381 PolarHBondContact O-OG 2.97Å; Q379-S381 PolarHBondContact O-N 3.25Å
382	N	39.6	Very low	49.3	Very low	151 Å²	151	108.7 Å²	108.7	81%	0.807	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.4	25.2	-171.2	-135.6	-7.5	0	0	0	118.2	Q379	Q379-N382 PolarHBondContact O-N 3.24Å
383	C	37.5	Very low	47.8	Very low	92 Å²	92	114.2 Å²	114.2	62%	0.622	64%	0.635	S	S	*	*			trans	-155	82.1	165.9	-144.5	0	0	0	0	115.6	Q379 T385	Q379-C383 PolarHBondContact O-N 3.21Å; C383-T385 PolarHBondContact O-N 3.44Å; C383-T385 PolarHBondContact SG-OG1 3.31Å
384	Q	31.8	Very low	46.8	Very low	202 Å²	202	117.1 Å²	117.1	94%	0.944	66%	0.662	S	S	*	*			trans	-74.8	68.2	165.5	-72.5	-170.4	-7.1	0	0	111.7
385	T	37.1	Very low	46.2	Very low	98 Å²	98	117 Å²	117	60%	0.601	66%	0.661	S	S	*	*			trans	-114.4	98	179	-51	0	0	0	0	111.7	C383	C383-T385 PolarHBondContact O-N 3.44Å; C383-T385 PolarHBondContact SG-OG1 3.31Å
386	T	33.4	Very low	45.7	Very low	119 Å²	119	113 Å²	113	73%	0.73	64%	0.642	S	S	*	*	S	Bend	trans	53.4	81	157	62.2	0	0	0	0	118.4
387	L	35.4	Very low	45.8	Very low	145 Å²	145	113.8 Å²	113.8	76%	0.759	65%	0.647	S	S	*	*			trans	-154.3	35.8	141.6	-112.8	161.6	0	0	0	112.7	C389	L387-C389 VanDerWaalsContact C-N 3.32Å; L387-C389 PolarHBondContact O-N 2.92Å
388	S	27.9	Very low	46.6	Very low	123 Å²	123	110.4 Å²	110.4	86%	0.86	62%	0.622	S	S	*	*			trans	-75.6	74.3	178.6	56.4	0	0	0	0	112.4
389	C	31.3	Very low	47.5	Very low	71 Å²	71	105.5 Å²	105.5	48%	0.48	60%	0.596	S	S	.	*			trans	-107.8	114	171.9	-91.5	0	0	0	0	110.9	L387 Q392	L387-C389 VanDerWaalsContact C-N 3.32Å; L387-C389 PolarHBondContact O-N 2.92Å; C389-Q392 HydrophobicContact CB-CB 4.45Å
390	S	31.2	Very low	48.6	Very low	95 Å²	95	103.8 Å²	103.8	66%	0.664	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	152.2	176.7	42.4	0	0	0	0	112.6	Q392	S390-Q392 VanDerWaalsContact C-N 3.25Å; S390-Q392 WeakPolarHBondContact O-CG 3.32Å; S390-Q392 PolarHBondContact O-N 3.49Å; S390-Q392 PolarHBondContact O-NE2 3.4Å
391	N	32.9	Very low	50.1	Low	174 Å²	174	102.6 Å²	102.6	93%	0.93	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.7	4.9	-176.7	-56.9	-13.2	0	0	0	116.9
392	Q	39.5	Very low	51.9	Low	137 Å²	137	97.9 Å²	97.9	64%	0.64	55%	0.547	S	S	*	.			trans	-108.7	143.6	-164.7	-70.7	167.7	52.9	0	0	114.2	C389 S390	C389-Q392 HydrophobicContact CB-CB 4.45Å; S390-Q392 VanDerWaalsContact C-N 3.25Å; S390-Q392 WeakPolarHBondContact O-CG 3.32Å; S390-Q392 PolarHBondContact O-N 3.49Å; S390-Q392 PolarHBondContact O-NE2 3.4Å
393	K	49.4	Very low	54	Low	125 Å²	125	91.2 Å²	91.2	54%	0.543	51%	0.513	S	S	.	.			trans	-50.1	134	-173.8	-56.1	171.1	-175.5	172.2	0	110.7	I395 E423 R426	K393-I395 PolarHBondContact O-N 3.04Å; K393-E423 IonicContact NZ-OE1 3.47Å; K393-E423 PolarHBondContact NZ-OE1 3.4Å; K393-E423 IonicContact NZ-OE2 2.77Å; K393-E423 PolarHBondContact NZ-OE2 3.01Å; K393-E423 VanDerWaalsContact NZ-OE2 3.12Å; K393-R426 VanDerWaalsContact CD-NH1 3.29Å
394	S	56.3	Low	56.3	Low	118 Å²	118	90.2 Å²	90.2	83%	0.825	50%	0.502	S	S	*	.			trans	-62	101.3	170.6	54.1	0	0	0	0	110.1	H396	S394-H396 PolarHBondContact O-N 3.11Å
395	I	62.8	Low	58.9	Low	88 Å²	88	81.7 Å²	81.7	45%	0.451	46%	0.462	S	S	.	.			trans	-71.6	116.6	179.7	-55.4	179.3	0	0	0	107.9	K393 E399	K393-I395 PolarHBondContact O-N 3.04Å; I395-E399 HydrophobicContact CG2-CB 4.12Å
396	H	66	Low	61.2	Low	35 Å²	35	81.6 Å²	81.6	16%	0.162	46%	0.455	C	S	.	.			trans	-67.3	134.9	174.7	-170.6	-77.8	0	0	0	108.8	C369 E373 S394 F398 E399 I429	C369-H396 PolarHBondContact O-CE1 3.47Å; E373-H396 VanDerWaalsContact CG-NE2 3.32Å; E373-H396 WeakPolarHBondContact CG-NE2 3.48Å; E373-H396 IonicContact OE1-NE2 2.63Å; S394-H396 PolarHBondContact O-N 3.11Å; H396-F398 VanDerWaalsContact C-N 3.28Å; H396-F398 VanDerWaalsContact ND1-CB 3.33Å; H396-F398 WeakPolarHBondContact ND1-CB 3.35Å; H396-F398 PolarHBondContact ND1-N 3.23Å; H396-F398 PolarHBondContact O-N 3.26Å; H396-E399 HydrophobicContact CB-CB 4.42Å; H396-E399 WeakPolarHBondContact O-CA 3.33Å; H396-E399 WeakPolarHBondContact O-CB 3.35Å; H396-E399 PolarHBondContact O-N 3.49Å; H396-I429 HydrophobicContact CB-CD1 4.44Å; H396-I429 HydrophobicContact CB-CG2 4.33Å
397	P	68.9	Low	63.5	Low	58 Å²	58	76.2 Å²	76.2	38%	0.377	42%	0.422	S	S	.	.	H	α-helix	trans	-55.7	-42.2	-174.7	16.6	-29.8	0	0	0	113	A372 E399 I400	A372-P397 HydrophobicContact CB-CB 4.42Å; A372-P397 HydrophobicContact CB-CG 3.97Å; A372-P397 WeakPolarHBondContact O-CG 3.26Å; P397-E399 PolarHBondContact O-N 2.82Å; P397-E399 VanDerWaalsContact O-N 3.16Å; P397-I400 PolarHBondContact O-N 3.05Å
398	F	80.5	Confident	65.5	Low	2 Å²	2	76.6 Å²	76.6	1%	0.009	41%	0.413	C	S	.	.	H	α-helix	trans	-62.8	-15.5	174	-164	-126.9	0	0	0	115	Y359 F365 A368 C369 A372 H396 I400 E401 L402 I429	Y359-F398 HydrophobicContact CE1-CE2 4.34Å; Y359-F398 AromaticContact CE1-CZ 3.95Å; Y359-F398 HydrophobicContact CE1-CZ 3.95Å; Y359-F398 HydrophobicContact CE2-CZ 4.05Å; Y359-F398 AromaticContact CZ-CE2 3.9Å; Y359-F398 AromaticContact CZ-CZ 3.53Å; Y359-F398 VanDerWaalsContact OH-CE2 3.3Å; Y359-F398 WeakPolarHBondContact OH-CE2 3.5Å; Y359-F398 WeakPolarHBondContact OH-CZ 3.25Å; F365-F398 HydrophobicContact CD2-CE1 4.36Å; F365-F398 AromaticContact CE2-CE1 3.69Å; F365-F398 HydrophobicContact CE2-CE1 3.69Å; F365-F398 HydrophobicContact CE2-CZ 4.21Å; F365-F398 AromaticContact CZ-CE1 3.79Å; F365-F398 HydrophobicContact CZ-CE1 3.79Å; A368-F398 HydrophobicContact CB-CE1 4.28Å; A368-F398 HydrophobicContact CB-CE2 3.68Å; A368-F398 HydrophobicContact CB-CZ 3.53Å; C369-F398 HydrophobicContact CB-CD1 4.34Å; C369-F398 VanDerWaalsContact SG-CD1 3.5Å; C369-F398 WeakPolarHBondContact SG-CE1 3.47Å; A372-F398 HydrophobicContact CB-CB 3.74Å; A372-F398 HydrophobicContact CB-CG 4.45Å; H396-F398 VanDerWaalsContact C-N 3.28Å; H396-F398 VanDerWaalsContact ND1-CB 3.33Å; H396-F398 WeakPolarHBondContact ND1-CB 3.35Å; H396-F398 PolarHBondContact ND1-N 3.23Å; H396-F398 PolarHBondContact O-N 3.26Å; F398-I400 PolarHBondContact O-N 3.43Å; F398-E401 HydrophobicContact CD2-CB 4.16Å; F398-E401 HydrophobicContact CD2-CG 4.5Å; F398-E401 VanDerWaalsContact CD2-OE2 3.31Å; F398-E401 WeakPolarHBondContact CD2-OE2 3.43Å; F398-E401 HydrophobicContact CE2-CB 4.49Å; F398-E401 HydrophobicContact CE2-CG 4.38Å; F398-E401 WeakPolarHBondContact CE2-OE2 3.27Å; F398-E401 PolarHBondContact O-N 2.58Å; F398-L402 HydrophobicContact CD1-CB 4.47Å; F398-L402 HydrophobicContact CD1-CD2 4.49Å; F398-L402 HydrophobicContact CE1-CB 4.41Å; F398-L402 HydrophobicContact CE1-CD2 4.24Å; F398-L402 VanDerWaalsContact O-CB 3.26Å; F398-L402 WeakPolarHBondContact O-CB 3.43Å; F398-L402 PolarHBondContact O-N 3.37Å; F398-I429 HydrophobicContact CB-CD1 4.05Å; F398-I429 HydrophobicContact CD1-CD1 3.85Å; F398-I429 HydrophobicContact CD1-CG1 3.89Å; F398-I429 HydrophobicContact CG-CD1 4.35Å
399	E	80.9	Confident	67.5	Low	6 Å²	6	73.6 Å²	73.6	3%	0.028	38%	0.383	C	S	.	.	H	α-helix	trans	-61.8	-36	176.7	-168	-176.2	132.6	0	0	110.8	I395 H396 P397 A403 P422 A425 R426 I429	I395-E399 HydrophobicContact CG2-CB 4.12Å; H396-E399 HydrophobicContact CB-CB 4.42Å; H396-E399 WeakPolarHBondContact O-CA 3.33Å; H396-E399 WeakPolarHBondContact O-CB 3.35Å; H396-E399 PolarHBondContact O-N 3.49Å; P397-E399 PolarHBondContact O-N 2.82Å; P397-E399 VanDerWaalsContact O-N 3.16Å; E399-A403 WeakPolarHBondContact O-CA 3.36Å; E399-A403 WeakPolarHBondContact O-CB 3.45Å; E399-A403 PolarHBondContact O-N 2.97Å; E399-P422 WeakPolarHBondContact OE1-CB 3.37Å; E399-A425 HydrophobicContact CG-CB 4.05Å; E399-R426 HydrophobicContact CG-CB 4.19Å; E399-R426 IonicContact OE1-CZ 2.66Å; E399-R426 VanDerWaalsContact OE1-CZ 3.29Å; E399-R426 IonicContact OE1-NE 2.76Å; E399-R426 PolarHBondContact OE1-NE 2.96Å; E399-R426 IonicContact OE1-NH2 3.44Å; E399-R426 PolarHBondContact OE1-NH2 3.02Å; E399-R426 WeakPolarHBondContact OE2-CB 3.3Å; E399-R426 VanDerWaalsContact OE2-CG 3.32Å; E399-R426 WeakPolarHBondContact OE2-CG 3.35Å; E399-R426 IonicContact OE2-CZ 2.98Å; E399-R426 IonicContact OE2-NE 3.9Å; E399-R426 PolarHBondContact OE2-NE 3.4Å; E399-R426 IonicContact OE2-NH2 3.25Å; E399-I429 VanDerWaalsContact CA-CD1 3.5Å; E399-I429 HydrophobicContact CB-CD1 3.99Å
400	I	78.8	Confident	69.1	Low	103 Å²	103	72.1 Å²	72.1	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-70.6	-44.6	179.8	-60.1	175	0	0	0	110.9	P397 F398 N404	P397-I400 PolarHBondContact O-N 3.05Å; F398-I400 PolarHBondContact O-N 3.43Å; I400-N404 WeakPolarHBondContact O-CB 3.41Å; I400-N404 PolarHBondContact O-N 3.01Å; I400-N404 PolarHBondContact O-ND2 3.23Å
401	E	82.4	Confident	70.8	Confident	112 Å²	112	71 Å²	71	52%	0.523	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-53.7	176.5	-174.2	-175	159.4	0	0	110.4	Y359 F398 A403 N404 L405	Y359-E401 PolarHBondContact OH-OE1 3.4Å; F398-E401 HydrophobicContact CD2-CB 4.16Å; F398-E401 HydrophobicContact CD2-CG 4.5Å; F398-E401 VanDerWaalsContact CD2-OE2 3.31Å; F398-E401 WeakPolarHBondContact CD2-OE2 3.43Å; F398-E401 HydrophobicContact CE2-CB 4.49Å; F398-E401 HydrophobicContact CE2-CG 4.38Å; F398-E401 WeakPolarHBondContact CE2-OE2 3.27Å; F398-E401 PolarHBondContact O-N 2.58Å; E401-A403 PolarHBondContact O-N 2.87Å; E401-N404 PolarHBondContact O-N 2.98Å; E401-N404 VanDerWaalsContact O-N 3.1Å; E401-L405 PolarHBondContact O-N 2.8Å
402	L	86.1	Confident	72.6	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-67.6	-33.9	-176.8	-175	61.1	0	0	0	112.6	F365 F398 N404 L405 L420 A425 L428 I429	F365-L402 HydrophobicContact CE2-CD1 3.97Å; F365-L402 HydrophobicContact CE2-CD2 3.8Å; F365-L402 HydrophobicContact CZ-CD2 3.66Å; F398-L402 HydrophobicContact CD1-CB 4.47Å; F398-L402 HydrophobicContact CD1-CD2 4.49Å; F398-L402 HydrophobicContact CE1-CB 4.41Å; F398-L402 HydrophobicContact CE1-CD2 4.24Å; F398-L402 VanDerWaalsContact O-CB 3.26Å; F398-L402 WeakPolarHBondContact O-CB 3.43Å; F398-L402 PolarHBondContact O-N 3.37Å; L402-N404 VanDerWaalsContact C-N 3.26Å; L402-N404 PolarHBondContact O-N 2.92Å; L402-L405 HydrophobicContact CD1-CD2 4.15Å; L402-L405 VanDerWaalsContact O-CB 3.22Å; L402-L405 WeakPolarHBondContact O-CB 3.3Å; L402-L405 PolarHBondContact O-N 3.06Å; L402-L420 HydrophobicContact CD1-CD2 3.87Å; L402-L420 HydrophobicContact CD2-CD2 4.46Å; L402-L420 HydrophobicContact CG-CD2 3.7Å; L402-L420 WeakPolarHBondContact O-CB 3.45Å; L402-L420 VanDerWaalsContact O-CD2 3.27Å; L402-L420 WeakPolarHBondContact O-CD2 2.97Å; L402-A425 HydrophobicContact CB-CB 3.99Å; L402-A425 HydrophobicContact CD2-CB 4.1Å; L402-A425 HydrophobicContact CG-CB 3.91Å; L402-L428 HydrophobicContact CD2-CB 4.46Å; L402-L428 HydrophobicContact CD2-CD2 4.42Å; L402-I429 HydrophobicContact CD2-CD1 4.14Å; L402-I429 HydrophobicContact CD2-CG1 3.77Å
403	A	84.1	Confident	74	Confident	10 Å²	10	66.3 Å²	66.3	8%	0.083	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-31.4	173.5	0	0	0	0	0	112.6	E399 E401 R419 L420 G421 P422 A425	E399-A403 WeakPolarHBondContact O-CA 3.36Å; E399-A403 WeakPolarHBondContact O-CB 3.45Å; E399-A403 PolarHBondContact O-N 2.97Å; E401-A403 PolarHBondContact O-N 2.87Å; A403-R419 WeakPolarHBondContact O-CB 3.25Å; A403-L420 PolarHBondContact O-N 3.37Å; A403-L420 VanDerWaalsContact O-N 3.16Å; A403-G421 PolarHBondContact O-N 3.01Å; A403-P422 HydrophobicContact CB-CB 4.38Å; A403-A425 HydrophobicContact CB-CB 3.95Å
404	N	85.9	Confident	75.1	Confident	72 Å²	72	63.3 Å²	63.3	39%	0.385	36%	0.358	S	S	.	.	H	α-helix	trans	-85.1	-7.1	179.8	-76.2	-54.5	0	0	0	114.2	I400 E401 L402 E406 R419	I400-N404 WeakPolarHBondContact O-CB 3.41Å; I400-N404 PolarHBondContact O-N 3.01Å; I400-N404 PolarHBondContact O-ND2 3.23Å; E401-N404 PolarHBondContact O-N 2.98Å; E401-N404 VanDerWaalsContact O-N 3.1Å; L402-N404 VanDerWaalsContact C-N 3.26Å; L402-N404 PolarHBondContact O-N 2.92Å; N404-E406 PolarHBondContact O-N 3.37Å; N404-R419 WeakPolarHBondContact OD1-CD 3.46Å; N404-R419 PolarHBondContact OD1-NH1 2.81Å
405	L	86.5	Confident	76.1	Confident	23 Å²	23	59.2 Å²	59.2	12%	0.12	33%	0.329	C	S	.	.			trans	-47.6	122.9	175.3	-179.9	66.2	0	0	0	111.5	A354 I355 V358 E401 L402 I407 L420	A354-L405 HydrophobicContact CB-CD2 4.32Å; A354-L405 HydrophobicContact CB-CG 4.43Å; I355-L405 HydrophobicContact CB-CD2 4.44Å; I355-L405 HydrophobicContact CG1-CD2 3.59Å; V358-L405 HydrophobicContact CB-CD1 4.47Å; V358-L405 HydrophobicContact CG2-CD1 3.63Å; E401-L405 PolarHBondContact O-N 2.8Å; L402-L405 HydrophobicContact CD1-CD2 4.15Å; L402-L405 VanDerWaalsContact O-CB 3.22Å; L402-L405 WeakPolarHBondContact O-CB 3.3Å; L402-L405 PolarHBondContact O-N 3.06Å; L405-I407 PolarHBondContact O-N 3.26Å; L405-L420 HydrophobicContact CB-CB 4.41Å; L405-L420 PolarHBondContact O-N 2.84Å
406	E	84.4	Confident	76.8	Confident	95 Å²	95	57.8 Å²	57.8	44%	0.444	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	110.5	-178.2	-165.1	-170.7	112.4	0	0	111.3	N404 K417	N404-E406 PolarHBondContact O-N 3.37Å; E406-K417 HydrophobicContact CG-CB 4.3Å; E406-K417 HydrophobicContact CG-CG 4.34Å; E406-K417 WeakPolarHBondContact OE1-CE 3.06Å; E406-K417 WeakPolarHBondContact OE1-CG 3.34Å; E406-K417 IonicContact OE1-NZ 2.65Å; E406-K417 PolarHBondContact OE1-NZ 3.3Å; E406-K417 IonicContact OE2-NZ 2.67Å; E406-K417 PolarHBondContact OE2-NZ 3.37Å
407	I	81.7	Confident	77.5	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	109.2	170.8	-54.8	149.1	0	0	0	108.1	E350 I351 A354 L405 R409 R418 L420	E350-I407 HydrophobicContact CB-CG2 3.84Å; I351-I407 HydrophobicContact CD1-CD1 4.45Å; I351-I407 HydrophobicContact CG1-CD1 3.8Å; I351-I407 HydrophobicContact CG1-CG1 4.21Å; I351-I407 HydrophobicContact CG1-CG2 4.17Å; A354-I407 HydrophobicContact CB-CG1 4.25Å; L405-I407 PolarHBondContact O-N 3.26Å; I407-R409 HydrophobicContact CG2-CG 4.1Å; I407-R418 WeakPolarHBondContact CA-O 3.47Å; I407-R418 WeakPolarHBondContact CB-O 3.49Å; I407-R418 PolarHBondContact N-O 2.81Å; I407-R418 PolarHBondContact O-N 3.2Å; I407-L420 HydrophobicContact CD1-CB 4.18Å; I407-L420 HydrophobicContact CD1-CD1 3.88Å
408	R	77.6	Confident	78.2	Confident	153 Å²	153	67.1 Å²	67.1	58%	0.577	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	123	168.4	-170.8	179.3	-169.7	175.7	5.6	109.9	S415	R408-S415 PolarHBondContact NE-OG 2.96Å; R408-S415 PolarHBondContact NH2-OG 3.19Å
409	R	70.7	Confident	78.5	Confident	60 Å²	60	75.5 Å²	75.5	23%	0.226	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.4	172.2	-55.8	-173.2	163.8	-116.6	0.4	110	T348 E350 I407 L414 S415 T416	T348-R409 PolarHBondContact OG1-NH2 2.96Å; E350-R409 HydrophobicContact CB-CG 4.12Å; E350-R409 HydrophobicContact CG-CB 4.37Å; E350-R409 HydrophobicContact CG-CG 3.97Å; E350-R409 WeakPolarHBondContact OE1-CB 3.42Å; E350-R409 WeakPolarHBondContact OE1-CD 3.33Å; E350-R409 WeakPolarHBondContact OE1-CG 3.39Å; E350-R409 IonicContact OE1-CZ 3.91Å; E350-R409 VanDerWaalsContact OE1-CZ 3.26Å; E350-R409 IonicContact OE1-NE 2.65Å; E350-R409 PolarHBondContact OE1-NE 3.22Å; E350-R409 IonicContact OE1-NH1 2.72Å; E350-R409 PolarHBondContact OE1-NH1 3.28Å; E350-R409 IonicContact OE2-CZ 3.55Å; E350-R409 VanDerWaalsContact OE2-CZ 3.25Å; E350-R409 IonicContact OE2-NE 2.7Å; E350-R409 IonicContact OE2-NH1 3.26Å; E350-R409 PolarHBondContact OE2-NH1 3.5Å; E350-R409 IonicContact OE2-NH2 2.7Å; I407-R409 HydrophobicContact CG2-CG 4.1Å; R409-L414 VanDerWaalsContact O-O 3.13Å; R409-S415 CarbonylContact O-C 3.47Å; R409-S415 VanDerWaalsContact O-CA 3.32Å; R409-S415 WeakPolarHBondContact O-CA 3.39Å; R409-T416 PolarHBondContact N-O 3.16Å; R409-T416 PolarHBondContact O-N 3.03Å
410	G	63.6	Low	78.7	Confident	40 Å²	40	76 Å²	76	41%	0.412	39%	0.389	S	S	.	.	S	Bend	trans	73.8	-178.9	-178	0	0	0	0	0	114.2
411	A	67.4	Low	78.9	Confident	72 Å²	72	72.2 Å²	72.2	60%	0.595	38%	0.375	S	S	*	.	S	Bend	trans	-135.9	161.1	-177.3	0	0	0	0	0	111.2	I413 L414	A411-I413 PolarHBondContact O-N 2.68Å; A411-L414 WeakPolarHBondContact O-CB 3.29Å; A411-L414 PolarHBondContact O-N 3.48Å; A411-L414 VanDerWaalsContact O-N 3.11Å
412	G	71.1	Confident	79	Confident	60 Å²	60	70.2 Å²	70.2	62%	0.619	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	56.6	-135.6	-177.1	0	0	0	0	0	112.5	L414 S415	G412-L414 PolarHBondContact O-N 2.95Å; G412-S415 WeakPolarHBondContact O-CB 3.46Å; G412-S415 PolarHBondContact O-N 3.29Å; G412-S415 VanDerWaalsContact O-N 3.11Å
413	I	69.2	Low	78.9	Confident	152 Å²	152	74.1 Å²	74.1	78%	0.779	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-59.2	-24.6	177.3	-70.1	167.2	0	0	0	112.4	A411 S415	A411-I413 PolarHBondContact O-N 2.68Å; I413-S415 VanDerWaalsContact C-N 3.26Å; I413-S415 PolarHBondContact O-N 3.02Å
414	L	72.5	Confident	78.9	Confident	63 Å²	63	75 Å²	75	33%	0.33	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-84.3	2.6	-179.5	-49.1	-178.9	0	0	0	113.5	V7 R409 A411 G412 T416	V7-L414 VanDerWaalsContact N-CD2 3.29Å; V7-L414 WeakPolarHBondContact O-CD1 3.47Å; V7-L414 WeakPolarHBondContact O-CD2 3.32Å; R409-L414 VanDerWaalsContact O-O 3.13Å; A411-L414 WeakPolarHBondContact O-CB 3.29Å; A411-L414 PolarHBondContact O-N 3.48Å; A411-L414 VanDerWaalsContact O-N 3.11Å; G412-L414 PolarHBondContact O-N 2.95Å; L414-T416 PolarHBondContact O-N 3.32Å
415	S	76.4	Confident	78.9	Confident	32 Å²	32	71.6 Å²	71.6	22%	0.224	37%	0.374	C	S	.	.			trans	-73.8	79.5	-173.5	178.2	0	0	0	0	112.5	R408 R409 G412 I413	R408-S415 PolarHBondContact NE-OG 2.96Å; R408-S415 PolarHBondContact NH2-OG 3.19Å; R409-S415 CarbonylContact O-C 3.47Å; R409-S415 VanDerWaalsContact O-CA 3.32Å; R409-S415 WeakPolarHBondContact O-CA 3.39Å; G412-S415 WeakPolarHBondContact O-CB 3.46Å; G412-S415 PolarHBondContact O-N 3.29Å; G412-S415 VanDerWaalsContact O-N 3.11Å; I413-S415 VanDerWaalsContact C-N 3.26Å; I413-S415 PolarHBondContact O-N 3.02Å
416	T	78.5	Confident	78.9	Confident	57 Å²	57	73 Å²	73	35%	0.35	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	131.5	173.4	64	0	0	0	0	111.5	R409 L414	R409-T416 PolarHBondContact N-O 3.16Å; R409-T416 PolarHBondContact O-N 3.03Å; L414-T416 PolarHBondContact O-N 3.32Å
417	K	80.4	Confident	78.9	Confident	138 Å²	138	71.9 Å²	71.9	60%	0.6	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.8	170.7	-66	176.2	173.4	-95.9	0	109.1	E406	E406-K417 HydrophobicContact CG-CB 4.3Å; E406-K417 HydrophobicContact CG-CG 4.34Å; E406-K417 WeakPolarHBondContact OE1-CE 3.06Å; E406-K417 WeakPolarHBondContact OE1-CG 3.34Å; E406-K417 IonicContact OE1-NZ 2.65Å; E406-K417 PolarHBondContact OE1-NZ 3.3Å; E406-K417 IonicContact OE2-NZ 2.67Å; E406-K417 PolarHBondContact OE2-NZ 3.37Å
418	R	83.4	Confident	79.2	Confident	151 Å²	151	71.9 Å²	71.9	57%	0.57	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	150.8	169.8	-67.2	-173.2	178.7	-175.9	-1	109.8	I407	I407-R418 WeakPolarHBondContact CA-O 3.47Å; I407-R418 WeakPolarHBondContact CB-O 3.49Å; I407-R418 PolarHBondContact N-O 2.81Å; I407-R418 PolarHBondContact O-N 3.2Å
419	R	86.9	Confident	79.6	Confident	178 Å²	178	64.8 Å²	64.8	67%	0.672	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	153.9	168.8	-71.3	-176	-175.7	-179.8	11	109.7	A403 N404 G421	A403-R419 WeakPolarHBondContact O-CB 3.25Å; N404-R419 WeakPolarHBondContact OD1-CD 3.46Å; N404-R419 PolarHBondContact OD1-NH1 2.81Å; R419-G421 VanDerWaalsContact C-N 3.33Å
420	L	84.3	Confident	80.3	Confident	17 Å²	17	64.7 Å²	64.7	9%	0.089	34%	0.344	C	S	.	.			trans	-64.7	-37.4	179.7	-168.4	72.2	0	0	0	112.5	I351 L402 A403 L405 I407 F424 A425	I351-L420 HydrophobicContact CG2-CD1 3.48Å; I351-L420 VanDerWaalsContact CG2-CD1 3.48Å; L402-L420 HydrophobicContact CD1-CD2 3.87Å; L402-L420 HydrophobicContact CD2-CD2 4.46Å; L402-L420 HydrophobicContact CG-CD2 3.7Å; L402-L420 WeakPolarHBondContact O-CB 3.45Å; L402-L420 VanDerWaalsContact O-CD2 3.27Å; L402-L420 WeakPolarHBondContact O-CD2 2.97Å; A403-L420 PolarHBondContact O-N 3.37Å; A403-L420 VanDerWaalsContact O-N 3.16Å; L405-L420 HydrophobicContact CB-CB 4.41Å; L405-L420 PolarHBondContact O-N 2.84Å; I407-L420 HydrophobicContact CD1-CB 4.18Å; I407-L420 HydrophobicContact CD1-CD1 3.88Å; L420-F424 HydrophobicContact CD1-CD1 3.49Å; L420-F424 VanDerWaalsContact CD1-CD1 3.49Å; L420-F424 HydrophobicContact CD1-CE1 3.92Å; L420-F424 HydrophobicContact CD1-CG 4.26Å; L420-F424 HydrophobicContact CD2-CD1 4Å; L420-F424 HydrophobicContact CG-CB 4.22Å; L420-F424 HydrophobicContact CG-CD1 3.7Å; L420-F424 HydrophobicContact CG-CG 4.32Å; L420-A425 HydrophobicContact CD2-CB 4.25Å
421	G	84.7	Confident	81.3	Confident	23 Å²	23	64.9 Å²	64.9	24%	0.237	34%	0.335	C	S	.	.			trans	84.2	149	179.1	0	0	0	0	0	113.9	A403 R419 E423 F424 A425	A403-G421 PolarHBondContact O-N 3.01Å; R419-G421 VanDerWaalsContact C-N 3.33Å; G421-E423 PolarHBondContact O-N 3.41Å; G421-F424 PolarHBondContact O-N 3.34Å; G421-A425 PolarHBondContact O-N 3.41Å
422	P	84.4	Confident	82.1	Confident	70 Å²	70	63.8 Å²	63.8	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-64.3	-44.3	-167.8	23.4	-33.5	0	0	0	113.7	E399 A403 F424 A425 R426	E399-P422 WeakPolarHBondContact OE1-CB 3.37Å; A403-P422 HydrophobicContact CB-CB 4.38Å; P422-F424 PolarHBondContact O-N 2.96Å; P422-A425 PolarHBondContact O-N 3.27Å; P422-R426 WeakPolarHBondContact O-CB 3.22Å; P422-R426 PolarHBondContact O-N 3.33Å
423	E	83.2	Confident	82.7	Confident	84 Å²	84	62.5 Å²	62.5	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-65.5	-25	179	-60.7	-63.2	141.2	0	0	112.8	K393 G421 R426 R427	K393-E423 IonicContact NZ-OE1 3.47Å; K393-E423 PolarHBondContact NZ-OE1 3.4Å; K393-E423 IonicContact NZ-OE2 2.77Å; K393-E423 PolarHBondContact NZ-OE2 3.01Å; K393-E423 VanDerWaalsContact NZ-OE2 3.12Å; G421-E423 PolarHBondContact O-N 3.41Å; E423-R426 IonicContact OE1-CZ 2.68Å; E423-R426 IonicContact OE1-NH1 2.83Å; E423-R426 PolarHBondContact OE1-NH1 2.81Å; E423-R426 IonicContact OE1-NH2 2.68Å; E423-R426 PolarHBondContact OE1-NH2 3.42Å; E423-R426 IonicContact OE2-CZ 3.98Å; E423-R426 IonicContact OE2-NH1 3.26Å; E423-R426 PolarHBondContact OE2-NH1 2.94Å; E423-R427 WeakPolarHBondContact O-CG 3.19Å; E423-R427 PolarHBondContact O-N 3.47Å; E423-R427 PolarHBondContact O-NE 2.94Å
424	F	84.2	Confident	83.4	Confident	30 Å²	30	57.7 Å²	57.7	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-83.5	-40.7	173.5	-161	-79.4	0	0	0	111.6	L347 I351 L420 G421 P422 R427 L428	L347-F424 HydrophobicContact CB-CZ 3.81Å; L347-F424 HydrophobicContact CD1-CE1 4.07Å; L347-F424 HydrophobicContact CD1-CZ 3.98Å; L347-F424 HydrophobicContact CG-CE1 4.12Å; L347-F424 HydrophobicContact CG-CZ 3.76Å; I351-F424 HydrophobicContact CG2-CE1 4.1Å; L420-F424 HydrophobicContact CD1-CD1 3.49Å; L420-F424 VanDerWaalsContact CD1-CD1 3.49Å; L420-F424 HydrophobicContact CD1-CE1 3.92Å; L420-F424 HydrophobicContact CD1-CG 4.26Å; L420-F424 HydrophobicContact CD2-CD1 4Å; L420-F424 HydrophobicContact CG-CB 4.22Å; L420-F424 HydrophobicContact CG-CD1 3.7Å; L420-F424 HydrophobicContact CG-CG 4.32Å; G421-F424 PolarHBondContact O-N 3.34Å; P422-F424 PolarHBondContact O-N 2.96Å; F424-R427 PolarHBondContact O-N 2.7Å; F424-L428 HydrophobicContact CD1-CD1 4.48Å; F424-L428 HydrophobicContact CE1-CD1 3.85Å; F424-L428 WeakPolarHBondContact O-CB 3.31Å; F424-L428 PolarHBondContact O-N 3.03Å; F424-L428 VanDerWaalsContact O-N 3.09Å
425	A	86.5	Confident	84	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-57	-48.9	171.9	0	0	0	0	0	111.8	E399 L402 A403 L420 G421 P422 R427 L428 I429	E399-A425 HydrophobicContact CG-CB 4.05Å; L402-A425 HydrophobicContact CB-CB 3.99Å; L402-A425 HydrophobicContact CD2-CB 4.1Å; L402-A425 HydrophobicContact CG-CB 3.91Å; A403-A425 HydrophobicContact CB-CB 3.95Å; L420-A425 HydrophobicContact CD2-CB 4.25Å; G421-A425 PolarHBondContact O-N 3.41Å; P422-A425 PolarHBondContact O-N 3.27Å; A425-R427 PolarHBondContact O-N 3.44Å; A425-L428 PolarHBondContact O-N 2.91Å; A425-L428 VanDerWaalsContact O-N 3.15Å; A425-I429 WeakPolarHBondContact O-CG1 3.26Å; A425-I429 PolarHBondContact O-N 3.1Å
426	R	85	Confident	84.3	Confident	51 Å²	51	67 Å²	67	19%	0.192	32%	0.315	C	S	.	.	H	α-helix	trans	-59.1	-46.5	179.4	-165.1	-180	-53.8	122.9	3.4	112.4	K393 E399 P422 E423 L428 I429 K430	K393-R426 VanDerWaalsContact CD-NH1 3.29Å; E399-R426 HydrophobicContact CG-CB 4.19Å; E399-R426 IonicContact OE1-CZ 2.66Å; E399-R426 VanDerWaalsContact OE1-CZ 3.29Å; E399-R426 IonicContact OE1-NE 2.76Å; E399-R426 PolarHBondContact OE1-NE 2.96Å; E399-R426 IonicContact OE1-NH2 3.44Å; E399-R426 PolarHBondContact OE1-NH2 3.02Å; E399-R426 WeakPolarHBondContact OE2-CB 3.3Å; E399-R426 VanDerWaalsContact OE2-CG 3.32Å; E399-R426 WeakPolarHBondContact OE2-CG 3.35Å; E399-R426 IonicContact OE2-CZ 2.98Å; E399-R426 IonicContact OE2-NE 3.9Å; E399-R426 PolarHBondContact OE2-NE 3.4Å; E399-R426 IonicContact OE2-NH2 3.25Å; P422-R426 WeakPolarHBondContact O-CB 3.22Å; P422-R426 PolarHBondContact O-N 3.33Å; E423-R426 IonicContact OE1-CZ 2.68Å; E423-R426 IonicContact OE1-NH1 2.83Å; E423-R426 PolarHBondContact OE1-NH1 2.81Å; E423-R426 IonicContact OE1-NH2 2.68Å; E423-R426 PolarHBondContact OE1-NH2 3.42Å; E423-R426 IonicContact OE2-CZ 3.98Å; E423-R426 IonicContact OE2-NH1 3.26Å; E423-R426 PolarHBondContact OE2-NH1 2.94Å; R426-L428 VanDerWaalsContact C-N 3.3Å; R426-L428 PolarHBondContact O-N 3.49Å; R426-I429 PolarHBondContact O-N 3.16Å; R426-K430 WeakPolarHBondContact O-CB 3.18Å; R426-K430 PolarHBondContact O-N 2.77Å
427	R	85.9	Confident	84.4	Confident	72 Å²	72	70 Å²	70	27%	0.272	34%	0.335	S	S	.	.	H	α-helix	trans	-57.3	-43.5	175.1	-82.6	-173.8	-81.8	-146.7	-4.7	112.4	E423 F424 A425 L431 I441 N442	E423-R427 WeakPolarHBondContact O-CG 3.19Å; E423-R427 PolarHBondContact O-N 3.47Å; E423-R427 PolarHBondContact O-NE 2.94Å; F424-R427 PolarHBondContact O-N 2.7Å; A425-R427 PolarHBondContact O-N 3.44Å; R427-L431 WeakPolarHBondContact O-CB 3.38Å; R427-L431 PolarHBondContact O-N 2.73Å; R427-I441 HydrophobicContact CB-CG2 3.58Å; R427-I441 HydrophobicContact CG-CG2 3.49Å; R427-I441 VanDerWaalsContact CG-CG2 3.49Å; R427-N442 VanDerWaalsContact CD-C 3.44Å; R427-N442 VanDerWaalsContact CD-O 3.27Å; R427-N442 WeakPolarHBondContact CD-O 3.47Å; R427-N442 WeakPolarHBondContact CD-OXT 3.03Å; R427-N442 WeakPolarHBondContact CG-O 3.14Å; R427-N442 VanDerWaalsContact CZ-OXT 3.31Å; R427-N442 PolarHBondContact NH1-OXT 3.18Å
428	L	86.6	Confident	84.4	Confident	6 Å²	6	69.9 Å²	69.9	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-74.1	-37.1	-176.6	-155	150.1	0	0	0	111.4	L341 L347 I355 F365 L402 F424 A425 R426 L431 F432	L341-L428 HydrophobicContact CD2-CD1 4.48Å; L347-L428 HydrophobicContact CD1-CD1 3.66Å; I355-L428 HydrophobicContact CD1-CD1 3.6Å; F365-L428 HydrophobicContact CD1-CD2 4.31Å; F365-L428 HydrophobicContact CD2-CD2 4.45Å; F365-L428 HydrophobicContact CE1-CD2 3.52Å; F365-L428 HydrophobicContact CE2-CD2 3.67Å; F365-L428 HydrophobicContact CZ-CD2 3.15Å; L402-L428 HydrophobicContact CD2-CB 4.46Å; L402-L428 HydrophobicContact CD2-CD2 4.42Å; F424-L428 HydrophobicContact CD1-CD1 4.48Å; F424-L428 HydrophobicContact CE1-CD1 3.85Å; F424-L428 WeakPolarHBondContact O-CB 3.31Å; F424-L428 PolarHBondContact O-N 3.03Å; F424-L428 VanDerWaalsContact O-N 3.09Å; A425-L428 PolarHBondContact O-N 2.91Å; A425-L428 VanDerWaalsContact O-N 3.15Å; R426-L428 VanDerWaalsContact C-N 3.3Å; R426-L428 PolarHBondContact O-N 3.49Å; L428-L431 WeakPolarHBondContact O-CB 3.49Å; L428-F432 HydrophobicContact CD2-CD2 3.87Å; L428-F432 HydrophobicContact CD2-CE2 3.84Å; L428-F432 HydrophobicContact CG-CE2 4.39Å; L428-F432 VanDerWaalsContact O-CD2 3.29Å; L428-F432 WeakPolarHBondContact O-CD2 3.45Å; L428-F432 PolarHBondContact O-N 2.77Å
429	I	85.8	Confident	84.2	Confident	5 Å²	5	66.1 Å²	66.1	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-54.8	169.8	-67.6	168.5	0	0	0	110.1	H396 F398 E399 L402 A425 R426 L431 F432 T433	H396-I429 HydrophobicContact CB-CD1 4.44Å; H396-I429 HydrophobicContact CB-CG2 4.33Å; F398-I429 HydrophobicContact CB-CD1 4.05Å; F398-I429 HydrophobicContact CD1-CD1 3.85Å; F398-I429 HydrophobicContact CD1-CG1 3.89Å; F398-I429 HydrophobicContact CG-CD1 4.35Å; E399-I429 VanDerWaalsContact CA-CD1 3.5Å; E399-I429 HydrophobicContact CB-CD1 3.99Å; L402-I429 HydrophobicContact CD2-CD1 4.14Å; L402-I429 HydrophobicContact CD2-CG1 3.77Å; A425-I429 WeakPolarHBondContact O-CG1 3.26Å; A425-I429 PolarHBondContact O-N 3.1Å; R426-I429 PolarHBondContact O-N 3.16Å; I429-L431 PolarHBondContact O-N 3.24Å; I429-F432 CarbonylContact O-C 3.6Å; I429-F432 PolarHBondContact O-N 3.34Å; I429-T433 HydrophobicContact CG2-CG2 4.1Å; I429-T433 PolarHBondContact O-N 2.94Å; I429-T433 PolarHBondContact O-OG1 2.89Å; I429-T433 VanDerWaalsContact O-OG1 3.08Å
430	K	85.7	Confident	83.8	Confident	57 Å²	57	63.6 Å²	63.6	25%	0.248	33%	0.329	C	S	.	.	H	α-helix	trans	-50.4	-42.7	179.3	178.9	178.4	-178.7	167.8	0	112.3	R426 F432 S434 E439 I440	R426-K430 WeakPolarHBondContact O-CB 3.18Å; R426-K430 PolarHBondContact O-N 2.77Å; K430-F432 PolarHBondContact O-N 3.24Å; K430-S434 WeakPolarHBondContact O-CB 3.46Å; K430-S434 PolarHBondContact O-N 2.94Å; K430-E439 WeakPolarHBondContact CE-OE1 3.32Å; K430-E439 VanDerWaalsContact CE-OE2 3.24Å; K430-E439 WeakPolarHBondContact CE-OE2 3.08Å; K430-E439 IonicContact NZ-OE1 3.3Å; K430-E439 PolarHBondContact NZ-OE1 2.67Å; K430-E439 IonicContact NZ-OE2 2.72Å; K430-I440 PolarHBondContact NZ-O 3.11Å
431	L	84.3	Confident	83.2	Confident	44 Å²	44	66 Å²	66	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-58.8	-40.9	175.5	172.3	66.7	0	0	0	113.7	W344 R427 L428 I429 I441	W344-L431 HydrophobicContact CD2-CD1 4.44Å; W344-L431 HydrophobicContact CD2-CD2 3.5Å; W344-L431 VanDerWaalsContact CD2-CD2 3.5Å; W344-L431 HydrophobicContact CE3-CD1 4.11Å; W344-L431 HydrophobicContact CE3-CD2 3.93Å; W344-L431 HydrophobicContact CG-CD2 3.96Å; W344-L431 HydrophobicContact CH2-CD1 3.48Å; W344-L431 VanDerWaalsContact CH2-CD1 3.48Å; W344-L431 HydrophobicContact CH2-CD2 4.14Å; W344-L431 HydrophobicContact CH2-CG 4.41Å; W344-L431 HydrophobicContact CZ2-CD1 3.84Å; W344-L431 HydrophobicContact CZ2-CD2 3.71Å; W344-L431 HydrophobicContact CZ2-CG 4.31Å; W344-L431 HydrophobicContact CZ3-CD1 3.62Å; W344-L431 HydrophobicContact CZ3-CD2 4.23Å; R427-L431 WeakPolarHBondContact O-CB 3.38Å; R427-L431 PolarHBondContact O-N 2.73Å; L428-L431 WeakPolarHBondContact O-CB 3.49Å; I429-L431 PolarHBondContact O-N 3.24Å; L431-I441 HydrophobicContact CB-CD1 3.96Å; L431-I441 HydrophobicContact CD1-CD1 3.85Å
432	F	84.3	Confident	82.2	Confident	50 Å²	50	72.2 Å²	72.2	22%	0.219	37%	0.369	C	S	.	.	H	α-helix	trans	-92.8	-14.7	-177	-74.8	-76.5	0	0	0	113.8	W337 F365 Y366 L428 I429 K430	W337-F432 HydrophobicContact CH2-CE1 4.02Å; W337-F432 AromaticContact CH2-CE2 3.99Å; W337-F432 HydrophobicContact CH2-CE2 3.99Å; W337-F432 AromaticContact CH2-CZ 3.5Å; W337-F432 HydrophobicContact CH2-CZ 3.5Å; W337-F432 AromaticContact CZ3-CE1 3.91Å; W337-F432 HydrophobicContact CZ3-CE1 3.91Å; W337-F432 HydrophobicContact CZ3-CE2 4.4Å; W337-F432 AromaticContact CZ3-CZ 3.51Å; W337-F432 HydrophobicContact CZ3-CZ 3.51Å; F365-F432 HydrophobicContact CD1-CB 4.12Å; F365-F432 AromaticContact CD1-CD2 3.63Å; F365-F432 HydrophobicContact CD1-CD2 3.63Å; F365-F432 HydrophobicContact CD1-CE2 4.24Å; F365-F432 AromaticContact CD1-CG 3.83Å; F365-F432 HydrophobicContact CD1-CG 3.83Å; F365-F432 HydrophobicContact CE1-CB 3.97Å; F365-F432 AromaticContact CE1-CD2 3.48Å; F365-F432 HydrophobicContact CE1-CD2 3.48Å; F365-F432 VanDerWaalsContact CE1-CD2 3.48Å; F365-F432 HydrophobicContact CE1-CE2 4.29Å; F365-F432 AromaticContact CE1-CG 3.92Å; F365-F432 HydrophobicContact CE1-CG 3.92Å; Y366-F432 VanDerWaalsContact CD2-O 3.31Å; Y366-F432 WeakPolarHBondContact CD2-O 3.44Å; Y366-F432 WeakPolarHBondContact CE2-O 3.44Å; L428-F432 HydrophobicContact CD2-CD2 3.87Å; L428-F432 HydrophobicContact CD2-CE2 3.84Å; L428-F432 HydrophobicContact CG-CE2 4.39Å; L428-F432 VanDerWaalsContact O-CD2 3.29Å; L428-F432 WeakPolarHBondContact O-CD2 3.45Å; L428-F432 PolarHBondContact O-N 2.77Å; I429-F432 CarbonylContact O-C 3.6Å; I429-F432 PolarHBondContact O-N 3.34Å; K430-F432 PolarHBondContact O-N 3.24Å
433	T	84.4	Confident	82.1	Confident	33 Å²	33	72.4 Å²	72.4	20%	0.202	37%	0.365	C	S	.	.	H	α-helix	trans	-110.9	-22.5	-179.1	63.8	0	0	0	0	115	C369 E373 I429	C369-T433 HydrophobicContact CB-CG2 3.71Å; E373-T433 WeakPolarHBondContact OE1-CG2 3.43Å; I429-T433 HydrophobicContact CG2-CG2 4.1Å; I429-T433 PolarHBondContact O-N 2.94Å; I429-T433 PolarHBondContact O-OG1 2.89Å; I429-T433 VanDerWaalsContact O-OG1 3.08Å
434	S	84.1	Confident	82.1	Confident	50 Å²	50	71.7 Å²	71.7	35%	0.35	36%	0.363	S	S	.	.			trans	-68.6	147.3	179.1	-169.8	0	0	0	0	112.1	K430 N436 E439	K430-S434 WeakPolarHBondContact O-CB 3.46Å; K430-S434 PolarHBondContact O-N 2.94Å; S434-N436 PolarHBondContact OG-N 2.9Å; S434-E439 WeakPolarHBondContact CB-OE2 3.41Å; S434-E439 PolarHBondContact OG-OE2 3.29Å
435	K	84.8	Confident	82	Confident	207 Å²	207	74.1 Å²	74.1	90%	0.9	38%	0.376	S	S	*	.			trans	-102.7	-6	174.9	-62.4	178.8	-178.4	175.1	0	112.5
436	N	83.3	Confident	81.7	Confident	83 Å²	83	78.4 Å²	78.4	44%	0.444	40%	0.398	S	S	.	.			trans	-96.6	114.4	-175.6	178.7	9.2	0	0	0	110	S434 D438 E439	S434-N436 PolarHBondContact OG-N 2.9Å; N436-D438 VanDerWaalsContact C-N 3.29Å; N436-D438 PolarHBondContact O-N 2.89Å; N436-D438 PolarHBondContact OD1-N 2.65Å; N436-D438 VanDerWaalsContact OD1-N 3.14Å; N436-E439 HydrophobicContact CB-CB 3.98Å; N436-E439 WeakPolarHBondContact O-CB 3.49Å; N436-E439 PolarHBondContact O-N 3.48Å
437	P	80.6	Confident	81.5	Confident	120 Å²	120	80.1 Å²	80.1	78%	0.779	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-26	-178.2	29.8	-35.7	0	0	0	113.2	E439	P437-E439 VanDerWaalsContact C-N 3.28Å; P437-E439 PolarHBondContact O-N 3.14Å
438	D	80.4	Confident	81.2	Confident	136 Å²	136	80.7 Å²	80.7	73%	0.727	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	6	-176.1	-54.5	-47.7	0	0	0	112.4	N436 I440	N436-D438 VanDerWaalsContact C-N 3.29Å; N436-D438 PolarHBondContact O-N 2.89Å; N436-D438 PolarHBondContact OD1-N 2.65Å; N436-D438 VanDerWaalsContact OD1-N 3.14Å; D438-I440 PolarHBondContact O-N 3.11Å
439	E	79.3	Confident	80.8	Confident	73 Å²	73	86 Å²	86	34%	0.341	45%	0.448	S	S	.	.			trans	-80.7	107.8	-169.5	-147.7	-165.1	160.3	0	0	112.9	K430 S434 N436 P437 I441	K430-E439 WeakPolarHBondContact CE-OE1 3.32Å; K430-E439 VanDerWaalsContact CE-OE2 3.24Å; K430-E439 WeakPolarHBondContact CE-OE2 3.08Å; K430-E439 IonicContact NZ-OE1 3.3Å; K430-E439 PolarHBondContact NZ-OE1 2.67Å; K430-E439 IonicContact NZ-OE2 2.72Å; S434-E439 WeakPolarHBondContact CB-OE2 3.41Å; S434-E439 PolarHBondContact OG-OE2 3.29Å; N436-E439 HydrophobicContact CB-CB 3.98Å; N436-E439 WeakPolarHBondContact O-CB 3.49Å; N436-E439 PolarHBondContact O-N 3.48Å; P437-E439 VanDerWaalsContact C-N 3.28Å; P437-E439 PolarHBondContact O-N 3.14Å; E439-I441 WeakPolarHBondContact O-CG1 3.47Å; E439-I441 PolarHBondContact O-N 3.38Å
440	I	77	Confident	80.4	Confident	124 Å²	124	92.2 Å²	92.2	64%	0.636	48%	0.481	S	S	*	.			trans	-60.2	128.6	-177.9	-55.8	177.6	0	0	0	111.4	K430 D438 N442	K430-I440 PolarHBondContact NZ-O 3.11Å; D438-I440 PolarHBondContact O-N 3.11Å; I440-N442 WeakPolarHBondContact CG2-OD1 3.44Å
441	I	71.7	Confident	80	Confident	67 Å²	67	95.2 Å²	95.2	34%	0.344	50%	0.5	S	S	.	.			trans	-102.1	79.8	-178.3	-54.6	-175.4	0	0	0	108.9	R427 L431 E439	R427-I441 HydrophobicContact CB-CG2 3.58Å; R427-I441 HydrophobicContact CG-CG2 3.49Å; R427-I441 VanDerWaalsContact CG-CG2 3.49Å; L431-I441 HydrophobicContact CB-CD1 3.96Å; L431-I441 HydrophobicContact CD1-CD1 3.85Å; E439-I441 WeakPolarHBondContact O-CG1 3.47Å; E439-I441 PolarHBondContact O-N 3.38Å
442	N	65.3	Low	79.6	Confident	155 Å²	155	99.8 Å²	99.8	83%	0.829	53%	0.525	S	S	*	.			trans	-80.4	0	179.1	-75.7	-28.1	0	0	0	113.1	R427 I440	R427-N442 VanDerWaalsContact CD-C 3.44Å; R427-N442 VanDerWaalsContact CD-O 3.27Å; R427-N442 WeakPolarHBondContact CD-O 3.47Å; R427-N442 WeakPolarHBondContact CD-OXT 3.03Å; R427-N442 WeakPolarHBondContact CG-O 3.14Å; R427-N442 VanDerWaalsContact CZ-OXT 3.31Å; R427-N442 PolarHBondContact NH1-OXT 3.18Å; I440-N442 WeakPolarHBondContact CG2-OD1 3.44Å

Retrieved 442 of 442 residues in 142.6 ms (Link to these results)

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