A0A5K4EWK9_SCHMA Loading...

Beta-parvin-related

AlphaFold DB , UniProt , Accession A0A5K4EWK9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 330 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	41.4	Very low	50.5	Low	231 Å²	231	125.4 Å²	125.4	100%	1.138	71%	0.711	S	S	*	*				0	108.7	0	-69.9	179.7	-170.7	0	0	107.7	T3	M1-T3 PolarHBondContact O-N 2.89Å
2	T	43.1	Very low	51.6	Low	148 Å²	148	119.3 Å²	119.3	91%	0.908	68%	0.682	S	S	*	*			trans	-86.8	99.8	179.1	-52.9	0	0	0	0	107.9
3	T	47.9	Very low	53.2	Low	116 Å²	116	117.9 Å²	117.9	71%	0.712	67%	0.67	S	S	*	*			trans	-122.3	94.6	-178.9	47.5	0	0	0	0	111.2	M1 A5	M1-T3 PolarHBondContact O-N 2.89Å; T3-A5 PolarHBondContact O-N 3.02Å
4	M	45.3	Very low	54.2	Low	152 Å²	152	116.5 Å²	116.5	75%	0.749	66%	0.659	S	S	*	*			trans	51.8	59.8	130.8	-59.1	-91.8	-92.3	0	0	117.7	L7	M4-L7 HydrophobicContact CE-CD1 3.27Å; M4-L7 HydrophobicContact SD-CD1 3.4Å; M4-L7 WeakPolarHBondContact SD-CD1 3.49Å; M4-L7 HydrophobicContact SD-CG 4.41Å
5	A	52.9	Low	55.1	Low	98 Å²	98	112.8 Å²	112.8	81%	0.81	64%	0.643	S	S	*	*	S	Bend	trans	-90.4	-14.1	165.2	0	0	0	0	0	113.8	T3	T3-A5 PolarHBondContact O-N 3.02Å
6	G	49.5	Very low	56.2	Low	56 Å²	56	113.6 Å²	113.6	58%	0.577	64%	0.637	S	S	*	*	S	Bend	trans	-85.4	-20.2	-170.4	0	0	0	0	0	117
7	L	48.7	Very low	57	Low	97 Å²	97	112.2 Å²	112.2	51%	0.508	63%	0.627	S	S	.	*	H	α-helix	trans	-78.9	-28.5	-170.5	-75.4	167.3	0	0	0	114.4	M4 S9 H10 D11	M4-L7 HydrophobicContact CE-CD1 3.27Å; M4-L7 HydrophobicContact SD-CD1 3.4Å; M4-L7 WeakPolarHBondContact SD-CD1 3.49Å; M4-L7 HydrophobicContact SD-CG 4.41Å; L7-S9 PolarHBondContact O-N 3.27Å; L7-S9 VanDerWaalsContact O-N 3.13Å; L7-H10 PolarHBondContact O-N 2.81Å; L7-D11 PolarHBondContact O-N 3.42Å
8	K	53.6	Low	57.8	Low	184 Å²	184	110.6 Å²	110.6	80%	0.8	62%	0.617	S	S	*	*	H	α-helix	trans	-61.1	-27.4	-178.3	-79.8	-176.3	176	178.9	0	113.7	S12	K8-S12 PolarHBondContact O-N 3.5Å
9	S	57.6	Low	58.6	Low	71 Å²	71	109.5 Å²	109.5	50%	0.497	61%	0.614	S	S	.	*	H	α-helix	trans	-68.2	-47.5	179.6	167.6	0	0	0	0	111.9	L7 D11 S12 I13	L7-S9 PolarHBondContact O-N 3.27Å; L7-S9 VanDerWaalsContact O-N 3.13Å; S9-D11 PolarHBondContact O-N 2.73Å; S9-S12 WeakPolarHBondContact O-CB 3.36Å; S9-S12 PolarHBondContact O-N 2.96Å; S9-I13 WeakPolarHBondContact O-CG1 3.04Å; S9-I13 PolarHBondContact O-N 2.93Å; S9-I13 VanDerWaalsContact O-N 3.14Å
10	H	55.2	Low	59.1	Low	122 Å²	122	111.1 Å²	111.1	57%	0.565	61%	0.614	S	S	*	*	H	α-helix	trans	-67.1	-39.4	-176.6	-89.8	-88.1	0	0	0	112.3	L7 S12 I13 L14	L7-H10 PolarHBondContact O-N 2.81Å; H10-S12 VanDerWaalsContact C-N 3.27Å; H10-S12 PolarHBondContact O-N 3.25Å; H10-I13 PolarHBondContact O-N 3.16Å; H10-I13 VanDerWaalsContact O-N 3.13Å; H10-L14 WeakPolarHBondContact O-CG 3.44Å; H10-L14 PolarHBondContact O-N 3.35Å
11	D	60.1	Low	59.8	Low	104 Å²	104	112 Å²	112	56%	0.556	61%	0.612	S	S	*	*	H	α-helix	trans	-62.4	-35.6	175	-70.5	-25.8	0	0	0	112	L7 S9 S15	L7-D11 PolarHBondContact O-N 3.42Å; S9-D11 PolarHBondContact O-N 2.73Å; D11-S15 VanDerWaalsContact O-CB 3.31Å; D11-S15 WeakPolarHBondContact O-CB 3.25Å; D11-S15 PolarHBondContact O-N 2.96Å; D11-S15 PolarHBondContact O-OG 3.41Å
12	S	64.7	Low	61.3	Low	53 Å²	53	110.3 Å²	110.3	37%	0.371	59%	0.593	S	S	.	*	H	α-helix	trans	-67.3	-36.5	175.1	-167.2	0	0	0	0	112.2	K8 S9 H10 S15 K16	K8-S12 PolarHBondContact O-N 3.5Å; S9-S12 WeakPolarHBondContact O-CB 3.36Å; S9-S12 PolarHBondContact O-N 2.96Å; H10-S12 VanDerWaalsContact C-N 3.27Å; H10-S12 PolarHBondContact O-N 3.25Å; S12-S15 WeakPolarHBondContact CA-OG 3.45Å; S12-S15 PolarHBondContact O-OG 3.19Å; S12-S15 VanDerWaalsContact O-OG 3.04Å; S12-K16 WeakPolarHBondContact O-CB 3.29Å; S12-K16 VanDerWaalsContact O-CG 3.22Å; S12-K16 WeakPolarHBondContact O-CG 3.37Å; S12-K16 PolarHBondContact O-N 3.36Å; S12-K16 VanDerWaalsContact O-N 3.1Å
13	I	71.7	Confident	63	Low	101 Å²	101	109.3 Å²	109.3	52%	0.518	58%	0.576	S	S	.	*	H	α-helix	trans	-70.9	-43.8	177.2	-64.6	171.5	0	0	0	110.8	S9 H10 K16 L17	S9-I13 WeakPolarHBondContact O-CG1 3.04Å; S9-I13 PolarHBondContact O-N 2.93Å; S9-I13 VanDerWaalsContact O-N 3.14Å; H10-I13 PolarHBondContact O-N 3.16Å; H10-I13 VanDerWaalsContact O-N 3.13Å; I13-K16 PolarHBondContact O-N 3.24Å; I13-L17 PolarHBondContact O-N 2.71Å
14	L	67.4	Low	64.5	Low	98 Å²	98	112.5 Å²	112.5	51%	0.513	58%	0.575	S	S	.	*	H	α-helix	trans	-65	-44.9	178.3	-70.3	175.4	0	0	0	111.9	H10 K16 L17 D18	H10-L14 WeakPolarHBondContact O-CG 3.44Å; H10-L14 PolarHBondContact O-N 3.35Å; L14-K16 VanDerWaalsContact C-N 3.32Å; L14-K16 PolarHBondContact O-N 2.96Å; L14-L17 WeakPolarHBondContact O-CB 3.3Å; L14-L17 PolarHBondContact O-N 3.35Å; L14-L17 VanDerWaalsContact O-N 3.1Å; L14-D18 PolarHBondContact O-N 3.11Å
15	S	68.2	Low	66.2	Low	61 Å²	61	111.6 Å²	111.6	43%	0.427	57%	0.566	S	S	.	*	H	α-helix	trans	-63.4	-36.7	176.1	54.8	0	0	0	0	112.6	D11 S12 T19	D11-S15 VanDerWaalsContact O-CB 3.31Å; D11-S15 WeakPolarHBondContact O-CB 3.25Å; D11-S15 PolarHBondContact O-N 2.96Å; D11-S15 PolarHBondContact O-OG 3.41Å; S12-S15 WeakPolarHBondContact CA-OG 3.45Å; S12-S15 PolarHBondContact O-OG 3.19Å; S12-S15 VanDerWaalsContact O-OG 3.04Å; S15-T19 WeakPolarHBondContact O-CB 3.39Å; S15-T19 PolarHBondContact O-N 2.9Å; S15-T19 PolarHBondContact O-OG1 3.32Å
16	K	72.8	Confident	67.4	Low	126 Å²	126	109.2 Å²	109.2	55%	0.548	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-44.8	170.4	-77.9	173.7	-178.5	176.6	0	111.3	S12 I13 L14 D18 T19 F20	S12-K16 WeakPolarHBondContact O-CB 3.29Å; S12-K16 VanDerWaalsContact O-CG 3.22Å; S12-K16 WeakPolarHBondContact O-CG 3.37Å; S12-K16 PolarHBondContact O-N 3.36Å; S12-K16 VanDerWaalsContact O-N 3.1Å; I13-K16 PolarHBondContact O-N 3.24Å; L14-K16 VanDerWaalsContact C-N 3.32Å; L14-K16 PolarHBondContact O-N 2.96Å; K16-D18 PolarHBondContact O-N 2.86Å; K16-T19 WeakPolarHBondContact O-CB 3.42Å; K16-T19 PolarHBondContact O-N 2.88Å; K16-F20 WeakPolarHBondContact O-CD2 3.48Å; K16-F20 PolarHBondContact O-N 2.98Å
17	L	69.6	Low	68.7	Low	90 Å²	90	115 Å²	115	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-60.8	-44.1	178.9	-168.1	80.5	0	0	0	112.1	I13 L14 T19 F20 K21	I13-L17 PolarHBondContact O-N 2.71Å; L14-L17 WeakPolarHBondContact O-CB 3.3Å; L14-L17 PolarHBondContact O-N 3.35Å; L14-L17 VanDerWaalsContact O-N 3.1Å; L17-T19 VanDerWaalsContact C-N 3.32Å; L17-T19 PolarHBondContact O-N 3.36Å; L17-F20 PolarHBondContact O-N 3.38Å; L17-K21 PolarHBondContact O-N 2.72Å
18	D	70.9	Confident	70.3	Confident	82 Å²	82	114.8 Å²	114.8	44%	0.439	55%	0.55	S	S	.	*	H	α-helix	trans	-64.8	-38.3	176.4	-75.2	-24	0	0	0	111.9	L14 K16 F20 K21 R22	L14-D18 PolarHBondContact O-N 3.11Å; K16-D18 PolarHBondContact O-N 2.86Å; D18-F20 VanDerWaalsContact C-N 3.33Å; D18-F20 PolarHBondContact O-N 3.16Å; D18-K21 PolarHBondContact O-N 2.9Å; D18-R22 WeakPolarHBondContact O-CG 3.46Å; D18-R22 PolarHBondContact O-N 2.88Å
19	T	72.5	Confident	71.6	Confident	90 Å²	90	110.1 Å²	110.1	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-62.4	-41.2	174	-55.3	0	0	0	0	111.1	S15 K16 L17 R22 K23	S15-T19 WeakPolarHBondContact O-CB 3.39Å; S15-T19 PolarHBondContact O-N 2.9Å; S15-T19 PolarHBondContact O-OG1 3.32Å; K16-T19 WeakPolarHBondContact O-CB 3.42Å; K16-T19 PolarHBondContact O-N 2.88Å; L17-T19 VanDerWaalsContact C-N 3.32Å; L17-T19 PolarHBondContact O-N 3.36Å; T19-R22 PolarHBondContact O-N 3.01Å; T19-K23 VanDerWaalsContact O-CB 3.31Å; T19-K23 WeakPolarHBondContact O-CB 3.46Å; T19-K23 PolarHBondContact O-N 2.88Å
20	F	69.3	Low	72.6	Confident	141 Å²	141	110.7 Å²	110.7	62%	0.618	53%	0.531	S	S	*	.	H	α-helix	trans	-65.2	-40.7	174.6	-86.4	-74.6	0	0	0	112.6	K16 L17 D18 K23 R24	K16-F20 WeakPolarHBondContact O-CD2 3.48Å; K16-F20 PolarHBondContact O-N 2.98Å; L17-F20 PolarHBondContact O-N 3.38Å; D18-F20 VanDerWaalsContact C-N 3.33Å; D18-F20 PolarHBondContact O-N 3.16Å; F20-K23 PolarHBondContact O-N 3.01Å; F20-R24 WeakPolarHBondContact O-CB 3.48Å; F20-R24 PolarHBondContact O-N 2.75Å
21	K	73.8	Confident	73.7	Confident	131 Å²	131	109.5 Å²	109.5	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-62.4	-46.1	175.6	-75.3	-179.6	-179.5	174.6	0	111.8	L17 D18 R24 K25	L17-K21 PolarHBondContact O-N 2.72Å; D18-K21 PolarHBondContact O-N 2.9Å; K21-R24 PolarHBondContact O-N 2.93Å; K21-K25 PolarHBondContact O-N 2.91Å
22	R	72.8	Confident	74.8	Confident	196 Å²	196	110.9 Å²	110.9	74%	0.74	53%	0.529	S	S	*	.	H	α-helix	trans	-61.2	-45.6	176	-70.7	179.7	-173.4	-177	2.7	111.5	D18 T19 R24 K25 A26	D18-R22 WeakPolarHBondContact O-CG 3.46Å; D18-R22 PolarHBondContact O-N 2.88Å; T19-R22 PolarHBondContact O-N 3.01Å; R22-R24 VanDerWaalsContact C-N 3.3Å; R22-R24 PolarHBondContact O-N 3.22Å; R22-K25 PolarHBondContact O-N 3.16Å; R22-A26 PolarHBondContact O-N 2.93Å
23	K	78.1	Confident	75.3	Confident	127 Å²	127	113.3 Å²	113.3	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-62.9	-35.4	177.1	-169.7	173.5	-177.3	175.5	0	112.4	T19 F20 R27	T19-K23 VanDerWaalsContact O-CB 3.31Å; T19-K23 WeakPolarHBondContact O-CB 3.46Å; T19-K23 PolarHBondContact O-N 2.88Å; F20-K23 PolarHBondContact O-N 3.01Å; K23-R27 WeakPolarHBondContact O-CG 3.49Å; K23-R27 PolarHBondContact O-N 2.75Å; K23-R27 VanDerWaalsContact O-N 3.16Å
24	R	80	Confident	75.6	Confident	183 Å²	183	112.6 Å²	112.6	69%	0.691	54%	0.535	S	S	*	.	H	α-helix	trans	-70	-42.5	174.5	-179.2	177.6	149.9	-176	-6.7	111.9	F20 K21 R22 R27 L28	F20-R24 WeakPolarHBondContact O-CB 3.48Å; F20-R24 PolarHBondContact O-N 2.75Å; K21-R24 PolarHBondContact O-N 2.93Å; R22-R24 VanDerWaalsContact C-N 3.3Å; R22-R24 PolarHBondContact O-N 3.22Å; R24-R27 PolarHBondContact O-N 2.92Å; R24-L28 HydrophobicContact CG-CD1 4.29Å; R24-L28 WeakPolarHBondContact O-CG 3.39Å; R24-L28 PolarHBondContact O-N 3.24Å
25	K	80.1	Confident	75.9	Confident	132 Å²	132	113.4 Å²	113.4	57%	0.574	53%	0.534	S	S	*	.	H	α-helix	trans	-61.3	-47.9	176.1	-167.8	179.7	-170.9	-95.4	0	111.6	K21 R22 R27 L28 E29	K21-K25 PolarHBondContact O-N 2.91Å; R22-K25 PolarHBondContact O-N 3.16Å; K25-R27 VanDerWaalsContact C-N 3.29Å; K25-R27 PolarHBondContact O-N 2.84Å; K25-L28 PolarHBondContact O-N 3.28Å; K25-L28 VanDerWaalsContact O-N 3.12Å; K25-E29 IonicContact NZ-OE1 2.89Å; K25-E29 PolarHBondContact NZ-OE1 3.03Å; K25-E29 PolarHBondContact O-N 3.32Å
26	A	79.5	Confident	76.1	Confident	48 Å²	48	116.2 Å²	116.2	40%	0.397	54%	0.54	S	S	.	.	H	α-helix	trans	-60.6	-37.2	176.8	0	0	0	0	0	112.5	R22 V30	R22-A26 PolarHBondContact O-N 2.93Å; A26-V30 WeakPolarHBondContact O-CB 3.48Å; A26-V30 WeakPolarHBondContact O-CG2 3.37Å; A26-V30 PolarHBondContact O-N 3.32Å
27	R	77.2	Confident	75.8	Confident	178 Å²	178	113.2 Å²	113.2	67%	0.672	54%	0.535	S	S	*	.	H	α-helix	trans	-65	-41.7	173.7	-84.7	-178.2	164.8	-171.9	-6.1	112.8	K23 R24 K25 V30 E31	K23-R27 WeakPolarHBondContact O-CG 3.49Å; K23-R27 PolarHBondContact O-N 2.75Å; K23-R27 VanDerWaalsContact O-N 3.16Å; R24-R27 PolarHBondContact O-N 2.92Å; K25-R27 VanDerWaalsContact C-N 3.29Å; K25-R27 PolarHBondContact O-N 2.84Å; R27-V30 PolarHBondContact O-N 3.24Å; R27-E31 WeakPolarHBondContact O-CB 3.28Å; R27-E31 PolarHBondContact O-N 2.65Å
28	L	80.7	Confident	75.7	Confident	93 Å²	93	117.6 Å²	117.6	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-66	-44.1	177.7	-73.1	166.9	0	0	0	111.6	R24 K25 V30 E31 E32	R24-L28 HydrophobicContact CG-CD1 4.29Å; R24-L28 WeakPolarHBondContact O-CG 3.39Å; R24-L28 PolarHBondContact O-N 3.24Å; K25-L28 PolarHBondContact O-N 3.28Å; K25-L28 VanDerWaalsContact O-N 3.12Å; L28-V30 VanDerWaalsContact C-N 3.35Å; L28-V30 PolarHBondContact O-N 3.43Å; L28-E31 PolarHBondContact O-N 3.35Å; L28-E31 VanDerWaalsContact O-N 3.16Å; L28-E32 WeakPolarHBondContact O-CB 3.33Å; L28-E32 PolarHBondContact O-N 3.45Å
29	E	81.3	Confident	75.5	Confident	86 Å²	86	119.4 Å²	119.4	40%	0.402	55%	0.552	S	S	.	*	H	α-helix	trans	-61.4	-42.2	175.4	-73.1	171.6	-174.8	0	0	111.5	K25 E31 E32 L33	K25-E29 IonicContact NZ-OE1 2.89Å; K25-E29 PolarHBondContact NZ-OE1 3.03Å; K25-E29 PolarHBondContact O-N 3.32Å; E29-E31 VanDerWaalsContact C-N 3.31Å; E29-E31 PolarHBondContact O-N 3.26Å; E29-E32 PolarHBondContact O-N 3.06Å; E29-L33 WeakPolarHBondContact O-CB 2.96Å; E29-L33 WeakPolarHBondContact O-CG 3.4Å; E29-L33 PolarHBondContact O-N 2.73Å
30	V	78.6	Confident	75.2	Confident	82 Å²	82	117.9 Å²	117.9	50%	0.497	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-35.9	174.9	169.4	0	0	0	0	111.7	A26 R27 L28 N34	A26-V30 WeakPolarHBondContact O-CB 3.48Å; A26-V30 WeakPolarHBondContact O-CG2 3.37Å; A26-V30 PolarHBondContact O-N 3.32Å; R27-V30 PolarHBondContact O-N 3.24Å; L28-V30 VanDerWaalsContact C-N 3.35Å; L28-V30 PolarHBondContact O-N 3.43Å; V30-N34 WeakPolarHBondContact O-CB 3.13Å; V30-N34 PolarHBondContact O-N 2.7Å; V30-N34 PolarHBondContact O-ND2 2.79Å
31	E	79	Confident	74.6	Confident	97 Å²	97	116.3 Å²	116.3	45%	0.453	55%	0.545	S	S	.	.	H	α-helix	trans	-71.5	-36.9	177.1	-160.8	-176.2	142.3	0	0	111.9	R27 L28 E29 N34 K35	R27-E31 WeakPolarHBondContact O-CB 3.28Å; R27-E31 PolarHBondContact O-N 2.65Å; L28-E31 PolarHBondContact O-N 3.35Å; L28-E31 VanDerWaalsContact O-N 3.16Å; E29-E31 VanDerWaalsContact C-N 3.31Å; E29-E31 PolarHBondContact O-N 3.26Å; E31-N34 PolarHBondContact O-N 2.82Å; E31-K35 WeakPolarHBondContact O-CG 3.43Å; E31-K35 PolarHBondContact O-N 2.85Å; E31-K35 WeakPolarHBondContact OE1-CE 3.21Å; E31-K35 IonicContact OE1-NZ 3.21Å; E31-K35 PolarHBondContact OE1-NZ 3.28Å
32	E	82.2	Confident	73.7	Confident	134 Å²	134	116.1 Å²	116.1	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-66.2	-47.8	174.6	-169.4	167.7	-162	0	0	111.4	L28 E29 N34 K35 E36	L28-E32 WeakPolarHBondContact O-CB 3.33Å; L28-E32 PolarHBondContact O-N 3.45Å; E29-E32 PolarHBondContact O-N 3.06Å; E32-N34 VanDerWaalsContact C-N 3.28Å; E32-N34 PolarHBondContact O-N 3.41Å; E32-K35 WeakPolarHBondContact O-CA 3.4Å; E32-K35 WeakPolarHBondContact O-CB 3.4Å; E32-K35 PolarHBondContact O-N 3.42Å; E32-E36 PolarHBondContact O-N 2.84Å
33	L	74.7	Confident	72.9	Confident	104 Å²	104	113.6 Å²	113.6	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-60.3	-36.6	173.2	-72.6	171.6	0	0	0	112.5	E29 S37	E29-L33 WeakPolarHBondContact O-CB 2.96Å; E29-L33 WeakPolarHBondContact O-CG 3.4Å; E29-L33 PolarHBondContact O-N 2.73Å; L33-S37 VanDerWaalsContact O-CB 3.26Å; L33-S37 WeakPolarHBondContact O-CB 3.27Å; L33-S37 PolarHBondContact O-N 3.44Å; L33-S37 PolarHBondContact O-OG 2.83Å
34	N	78.4	Confident	71.8	Confident	85 Å²	85	109.9 Å²	109.9	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-69.1	-35.2	174.1	-86.3	-57.5	0	0	0	112.3	V30 E31 E32 R38	V30-N34 WeakPolarHBondContact O-CB 3.13Å; V30-N34 PolarHBondContact O-N 2.7Å; V30-N34 PolarHBondContact O-ND2 2.79Å; E31-N34 PolarHBondContact O-N 2.82Å; E32-N34 VanDerWaalsContact C-N 3.28Å; E32-N34 PolarHBondContact O-N 3.41Å; N34-R38 VanDerWaalsContact O-CB 3.3Å; N34-R38 WeakPolarHBondContact O-CB 3.15Å; N34-R38 WeakPolarHBondContact O-CG 3.23Å; N34-R38 PolarHBondContact O-N 3.34Å
35	K	74.8	Confident	70.2	Confident	115 Å²	115	104.6 Å²	104.6	50%	0.5	53%	0.525	S	S	.	.	H	α-helix	trans	-67.5	-45.8	174.2	-76.8	169.6	-173.8	163	0	110.9	E31 E32 R38 Q39	E31-K35 WeakPolarHBondContact O-CG 3.43Å; E31-K35 PolarHBondContact O-N 2.85Å; E31-K35 WeakPolarHBondContact OE1-CE 3.21Å; E31-K35 IonicContact OE1-NZ 3.21Å; E31-K35 PolarHBondContact OE1-NZ 3.28Å; E32-K35 WeakPolarHBondContact O-CA 3.4Å; E32-K35 WeakPolarHBondContact O-CB 3.4Å; E32-K35 PolarHBondContact O-N 3.42Å; K35-R38 PolarHBondContact O-N 3.48Å; K35-Q39 WeakPolarHBondContact O-CB 3.39Å; K35-Q39 WeakPolarHBondContact O-CG 3.35Å; K35-Q39 PolarHBondContact O-N 3.36Å
36	E	72.3	Confident	68.7	Low	120 Å²	120	101 Å²	101	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-45.1	176.1	-172.7	178.9	-170.4	0	0	111.2	E32 R38 Q39 A40	E32-E36 PolarHBondContact O-N 2.84Å; E36-R38 PolarHBondContact O-N 3.33Å; E36-Q39 PolarHBondContact O-N 2.81Å; E36-A40 WeakPolarHBondContact O-CB 3.5Å; E36-A40 PolarHBondContact O-N 2.83Å
37	S	66.6	Low	67.3	Low	63 Å²	63	100.1 Å²	100.1	44%	0.441	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-41.4	175.6	-61.2	0	0	0	0	112	L33 A40 I41	L33-S37 VanDerWaalsContact O-CB 3.26Å; L33-S37 WeakPolarHBondContact O-CB 3.27Å; L33-S37 PolarHBondContact O-N 3.44Å; L33-S37 PolarHBondContact O-OG 2.83Å; S37-A40 PolarHBondContact O-N 2.89Å; S37-I41 WeakPolarHBondContact O-CB 3.48Å; S37-I41 WeakPolarHBondContact O-CD1 3.48Å; S37-I41 VanDerWaalsContact O-CG1 3.22Å; S37-I41 WeakPolarHBondContact O-CG1 3.36Å; S37-I41 PolarHBondContact O-N 2.83Å
38	R	66.4	Low	66	Low	183 Å²	183	95.6 Å²	95.6	69%	0.691	50%	0.498	S	S	*	.	H	α-helix	trans	-64.6	-40.8	174.7	-78.3	174.8	-175.3	-138.2	1.8	111.8	N34 K35 E36 I41 E42	N34-R38 VanDerWaalsContact O-CB 3.3Å; N34-R38 WeakPolarHBondContact O-CB 3.15Å; N34-R38 WeakPolarHBondContact O-CG 3.23Å; N34-R38 PolarHBondContact O-N 3.34Å; K35-R38 PolarHBondContact O-N 3.48Å; E36-R38 PolarHBondContact O-N 3.33Å; R38-I41 PolarHBondContact O-N 3.38Å; R38-E42 WeakPolarHBondContact O-CB 3.22Å; R38-E42 PolarHBondContact O-N 2.98Å
39	Q	67.8	Low	64.3	Low	120 Å²	120	94.5 Å²	94.5	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-65.4	-42	175.4	-77.9	178.1	-29.4	0	0	111.5	K35 E36 I41 E42 M43	K35-Q39 WeakPolarHBondContact O-CB 3.39Å; K35-Q39 WeakPolarHBondContact O-CG 3.35Å; K35-Q39 PolarHBondContact O-N 3.36Å; E36-Q39 PolarHBondContact O-N 2.81Å; Q39-I41 VanDerWaalsContact C-N 3.35Å; Q39-I41 PolarHBondContact O-N 2.99Å; Q39-E42 PolarHBondContact O-N 3.03Å; Q39-M43 VanDerWaalsContact O-CB 3.31Å; Q39-M43 WeakPolarHBondContact O-CB 3.47Å; Q39-M43 WeakPolarHBondContact O-CG 3.44Å; Q39-M43 PolarHBondContact O-N 2.84Å
40	A	65.5	Low	62.9	Low	57 Å²	57	90.9 Å²	90.9	47%	0.471	48%	0.479	S	S	.	.	H	α-helix	trans	-63.2	-41.5	175.3	0	0	0	0	0	111.8	E36 S37 A44	E36-A40 WeakPolarHBondContact O-CB 3.5Å; E36-A40 PolarHBondContact O-N 2.83Å; S37-A40 PolarHBondContact O-N 2.89Å; A40-A44 WeakPolarHBondContact O-CB 3.25Å; A40-A44 PolarHBondContact O-N 3.43Å
41	I	57.8	Low	61.5	Low	109 Å²	109	92.3 Å²	92.3	56%	0.559	48%	0.484	S	S	*	.	H	α-helix	trans	-65.5	-43.9	172.7	-67.2	165.1	0	0	0	110.4	S37 R38 Q39 M43 A44 V45	S37-I41 WeakPolarHBondContact O-CB 3.48Å; S37-I41 WeakPolarHBondContact O-CD1 3.48Å; S37-I41 VanDerWaalsContact O-CG1 3.22Å; S37-I41 WeakPolarHBondContact O-CG1 3.36Å; S37-I41 PolarHBondContact O-N 2.83Å; R38-I41 PolarHBondContact O-N 3.38Å; Q39-I41 VanDerWaalsContact C-N 3.35Å; Q39-I41 PolarHBondContact O-N 2.99Å; I41-M43 VanDerWaalsContact C-N 3.33Å; I41-M43 PolarHBondContact O-N 3.37Å; I41-A44 CarbonylContact O-C 3.45Å; I41-A44 PolarHBondContact O-N 3.32Å; I41-V45 HydrophobicContact CG2-CG2 3.9Å; I41-V45 WeakPolarHBondContact O-CA 3.24Å; I41-V45 WeakPolarHBondContact O-CB 3.44Å; I41-V45 WeakPolarHBondContact O-CG2 3.35Å; I41-V45 PolarHBondContact O-N 3.23Å
42	E	54.6	Low	59.9	Low	127 Å²	127	92.6 Å²	92.6	59%	0.593	49%	0.489	S	S	*	.	H	α-helix	trans	-68.3	-32.1	-179.7	-172.3	173.1	-166.6	0	0	112.1	R38 Q39 S46	R38-E42 WeakPolarHBondContact O-CB 3.22Å; R38-E42 PolarHBondContact O-N 2.98Å; Q39-E42 PolarHBondContact O-N 3.03Å; E42-S46 WeakPolarHBondContact O-CA 3.37Å; E42-S46 WeakPolarHBondContact O-CB 3.21Å; E42-S46 PolarHBondContact O-N 3.35Å; E42-S46 PolarHBondContact O-OG 2.84Å
43	M	55.8	Low	58.3	Low	142 Å²	142	86.9 Å²	86.9	70%	0.7	46%	0.463	S	S	*	.	H	α-helix	trans	-69.1	-44.1	170.1	-74.8	177.1	66.9	0	0	111.3	Q39 I41 S46 A47	Q39-M43 VanDerWaalsContact O-CB 3.31Å; Q39-M43 WeakPolarHBondContact O-CB 3.47Å; Q39-M43 WeakPolarHBondContact O-CG 3.44Å; Q39-M43 PolarHBondContact O-N 2.84Å; I41-M43 VanDerWaalsContact C-N 3.33Å; I41-M43 PolarHBondContact O-N 3.37Å; M43-S46 PolarHBondContact O-N 3.5Å; M43-A47 WeakPolarHBondContact O-CB 3.5Å; M43-A47 PolarHBondContact O-N 3.04Å
44	A	54.9	Low	57.1	Low	50 Å²	50	90 Å²	90	41%	0.413	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-43.7	174.1	0	0	0	0	0	111	A40 I41 A47 L48	A40-A44 WeakPolarHBondContact O-CB 3.25Å; A40-A44 PolarHBondContact O-N 3.43Å; I41-A44 CarbonylContact O-C 3.45Å; I41-A44 PolarHBondContact O-N 3.32Å; A44-A47 WeakPolarHBondContact O-CB 3.5Å; A44-A47 PolarHBondContact O-N 2.86Å; A44-L48 WeakPolarHBondContact O-CB 3.34Å; A44-L48 WeakPolarHBondContact O-CD1 3.37Å; A44-L48 WeakPolarHBondContact O-CG 3.45Å; A44-L48 PolarHBondContact O-N 2.72Å
45	V	47.1	Very low	55.7	Low	72 Å²	72	91.8 Å²	91.8	44%	0.436	48%	0.478	S	S	.	.	H	α-helix	trans	-67.3	-37.1	176.5	171.5	0	0	0	0	110.2	I41 L48 T49	I41-V45 HydrophobicContact CG2-CG2 3.9Å; I41-V45 WeakPolarHBondContact O-CA 3.24Å; I41-V45 WeakPolarHBondContact O-CB 3.44Å; I41-V45 WeakPolarHBondContact O-CG2 3.35Å; I41-V45 PolarHBondContact O-N 3.23Å; V45-L48 CarbonylContact O-C 3.59Å; V45-L48 VanDerWaalsContact O-CA 3.25Å; V45-L48 WeakPolarHBondContact O-CA 3.34Å; V45-L48 WeakPolarHBondContact O-CB 3.36Å; V45-L48 PolarHBondContact O-N 3.48Å; V45-T49 HydrophobicContact CG1-CG2 3.95Å; V45-T49 WeakPolarHBondContact O-CA 3.22Å; V45-T49 WeakPolarHBondContact O-CG2 3.5Å; V45-T49 PolarHBondContact O-N 2.98Å
46	S	47.9	Very low	54.8	Low	57 Å²	57	88.3 Å²	88.3	40%	0.399	46%	0.462	S	S	.	.	H	α-helix	trans	-71	-34.1	173.8	-71.8	0	0	0	0	112.7	E42 M43 L48 T49	E42-S46 WeakPolarHBondContact O-CA 3.37Å; E42-S46 WeakPolarHBondContact O-CB 3.21Å; E42-S46 PolarHBondContact O-N 3.35Å; E42-S46 PolarHBondContact O-OG 2.84Å; M43-S46 PolarHBondContact O-N 3.5Å; S46-L48 PolarHBondContact O-N 2.92Å; S46-T49 WeakPolarHBondContact CA-OG1 3.4Å; S46-T49 PolarHBondContact O-N 3.31Å; S46-T49 PolarHBondContact O-OG1 2.8Å
47	A	49.8	Very low	54.3	Low	29 Å²	29	90.4 Å²	90.4	24%	0.24	47%	0.472	C	S	.	.	H	α-helix	trans	-63	-31.2	166	0	0	0	0	0	110.6	M43 A44	M43-A47 WeakPolarHBondContact O-CB 3.5Å; M43-A47 PolarHBondContact O-N 3.04Å; A44-A47 WeakPolarHBondContact O-CB 3.5Å; A44-A47 PolarHBondContact O-N 2.86Å
48	L	49.6	Very low	54.5	Low	82 Å²	82	87.5 Å²	87.5	43%	0.429	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.7	176.3	-62.6	166.3	0	0	0	114.4	A44 V45 S46 T50	A44-L48 WeakPolarHBondContact O-CB 3.34Å; A44-L48 WeakPolarHBondContact O-CD1 3.37Å; A44-L48 WeakPolarHBondContact O-CG 3.45Å; A44-L48 PolarHBondContact O-N 2.72Å; V45-L48 CarbonylContact O-C 3.59Å; V45-L48 VanDerWaalsContact O-CA 3.25Å; V45-L48 WeakPolarHBondContact O-CA 3.34Å; V45-L48 WeakPolarHBondContact O-CB 3.36Å; V45-L48 PolarHBondContact O-N 3.48Å; S46-L48 PolarHBondContact O-N 2.92Å; L48-T50 CarbonylContact O-C 3.51Å; L48-T50 PolarHBondContact O-N 3.46Å
49	T	45.5	Very low	55.1	Low	70 Å²	70	84.5 Å²	84.5	43%	0.429	45%	0.445	S	S	.	.			trans	-80.1	19.8	-174.9	51.4	0	0	0	0	111.8	V45 S46 D51 K69	V45-T49 HydrophobicContact CG1-CG2 3.95Å; V45-T49 WeakPolarHBondContact O-CA 3.22Å; V45-T49 WeakPolarHBondContact O-CG2 3.5Å; V45-T49 PolarHBondContact O-N 2.98Å; S46-T49 WeakPolarHBondContact CA-OG1 3.4Å; S46-T49 PolarHBondContact O-N 3.31Å; S46-T49 PolarHBondContact O-OG1 2.8Å; T49-D51 PolarHBondContact O-N 3.46Å; T49-K69 PolarHBondContact O-NZ 2.88Å
50	T	51.5	Low	55.8	Low	10 Å²	10	83.4 Å²	83.4	6%	0.061	44%	0.44	C	S	.	.	S	Bend	trans	-65.3	110.9	143	65	0	0	0	0	106	L48 D52 Y56 K69	L48-T50 CarbonylContact O-C 3.51Å; L48-T50 PolarHBondContact O-N 3.46Å; T50-D52 PolarHBondContact O-N 3.17Å; T50-Y56 WeakPolarHBondContact CB-OH 3.34Å; T50-K69 HydrophobicContact CG2-CD 4.11Å; T50-K69 HydrophobicContact CG2-CG 3.94Å
51	D	49.4	Very low	56.4	Low	113 Å²	113	82.4 Å²	82.4	60%	0.604	44%	0.435	S	S	*	.	S	Bend	trans	-7	102.3	165.7	-91.7	-33.7	0	0	0	112.9	T49 Q55	T49-D51 PolarHBondContact O-N 3.46Å; D51-Q55 VanDerWaalsContact CB-OE1 3.24Å; D51-Q55 PolarHBondContact OD1-OE1 3.47Å
52	D	45.7	Very low	57.4	Low	102 Å²	102	81.1 Å²	81.1	55%	0.545	43%	0.427	S	S	.	.			trans	-20	112.6	-169.9	-159.9	-25.5	0	0	0	111.1	T50 K54 Q55	T50-D52 PolarHBondContact O-N 3.17Å; D52-K54 CarbonylContact O-C 3.57Å; D52-K54 PolarHBondContact O-N 3.3Å; D52-Q55 VanDerWaalsContact O-CB 3.29Å; D52-Q55 WeakPolarHBondContact O-CB 3.3Å; D52-Q55 PolarHBondContact O-N 3.32Å
53	P	48.6	Very low	58.6	Low	15 Å²	15	79.2 Å²	79.2	10%	0.097	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-55	-15.2	-167.3	-32.8	36.7	0	0	0	116.4	Q55 Y56 Y212	P53-Q55 PolarHBondContact O-N 3.21Å; P53-Y56 VanDerWaalsContact CA-CE2 3.46Å; P53-Y56 HydrophobicContact CB-CD2 3.68Å; P53-Y56 HydrophobicContact CB-CE2 3.65Å; P53-Y56 HydrophobicContact CG-CE2 4.03Å; P53-Y56 WeakPolarHBondContact O-CB 3.34Å; P53-Y56 WeakPolarHBondContact O-CD2 3.4Å; P53-Y56 PolarHBondContact O-N 2.85Å; P53-Y212 HydrophobicContact CB-CE1 3.59Å; P53-Y212 WeakPolarHBondContact CB-OH 3.46Å; P53-Y212 HydrophobicContact CG-CE1 4.22Å
54	K	49.1	Very low	59.6	Low	169 Å²	169	78 Å²	78	74%	0.735	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-58.4	-20.5	165.2	-68.1	177	-179.4	170.6	0	113.7	D52 Y56	D52-K54 CarbonylContact O-C 3.57Å; D52-K54 PolarHBondContact O-N 3.3Å; K54-Y56 VanDerWaalsContact C-N 3.33Å
55	Q	48.6	Very low	60.9	Low	123 Å²	123	79.3 Å²	79.3	58%	0.575	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-77.2	-17.2	173	-75	-173.1	-29.9	0	0	112.7	D51 D52 P53 Q57	D51-Q55 VanDerWaalsContact CB-OE1 3.24Å; D51-Q55 PolarHBondContact OD1-OE1 3.47Å; D52-Q55 VanDerWaalsContact O-CB 3.29Å; D52-Q55 WeakPolarHBondContact O-CB 3.3Å; D52-Q55 PolarHBondContact O-N 3.32Å; P53-Q55 PolarHBondContact O-N 3.21Å; Q55-Q57 VanDerWaalsContact C-N 3.29Å; Q55-Q57 PolarHBondContact O-N 3.21Å
56	Y	57.3	Low	62.6	Low	41 Å²	41	78.4 Å²	78.4	16%	0.161	40%	0.402	C	S	.	.	S	Bend	trans	-70.2	93.6	168.5	-54.2	-53.7	0	0	0	107.8	T50 P53 K54 L58 F66	T50-Y56 WeakPolarHBondContact CB-OH 3.34Å; P53-Y56 VanDerWaalsContact CA-CE2 3.46Å; P53-Y56 HydrophobicContact CB-CD2 3.68Å; P53-Y56 HydrophobicContact CB-CE2 3.65Å; P53-Y56 HydrophobicContact CG-CE2 4.03Å; P53-Y56 WeakPolarHBondContact O-CB 3.34Å; P53-Y56 WeakPolarHBondContact O-CD2 3.4Å; P53-Y56 PolarHBondContact O-N 2.85Å; K54-Y56 VanDerWaalsContact C-N 3.33Å; Y56-L58 PolarHBondContact O-N 2.99Å; Y56-F66 AromaticContact CD1-CE1 3.88Å; Y56-F66 HydrophobicContact CD1-CE1 3.88Å; Y56-F66 HydrophobicContact CD1-CE2 4.01Å; Y56-F66 AromaticContact CD1-CZ 3.37Å; Y56-F66 HydrophobicContact CD1-CZ 3.37Å; Y56-F66 AromaticContact CD2-CE2 3.91Å; Y56-F66 HydrophobicContact CD2-CE2 3.91Å; Y56-F66 HydrophobicContact CD2-CZ 4.14Å; Y56-F66 HydrophobicContact CE1-CD1 4.06Å; Y56-F66 AromaticContact CE1-CE1 3.42Å; Y56-F66 HydrophobicContact CE1-CE1 3.42Å; Y56-F66 VanDerWaalsContact CE1-CE1 3.42Å; Y56-F66 AromaticContact CE1-CE2 3.94Å; Y56-F66 HydrophobicContact CE1-CE2 3.94Å; Y56-F66 AromaticContact CE1-CZ 3.34Å; Y56-F66 HydrophobicContact CE1-CZ 3.34Å; Y56-F66 HydrophobicContact CE2-CD2 4.13Å; Y56-F66 AromaticContact CE2-CE2 3.83Å; Y56-F66 HydrophobicContact CE2-CE2 3.83Å; Y56-F66 HydrophobicContact CE2-CZ 4.12Å; Y56-F66 HydrophobicContact CG-CE2 4.01Å; Y56-F66 AromaticContact CG-CZ 3.81Å; Y56-F66 HydrophobicContact CG-CZ 3.81Å; Y56-F66 AromaticContact CZ-CE1 3.88Å; Y56-F66 AromaticContact CZ-CE2 3.86Å; Y56-F66 AromaticContact CZ-CZ 3.75Å
57	Q	60.9	Low	64.4	Low	164 Å²	164	77.2 Å²	77.2	77%	0.766	39%	0.391	S	S	*	.			trans	-62.4	86.2	166.9	-68.5	177.8	-0.1	0	0	107.8	Q55	Q55-Q57 VanDerWaalsContact C-N 3.29Å; Q55-Q57 PolarHBondContact O-N 3.21Å
58	L	71.1	Confident	66.1	Low	3 Å²	3	77.3 Å²	77.3	2%	0.016	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-94.7	132.5	169.8	-64.9	-177.8	0	0	0	107.8	Y56 Q62 R64 A203 K205 L210	Y56-L58 PolarHBondContact O-N 2.99Å; L58-Q62 HydrophobicContact CB-CB 4.42Å; L58-Q62 HydrophobicContact CD2-CB 4.33Å; L58-R64 HydrophobicContact CD2-CB 4.1Å; L58-R64 HydrophobicContact CD2-CG 3.54Å; L58-A203 HydrophobicContact CD1-CB 4.13Å; L58-K205 HydrophobicContact CB-CB 3.99Å; L58-K205 HydrophobicContact CB-CD 4.35Å; L58-K205 WeakPolarHBondContact O-CD 3.34Å; L58-K205 PolarHBondContact O-NZ 3.48Å; L58-L210 HydrophobicContact CB-CD2 4.33Å; L58-L210 HydrophobicContact CD1-CD2 3.83Å; L58-L210 HydrophobicContact CG-CD2 4.42Å
59	E	78.4	Confident	67.7	Low	120 Å²	120	77.3 Å²	77.3	56%	0.561	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-73.8	160.6	165.1	-59.4	-58.5	147.2	0	0	110.1	G61 Q62	E59-G61 PolarHBondContact O-N 3.13Å; E59-Q62 VanDerWaalsContact CB-CD 3.48Å; E59-Q62 HydrophobicContact CB-CG 3.9Å; E59-Q62 WeakPolarHBondContact O-CB 3.21Å; E59-Q62 PolarHBondContact O-N 2.88Å
60	E	83.1	Confident	69.5	Low	97 Å²	97	76.7 Å²	76.7	45%	0.453	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	127.5	178.7	-173.6	60.6	-152.7	0	0	110.9	Q62 L206 N207 G208	E60-Q62 VanDerWaalsContact C-N 3.3Å; E60-Q62 PolarHBondContact O-N 3.1Å; E60-L206 VanDerWaalsContact OE1-CA 3.3Å; E60-L206 WeakPolarHBondContact OE1-CA 3.38Å; E60-N207 WeakPolarHBondContact OE1-CA 3.44Å; E60-N207 PolarHBondContact OE1-N 3.5Å; E60-G208 PolarHBondContact OE2-N 3.19Å
61	G	77.7	Confident	71.1	Confident	35 Å²	35	76.7 Å²	76.7	36%	0.361	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-11.7	-176.9	0	0	0	0	0	115.6	E59 K205	E59-G61 PolarHBondContact O-N 3.13Å; G61-K205 WeakPolarHBondContact CA-O 3.35Å; G61-K205 PolarHBondContact N-O 3.34Å
62	Q	79.5	Confident	72.9	Confident	82 Å²	82	74 Å²	74	38%	0.383	37%	0.366	S	S	.	.			trans	-70.4	145.6	176.8	-71	-175.9	-12.1	0	0	111.8	L58 E59 E60 R204 K205	L58-Q62 HydrophobicContact CB-CB 4.42Å; L58-Q62 HydrophobicContact CD2-CB 4.33Å; E59-Q62 VanDerWaalsContact CB-CD 3.48Å; E59-Q62 HydrophobicContact CB-CG 3.9Å; E59-Q62 WeakPolarHBondContact O-CB 3.21Å; E59-Q62 PolarHBondContact O-N 2.88Å; E60-Q62 VanDerWaalsContact C-N 3.3Å; E60-Q62 PolarHBondContact O-N 3.1Å; Q62-R204 WeakPolarHBondContact O-CA 3.38Å; Q62-K205 PolarHBondContact O-N 2.88Å
63	E	78.8	Confident	75	Confident	87 Å²	87	73.5 Å²	73.5	41%	0.407	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.1	175.5	-175.6	173	97.9	0	0	109.6	I202 A203 R204 R213	E63-I202 HydrophobicContact CG-CG2 3.29Å; E63-I202 WeakPolarHBondContact OE2-CG2 3.37Å; E63-A203 WeakPolarHBondContact CA-O 3.46Å; E63-R204 HydrophobicContact CB-CG 4.36Å; E63-R213 IonicContact OE1-NH2 2.77Å; E63-R213 PolarHBondContact OE1-NH2 3.37Å; E63-R213 IonicContact OE2-CZ 2.68Å; E63-R213 IonicContact OE2-NE 2.78Å; E63-R213 IonicContact OE2-NH2 3.27Å; E63-R213 PolarHBondContact OE2-NH2 3Å
64	R	78.1	Confident	77	Confident	116 Å²	116	74.7 Å²	74.7	44%	0.438	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.3	169.9	-72.5	-173	-170.1	169.1	5.2	110.2	L58 F66 I202 A203	L58-R64 HydrophobicContact CD2-CB 4.1Å; L58-R64 HydrophobicContact CD2-CG 3.54Å; R64-F66 HydrophobicContact CB-CE2 3.6Å; R64-F66 HydrophobicContact CB-CZ 3.67Å; R64-F66 HydrophobicContact CG-CZ 4.49Å; R64-I202 WeakPolarHBondContact O-CA 3.13Å; R64-A203 PolarHBondContact N-O 3.3Å; R64-A203 PolarHBondContact O-N 3.38Å
65	S	81.2	Confident	79.1	Confident	79 Å²	79	72.7 Å²	72.7	55%	0.552	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.1	174.9	54.6	0	0	0	0	110.9	I201	S65-I201 CarbonylContact C-O 3.48Å; S65-I201 WeakPolarHBondContact CA-O 3.34Å
66	F	82	Confident	81.1	Confident	52 Å²	52	69.4 Å²	69.4	23%	0.228	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.1	178.5	-55	-83.2	0	0	0	109.3	Y56 R64 V200 I201 A203	Y56-F66 AromaticContact CD1-CE1 3.88Å; Y56-F66 HydrophobicContact CD1-CE1 3.88Å; Y56-F66 HydrophobicContact CD1-CE2 4.01Å; Y56-F66 AromaticContact CD1-CZ 3.37Å; Y56-F66 HydrophobicContact CD1-CZ 3.37Å; Y56-F66 AromaticContact CD2-CE2 3.91Å; Y56-F66 HydrophobicContact CD2-CE2 3.91Å; Y56-F66 HydrophobicContact CD2-CZ 4.14Å; Y56-F66 HydrophobicContact CE1-CD1 4.06Å; Y56-F66 AromaticContact CE1-CE1 3.42Å; Y56-F66 HydrophobicContact CE1-CE1 3.42Å; Y56-F66 VanDerWaalsContact CE1-CE1 3.42Å; Y56-F66 AromaticContact CE1-CE2 3.94Å; Y56-F66 HydrophobicContact CE1-CE2 3.94Å; Y56-F66 AromaticContact CE1-CZ 3.34Å; Y56-F66 HydrophobicContact CE1-CZ 3.34Å; Y56-F66 HydrophobicContact CE2-CD2 4.13Å; Y56-F66 AromaticContact CE2-CE2 3.83Å; Y56-F66 HydrophobicContact CE2-CE2 3.83Å; Y56-F66 HydrophobicContact CE2-CZ 4.12Å; Y56-F66 HydrophobicContact CG-CE2 4.01Å; Y56-F66 AromaticContact CG-CZ 3.81Å; Y56-F66 HydrophobicContact CG-CZ 3.81Å; Y56-F66 AromaticContact CZ-CE1 3.88Å; Y56-F66 AromaticContact CZ-CE2 3.86Å; Y56-F66 AromaticContact CZ-CZ 3.75Å; R64-F66 HydrophobicContact CB-CE2 3.6Å; R64-F66 HydrophobicContact CB-CZ 3.67Å; R64-F66 HydrophobicContact CG-CZ 4.49Å; F66-V200 CarbonylContact O-C 3.56Å; F66-V200 WeakPolarHBondContact O-CA 3.49Å; F66-I201 PolarHBondContact N-O 2.9Å; F66-I201 PolarHBondContact O-N 3.12Å; F66-A203 HydrophobicContact CE2-CB 4.39Å
67	I	86.6	Confident	82.9	Confident	33 Å²	33	67.4 Å²	67.4	17%	0.169	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	132	174.7	-62.4	172.1	0	0	0	108.8	K69 Q72 L172 V173 L198 V200	I67-K69 PolarHBondContact O-N 3Å; I67-Q72 HydrophobicContact CG2-CB 4.08Å; I67-L172 HydrophobicContact CD1-CB 3.54Å; I67-L172 HydrophobicContact CD1-CD2 4.35Å; I67-L172 HydrophobicContact CD1-CG 4.46Å; I67-V173 HydrophobicContact CD1-CG2 4.25Å; I67-L198 HydrophobicContact CD1-CD1 4.39Å; I67-L198 HydrophobicContact CG2-CD2 3.95Å; I67-V200 HydrophobicContact CG1-CG2 4.41Å
68	E	85.1	Confident	84.5	Confident	30 Å²	30	63.5 Å²	63.5	14%	0.14	33%	0.328	C	S	.	.			trans	-65.1	122.1	174.8	-170.9	-174	-155.3	0	0	110.1	S70 S71 Q72 T199 I201	E68-S70 VanDerWaalsContact C-N 3.27Å; E68-S70 WeakPolarHBondContact CG-OG 3.38Å; E68-S70 PolarHBondContact O-N 3.1Å; E68-S70 PolarHBondContact OE1-OG 2.79Å; E68-S70 VanDerWaalsContact OE1-OG 3.1Å; E68-S70 PolarHBondContact OE2-OG 3.46Å; E68-S71 WeakPolarHBondContact O-CB 3.34Å; E68-S71 PolarHBondContact O-N 3.31Å; E68-S71 VanDerWaalsContact O-N 3.08Å; E68-Q72 PolarHBondContact O-N 3.05Å; E68-T199 HydrophobicContact CB-CG2 4.23Å; E68-T199 WeakPolarHBondContact CB-O 3.41Å; E68-T199 PolarHBondContact N-O 3.28Å; E68-T199 WeakPolarHBondContact OE2-CB 3.3Å; E68-T199 WeakPolarHBondContact OE2-CG2 3.09Å; E68-T199 PolarHBondContact OE2-OG1 2.99Å; E68-I201 HydrophobicContact CB-CD1 4.01Å; E68-I201 HydrophobicContact CB-CG1 4.03Å; E68-I201 HydrophobicContact CG-CD1 4.13Å
69	K	83.6	Confident	85.6	Confident	83 Å²	83	66.4 Å²	66.4	36%	0.361	34%	0.344	S	S	.	.	H	α-helix	trans	-59.3	-36.1	-177.8	-72.9	-177.8	178.9	-178.3	0	112.9	T49 T50 I67 S71 Q72 N73	T49-K69 PolarHBondContact O-NZ 2.88Å; T50-K69 HydrophobicContact CG2-CD 4.11Å; T50-K69 HydrophobicContact CG2-CG 3.94Å; I67-K69 PolarHBondContact O-N 3Å; K69-S71 VanDerWaalsContact C-N 3.32Å; K69-Q72 PolarHBondContact O-N 3.17Å; K69-N73 VanDerWaalsContact O-CB 3.26Å; K69-N73 WeakPolarHBondContact O-CB 3.27Å; K69-N73 PolarHBondContact O-N 2.94Å; K69-N73 PolarHBondContact O-ND2 3.43Å
70	S	82.9	Confident	86.4	Confident	56 Å²	56	60.9 Å²	60.9	39%	0.392	32%	0.318	S	S	.	.	H	α-helix	trans	-63.5	-40.7	177.6	62.3	0	0	0	0	111.1	E68 N73 S74	E68-S70 VanDerWaalsContact C-N 3.27Å; E68-S70 WeakPolarHBondContact CG-OG 3.38Å; E68-S70 PolarHBondContact O-N 3.1Å; E68-S70 PolarHBondContact OE1-OG 2.79Å; E68-S70 VanDerWaalsContact OE1-OG 3.1Å; E68-S70 PolarHBondContact OE2-OG 3.46Å; S70-N73 PolarHBondContact O-N 3.35Å; S70-S74 PolarHBondContact O-N 2.61Å
71	S	86.3	Confident	87	Confident	10 Å²	10	57.9 Å²	57.9	7%	0.07	31%	0.305	C	S	.	.	H	α-helix	trans	-68.5	-44.1	176.7	-173.5	0	0	0	0	112.2	E68 K69 N73 S74 L198 T199	E68-S71 WeakPolarHBondContact O-CB 3.34Å; E68-S71 PolarHBondContact O-N 3.31Å; E68-S71 VanDerWaalsContact O-N 3.08Å; K69-S71 VanDerWaalsContact C-N 3.32Å; S71-N73 PolarHBondContact O-N 2.93Å; S71-S74 WeakPolarHBondContact O-CB 3.39Å; S71-S74 PolarHBondContact O-N 3.37Å; S71-S74 VanDerWaalsContact O-N 3.12Å; S71-S74 PolarHBondContact O-OG 3.27Å; S71-L198 WeakPolarHBondContact OG-CA 3.42Å; S71-T199 PolarHBondContact OG-N 3.39Å
72	Q	87.2	Confident	87.8	Confident	58 Å²	58	60.9 Å²	60.9	27%	0.271	31%	0.312	S	S	.	.	H	α-helix	trans	-61.5	-34.3	174.5	-170.5	178.9	2.8	0	0	112.2	I67 E68 K69 S74 L172 L198	I67-Q72 HydrophobicContact CG2-CB 4.08Å; E68-Q72 PolarHBondContact O-N 3.05Å; K69-Q72 PolarHBondContact O-N 3.17Å; Q72-S74 VanDerWaalsContact C-N 3.3Å; Q72-S74 PolarHBondContact O-N 2.82Å; Q72-L172 HydrophobicContact CG-CD2 3.95Å; Q72-L198 HydrophobicContact CB-CD2 4.34Å
73	N	88.9	Confident	88.6	Confident	90 Å²	90	61.4 Å²	61.4	48%	0.481	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	0.9	178.5	-77	-58.2	0	0	0	114.5	K69 S70 S71 K78	K69-N73 VanDerWaalsContact O-CB 3.26Å; K69-N73 WeakPolarHBondContact O-CB 3.27Å; K69-N73 PolarHBondContact O-N 2.94Å; K69-N73 PolarHBondContact O-ND2 3.43Å; S70-N73 PolarHBondContact O-N 3.35Å; S71-N73 PolarHBondContact O-N 2.93Å; N73-K78 VanDerWaalsContact O-CE 3.3Å; N73-K78 WeakPolarHBondContact O-CE 3.21Å; N73-K78 PolarHBondContact O-NZ 3.23Å
74	S	91.3	Very high	89.5	Confident	40 Å²	40	57.3 Å²	57.3	28%	0.28	29%	0.294	S	S	.	.	S	Bend	trans	-62.5	146.2	177.6	69.8	0	0	0	0	111.3	S70 S71 Q72 S76 V77 K78	S70-S74 PolarHBondContact O-N 2.61Å; S71-S74 WeakPolarHBondContact O-CB 3.39Å; S71-S74 PolarHBondContact O-N 3.37Å; S71-S74 VanDerWaalsContact O-N 3.12Å; S71-S74 PolarHBondContact O-OG 3.27Å; Q72-S74 VanDerWaalsContact C-N 3.3Å; Q72-S74 PolarHBondContact O-N 2.82Å; S74-S76 PolarHBondContact O-N 3.03Å; S74-V77 PolarHBondContact O-N 2.97Å; S74-V77 WeakPolarHBondContact OG-CB 3.33Å; S74-V77 VanDerWaalsContact OG-CG2 3.27Å; S74-V77 WeakPolarHBondContact OG-CG2 3.31Å; S74-K78 PolarHBondContact O-N 3.47Å
75	E	92.4	Very high	90.4	Very high	127 Å²	127	54 Å²	54	59%	0.593	29%	0.285	S	S	*	.	H	α-helix	trans	-60	-36.9	-177.4	-171.7	55.2	-147.7	0	0	111.9	N79	E75-N79 WeakPolarHBondContact CG-ND2 3.45Å; E75-N79 WeakPolarHBondContact O-CB 3.36Å; E75-N79 PolarHBondContact O-N 3.4Å; E75-N79 PolarHBondContact O-ND2 3.35Å; E75-N79 PolarHBondContact OE1-ND2 3.19Å
76	S	91.2	Very high	91.1	Very high	54 Å²	54	53.1 Å²	53.1	38%	0.378	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-42.6	177.9	-54.3	0	0	0	0	112.4	S74 L80	S74-S76 PolarHBondContact O-N 3.03Å; S76-L80 WeakPolarHBondContact O-CB 3.4Å; S76-L80 PolarHBondContact O-N 3.3Å; S76-L80 VanDerWaalsContact O-N 3.08Å
77	V	93.7	Very high	91.8	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-71.7	-41.6	178.7	173.9	0	0	0	0	110.8	S74 L80 L81 I196 L198	S74-V77 PolarHBondContact O-N 2.97Å; S74-V77 WeakPolarHBondContact OG-CB 3.33Å; S74-V77 VanDerWaalsContact OG-CG2 3.27Å; S74-V77 WeakPolarHBondContact OG-CG2 3.31Å; V77-L80 WeakPolarHBondContact O-CB 3.49Å; V77-L80 PolarHBondContact O-N 3.42Å; V77-L81 HydrophobicContact CG1-CD1 3.95Å; V77-L81 HydrophobicContact CG1-CG 4.43Å; V77-L81 WeakPolarHBondContact O-CB 3.3Å; V77-L81 WeakPolarHBondContact O-CG 3.42Å; V77-L81 PolarHBondContact O-N 3.32Å; V77-I196 HydrophobicContact CG2-CG2 3.99Å; V77-L198 HydrophobicContact CG1-CD2 4.1Å; V77-L198 HydrophobicContact CG2-CD2 3.9Å; V77-L198 HydrophobicContact CG2-CG 4.34Å
78	K	94.3	Very high	92.2	Very high	82 Å²	82	49.4 Å²	49.4	36%	0.357	27%	0.265	S	S	.	.	H	α-helix	trans	-59.2	-48.5	174.7	-76.4	175.3	171.1	158.4	0	112.2	N73 S74 L80 L81 D82	N73-K78 VanDerWaalsContact O-CE 3.3Å; N73-K78 WeakPolarHBondContact O-CE 3.21Å; N73-K78 PolarHBondContact O-NZ 3.23Å; S74-K78 PolarHBondContact O-N 3.47Å; K78-L80 VanDerWaalsContact C-N 3.27Å; K78-L80 PolarHBondContact O-N 2.9Å; K78-L81 WeakPolarHBondContact O-CB 3.31Å; K78-L81 PolarHBondContact O-N 3.28Å; K78-L81 VanDerWaalsContact O-N 3.16Å; K78-D82 WeakPolarHBondContact O-CB 3.28Å; K78-D82 VanDerWaalsContact O-CG 3.32Å; K78-D82 PolarHBondContact O-N 2.83Å
79	N	94.4	Very high	92.8	Very high	64 Å²	64	49.2 Å²	49.2	34%	0.342	27%	0.265	S	S	.	.	H	α-helix	trans	-61.5	-35.9	176.1	-78.7	-55.7	0	0	0	112.8	E75 K83	E75-N79 WeakPolarHBondContact CG-ND2 3.45Å; E75-N79 WeakPolarHBondContact O-CB 3.36Å; E75-N79 PolarHBondContact O-N 3.4Å; E75-N79 PolarHBondContact O-ND2 3.35Å; E75-N79 PolarHBondContact OE1-ND2 3.19Å; N79-K83 WeakPolarHBondContact O-CB 3.29Å; N79-K83 WeakPolarHBondContact O-CG 3.48Å; N79-K83 PolarHBondContact O-N 2.67Å; N79-K83 VanDerWaalsContact O-N 3.1Å
80	L	95.4	Very high	93.4	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-48.4	173.8	176.1	62.3	0	0	0	111.2	S76 V77 K78 K83 L84 L176 V180 F192 I196 I219	S76-L80 WeakPolarHBondContact O-CB 3.4Å; S76-L80 PolarHBondContact O-N 3.3Å; S76-L80 VanDerWaalsContact O-N 3.08Å; V77-L80 WeakPolarHBondContact O-CB 3.49Å; V77-L80 PolarHBondContact O-N 3.42Å; K78-L80 VanDerWaalsContact C-N 3.27Å; K78-L80 PolarHBondContact O-N 2.9Å; L80-K83 PolarHBondContact O-N 3.39Å; L80-L84 HydrophobicContact CD1-CD1 4.02Å; L80-L84 HydrophobicContact CD1-CG 4.21Å; L80-L84 HydrophobicContact CG-CD1 4.06Å; L80-L84 WeakPolarHBondContact O-CG 3.49Å; L80-L84 PolarHBondContact O-N 3.31Å; L80-L176 HydrophobicContact CD2-CD1 4.47Å; L80-V180 HydrophobicContact CD1-CG2 3.98Å; L80-V180 HydrophobicContact CD2-CG2 4.4Å; L80-F192 HydrophobicContact CD1-CD1 3.25Å; L80-F192 HydrophobicContact CD1-CE1 3.53Å; L80-F192 HydrophobicContact CD1-CG 4.06Å; L80-I196 HydrophobicContact CB-CD1 4.16Å; L80-I196 HydrophobicContact CD2-CD1 4.14Å; L80-I196 HydrophobicContact CD2-CG2 4.1Å; L80-I219 HydrophobicContact CD2-CB 4.4Å; L80-I219 HydrophobicContact CD2-CG2 3.72Å
81	L	95.7	Very high	93.9	Very high	35 Å²	35	48.4 Å²	48.4	18%	0.183	26%	0.259	C	S	.	.	H	α-helix	trans	-57.7	-50.2	177.2	-80.7	167.1	0	0	0	111.6	V77 K78 K83 L84 L85 I102 L172 L176	V77-L81 HydrophobicContact CG1-CD1 3.95Å; V77-L81 HydrophobicContact CG1-CG 4.43Å; V77-L81 WeakPolarHBondContact O-CB 3.3Å; V77-L81 WeakPolarHBondContact O-CG 3.42Å; V77-L81 PolarHBondContact O-N 3.32Å; K78-L81 WeakPolarHBondContact O-CB 3.31Å; K78-L81 PolarHBondContact O-N 3.28Å; K78-L81 VanDerWaalsContact O-N 3.16Å; L81-K83 VanDerWaalsContact C-N 3.33Å; L81-K83 PolarHBondContact O-N 2.88Å; L81-L84 PolarHBondContact O-N 3.24Å; L81-L85 VanDerWaalsContact O-CB 3.25Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 PolarHBondContact O-N 2.86Å; L81-I102 HydrophobicContact CD2-CD1 3.28Å; L81-I102 HydrophobicContact CD2-CG1 3.8Å; L81-L172 HydrophobicContact CD2-CD1 4.19Å; L81-L176 HydrophobicContact CD2-CD2 3.77Å; L81-L176 HydrophobicContact CG-CD2 4.35Å
82	D	95.8	Very high	94.4	Very high	97 Å²	97	48 Å²	48	52%	0.519	26%	0.256	S	S	.	.	H	α-helix	trans	-61.7	-41.5	-179.4	-71.2	-20.8	0	0	0	111.6	K78 L85 A86	K78-D82 WeakPolarHBondContact O-CB 3.28Å; K78-D82 VanDerWaalsContact O-CG 3.32Å; K78-D82 PolarHBondContact O-N 2.83Å; D82-L85 PolarHBondContact O-N 3.49Å; D82-A86 WeakPolarHBondContact O-CB 3.37Å; D82-A86 PolarHBondContact O-N 3.48Å
83	K	95.5	Very high	94.7	Very high	94 Å²	94	48.5 Å²	48.5	41%	0.409	27%	0.266	S	S	.	.	H	α-helix	trans	-62.2	-46.8	174.7	-79.1	175.9	177.8	-177.4	0	112	N79 L80 L81 W87	N79-K83 WeakPolarHBondContact O-CB 3.29Å; N79-K83 WeakPolarHBondContact O-CG 3.48Å; N79-K83 PolarHBondContact O-N 2.67Å; N79-K83 VanDerWaalsContact O-N 3.1Å; L80-K83 PolarHBondContact O-N 3.39Å; L81-K83 VanDerWaalsContact C-N 3.33Å; L81-K83 PolarHBondContact O-N 2.88Å; K83-W87 VanDerWaalsContact O-CB 3.3Å; K83-W87 WeakPolarHBondContact O-CB 3.38Å; K83-W87 PolarHBondContact O-N 2.93Å
84	L	97.3	Very high	94.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-43.3	178.9	-71.5	173.2	0	0	0	111.3	L80 L81 W87 I88 L176 L179 V180 A183 M190 F192	L80-L84 HydrophobicContact CD1-CD1 4.02Å; L80-L84 HydrophobicContact CD1-CG 4.21Å; L80-L84 HydrophobicContact CG-CD1 4.06Å; L80-L84 WeakPolarHBondContact O-CG 3.49Å; L80-L84 PolarHBondContact O-N 3.31Å; L81-L84 PolarHBondContact O-N 3.24Å; L84-W87 HydrophobicContact CD2-CE3 4.06Å; L84-W87 HydrophobicContact CD2-CZ3 4.33Å; L84-W87 PolarHBondContact O-N 2.81Å; L84-I88 WeakPolarHBondContact O-CB 3.47Å; L84-I88 VanDerWaalsContact O-CG1 3.24Å; L84-I88 WeakPolarHBondContact O-CG1 3.22Å; L84-I88 PolarHBondContact O-N 3.4Å; L84-L176 HydrophobicContact CD1-CD2 3.63Å; L84-L179 HydrophobicContact CD1-CB 4.01Å; L84-L179 HydrophobicContact CD1-CD1 4.19Å; L84-L179 HydrophobicContact CD2-CB 4.11Å; L84-V180 HydrophobicContact CD1-CG2 4.34Å; L84-A183 HydrophobicContact CD2-CB 4.26Å; L84-M190 HydrophobicContact CD2-CE 4.37Å; L84-F192 HydrophobicContact CD2-CE1 3.89Å; L84-F192 HydrophobicContact CD2-CZ 3.68Å; L84-F192 HydrophobicContact CG-CE1 4.26Å
85	L	96.7	Very high	94.8	Very high	46 Å²	46	54.3 Å²	54.3	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-64.6	-45.7	178.7	-174.9	150.8	0	0	0	111.3	L81 D82 W87 I88 N89 R100	L81-L85 VanDerWaalsContact O-CB 3.25Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 PolarHBondContact O-N 2.86Å; D82-L85 PolarHBondContact O-N 3.49Å; L85-W87 VanDerWaalsContact C-N 3.3Å; L85-W87 PolarHBondContact O-N 3.13Å; L85-I88 PolarHBondContact O-N 3.15Å; L85-N89 WeakPolarHBondContact CD2-ND2 3.24Å; L85-N89 VanDerWaalsContact O-CB 3.31Å; L85-N89 WeakPolarHBondContact O-CB 3.42Å; L85-N89 PolarHBondContact O-N 3.37Å; L85-N89 PolarHBondContact O-ND2 2.99Å; L85-R100 VanDerWaalsContact CD1-O 3.29Å; L85-R100 WeakPolarHBondContact CD1-O 3.2Å
86	A	96.1	Very high	94.8	Very high	61 Å²	61	59.5 Å²	59.5	50%	0.504	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-40.5	175.5	0	0	0	0	0	111.5	D82 N90	D82-A86 WeakPolarHBondContact O-CB 3.37Å; D82-A86 PolarHBondContact O-N 3.48Å; A86-N90 WeakPolarHBondContact O-CB 3.3Å; A86-N90 PolarHBondContact O-N 3.39Å
87	W	96.5	Very high	94.8	Very high	7 Å²	7	59.4 Å²	59.4	3%	0.027	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-55.3	175.2	167.9	49	0	0	0	111.9	K83 L84 L85 N89 N90 E91 L115 L119 I182 A183 K187 M190	K83-W87 VanDerWaalsContact O-CB 3.3Å; K83-W87 WeakPolarHBondContact O-CB 3.38Å; K83-W87 PolarHBondContact O-N 2.93Å; L84-W87 HydrophobicContact CD2-CE3 4.06Å; L84-W87 HydrophobicContact CD2-CZ3 4.33Å; L84-W87 PolarHBondContact O-N 2.81Å; L85-W87 VanDerWaalsContact C-N 3.3Å; L85-W87 PolarHBondContact O-N 3.13Å; W87-N89 VanDerWaalsContact C-N 3.31Å; W87-N89 PolarHBondContact O-N 2.76Å; W87-N90 WeakPolarHBondContact O-CB 3.21Å; W87-N90 PolarHBondContact O-N 3.13Å; W87-E91 VanDerWaalsContact CD1-CG 3.47Å; W87-E91 HydrophobicContact CG-CG 4.4Å; W87-E91 PolarHBondContact NE1-OE1 3.26Å; W87-E91 WeakPolarHBondContact O-CG 3.49Å; W87-E91 PolarHBondContact O-N 3.19Å; W87-L115 HydrophobicContact CH2-CD2 4.33Å; W87-L115 HydrophobicContact CZ3-CD2 4.48Å; W87-L119 HydrophobicContact CH2-CD1 4.05Å; W87-L119 HydrophobicContact CZ2-CD1 3.72Å; W87-L119 HydrophobicContact CZ2-CD2 4.45Å; W87-I182 HydrophobicContact CH2-CB 4.33Å; W87-I182 HydrophobicContact CH2-CG2 3.84Å; W87-A183 HydrophobicContact CE3-CB 4.1Å; W87-A183 HydrophobicContact CH2-CB 3.88Å; W87-A183 HydrophobicContact CZ2-CB 4.37Å; W87-A183 HydrophobicContact CZ3-CB 3.73Å; W87-K187 HydrophobicContact CG-CD 3.98Å; W87-K187 VanDerWaalsContact NE1-CD 3.32Å; W87-M190 HydrophobicContact CB-CE 3.99Å; W87-M190 HydrophobicContact CB-SD 3.75Å; W87-M190 HydrophobicContact CD2-CE 3.6Å; W87-M190 HydrophobicContact CE3-CE 3.8Å; W87-M190 HydrophobicContact CG-CE 3.7Å; W87-M190 HydrophobicContact CG-SD 4.05Å
88	I	96.6	Very high	94.8	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-56.9	-46.1	-178.6	-68.1	166.6	0	0	0	110.7	L84 L85 N90 E91 L92 V99 I102 L111 L115 L179	L84-I88 WeakPolarHBondContact O-CB 3.47Å; L84-I88 VanDerWaalsContact O-CG1 3.24Å; L84-I88 WeakPolarHBondContact O-CG1 3.22Å; L84-I88 PolarHBondContact O-N 3.4Å; L85-I88 PolarHBondContact O-N 3.15Å; I88-N90 VanDerWaalsContact C-N 3.33Å; I88-N90 PolarHBondContact O-N 2.91Å; I88-E91 PolarHBondContact O-N 2.68Å; I88-L92 HydrophobicContact CG2-CD1 3.82Å; I88-L92 HydrophobicContact CG2-CG 4.48Å; I88-L92 WeakPolarHBondContact O-CB 3.3Å; I88-L92 PolarHBondContact O-N 3.04Å; I88-V99 HydrophobicContact CG2-CB 4.49Å; I88-V99 HydrophobicContact CG2-CG2 3.79Å; I88-I102 HydrophobicContact CD1-CG2 4.26Å; I88-L111 HydrophobicContact CG2-CD1 4.26Å; I88-L115 HydrophobicContact CD1-CD2 4.49Å; I88-L115 HydrophobicContact CG1-CD2 4.07Å; I88-L179 HydrophobicContact CD1-CD1 3.92Å; I88-L179 HydrophobicContact CD1-CD2 3.84Å
89	N	96.7	Very high	94.9	Very high	27 Å²	27	61.4 Å²	61.4	14%	0.144	31%	0.309	C	S	.	.	H	α-helix	trans	-62.4	-38.3	177.3	-81.2	-40.3	0	0	0	112.7	L85 W87 S93 V99	L85-N89 WeakPolarHBondContact CD2-ND2 3.24Å; L85-N89 VanDerWaalsContact O-CB 3.31Å; L85-N89 WeakPolarHBondContact O-CB 3.42Å; L85-N89 PolarHBondContact O-N 3.37Å; L85-N89 PolarHBondContact O-ND2 2.99Å; W87-N89 VanDerWaalsContact C-N 3.31Å; W87-N89 PolarHBondContact O-N 2.76Å; N89-S93 WeakPolarHBondContact O-CA 3.14Å; N89-S93 VanDerWaalsContact O-CB 3.31Å; N89-S93 WeakPolarHBondContact O-CB 3.26Å; N89-S93 PolarHBondContact O-N 3.2Å; N89-V99 PolarHBondContact ND2-O 3.36Å; N89-V99 PolarHBondContact OD1-N 3.03Å
90	N	95.8	Very high	94.9	Very high	95 Å²	95	68 Å²	68	51%	0.508	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-46.3	174.2	-179	74.2	0	0	0	111.5	A86 W87 I88 L92 S93	A86-N90 WeakPolarHBondContact O-CB 3.3Å; A86-N90 PolarHBondContact O-N 3.39Å; W87-N90 WeakPolarHBondContact O-CB 3.21Å; W87-N90 PolarHBondContact O-N 3.13Å; I88-N90 VanDerWaalsContact C-N 3.33Å; I88-N90 PolarHBondContact O-N 2.91Å; N90-L92 VanDerWaalsContact C-N 3.32Å; N90-L92 PolarHBondContact O-N 3Å; N90-S93 PolarHBondContact O-OG 3.4Å
91	E	94.9	Very high	94.8	Very high	27 Å²	27	71.2 Å²	71.2	13%	0.126	35%	0.346	C	S	.	.	H	α-helix	trans	-66.9	-31.9	-179.2	-59.5	-50.3	139.4	0	0	113.2	W87 I88 L115 K118 L119 K187	W87-E91 VanDerWaalsContact CD1-CG 3.47Å; W87-E91 HydrophobicContact CG-CG 4.4Å; W87-E91 PolarHBondContact NE1-OE1 3.26Å; W87-E91 WeakPolarHBondContact O-CG 3.49Å; W87-E91 PolarHBondContact O-N 3.19Å; I88-E91 PolarHBondContact O-N 2.68Å; E91-L115 HydrophobicContact CB-CD1 4.21Å; E91-K118 HydrophobicContact CB-CD 4.35Å; E91-K118 VanDerWaalsContact O-CE 3.31Å; E91-K118 WeakPolarHBondContact O-CE 3.48Å; E91-K118 IonicContact OE2-NZ 2.64Å; E91-K118 PolarHBondContact OE2-NZ 3.12Å; E91-L119 HydrophobicContact CG-CD2 4.21Å; E91-K187 IonicContact OE1-NZ 3.1Å; E91-K187 PolarHBondContact OE1-NZ 3.09Å; E91-K187 VanDerWaalsContact OE1-NZ 3.1Å
92	L	95.4	Very high	94.8	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-102.5	3.2	-177	-62.8	179.8	0	0	0	114.4	I88 N90 E94 H95 R96 I97 L111 K114 L115 K118	I88-L92 HydrophobicContact CG2-CD1 3.82Å; I88-L92 HydrophobicContact CG2-CG 4.48Å; I88-L92 WeakPolarHBondContact O-CB 3.3Å; I88-L92 PolarHBondContact O-N 3.04Å; N90-L92 VanDerWaalsContact C-N 3.32Å; N90-L92 PolarHBondContact O-N 3Å; L92-E94 VanDerWaalsContact C-N 3.26Å; L92-E94 PolarHBondContact O-N 3.4Å; L92-H95 WeakPolarHBondContact O-CA 3.36Å; L92-H95 WeakPolarHBondContact O-CB 3.34Å; L92-H95 PolarHBondContact O-N 2.96Å; L92-R96 PolarHBondContact O-N 3.4Å; L92-I97 HydrophobicContact CB-CB 4.07Å; L92-I97 HydrophobicContact CD1-CD1 4.41Å; L92-I97 HydrophobicContact CD1-CG2 4.23Å; L92-I97 PolarHBondContact O-N 3.47Å; L92-L111 HydrophobicContact CD1-CD1 3.3Å; L92-K114 HydrophobicContact CD2-CB 4.38Å; L92-L115 HydrophobicContact CD1-CB 4.44Å; L92-L115 HydrophobicContact CD1-CD1 4.47Å; L92-L115 HydrophobicContact CG-CD1 4.29Å; L92-K118 HydrophobicContact CD2-CB 4.42Å
93	S	93.9	Very high	94.6	Very high	69 Å²	69	66.8 Å²	66.8	48%	0.483	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-55.4	-40	178.2	59.3	0	0	0	0	112.8	N89 N90 H95 R96	N89-S93 WeakPolarHBondContact O-CA 3.14Å; N89-S93 VanDerWaalsContact O-CB 3.31Å; N89-S93 WeakPolarHBondContact O-CB 3.26Å; N89-S93 PolarHBondContact O-N 3.2Å; N90-S93 PolarHBondContact O-OG 3.4Å; S93-H95 PolarHBondContact O-N 3.39Å; S93-R96 PolarHBondContact O-N 3.01Å
94	E	91.3	Very high	94.6	Very high	159 Å²	159	66.8 Å²	66.8	74%	0.743	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-63	-29.4	176.9	-63.5	-178.7	172.8	0	0	112.8	L92 R96	L92-E94 VanDerWaalsContact C-N 3.26Å; L92-E94 PolarHBondContact O-N 3.4Å; E94-R96 VanDerWaalsContact C-N 3.25Å; E94-R96 PolarHBondContact O-N 3.1Å
95	H	90.9	Very high	94.4	Very high	93 Å²	93	69.6 Å²	69.6	43%	0.431	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-85.8	1.7	178.1	-63	82.8	0	0	0	112.5	L92 S93 I97	L92-H95 WeakPolarHBondContact O-CA 3.36Å; L92-H95 WeakPolarHBondContact O-CB 3.34Å; L92-H95 PolarHBondContact O-N 2.96Å; S93-H95 PolarHBondContact O-N 3.39Å; H95-I97 HydrophobicContact CB-CD1 3.89Å; H95-I97 HydrophobicContact CB-CG1 4.03Å; H95-I97 PolarHBondContact O-N 3.41Å
96	R	92.8	Very high	94.3	Very high	236 Å²	236	67.7 Å²	67.7	89%	0.891	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	28.6	-175.7	-52.4	179.5	178	-179.4	-1.2	113.2	L92 S93 E94	L92-R96 PolarHBondContact O-N 3.4Å; S93-R96 PolarHBondContact O-N 3.01Å; E94-R96 VanDerWaalsContact C-N 3.25Å; E94-R96 PolarHBondContact O-N 3.1Å
97	I	92	Very high	94.1	Very high	52 Å²	52	67.9 Å²	67.9	27%	0.267	32%	0.316	S	S	.	.			trans	-92.8	130.1	174.5	-60.7	170.1	0	0	0	107.5	L92 H95 V99 L111 K114	L92-I97 HydrophobicContact CB-CB 4.07Å; L92-I97 HydrophobicContact CD1-CD1 4.41Å; L92-I97 HydrophobicContact CD1-CG2 4.23Å; L92-I97 PolarHBondContact O-N 3.47Å; H95-I97 HydrophobicContact CB-CD1 3.89Å; H95-I97 HydrophobicContact CB-CG1 4.03Å; H95-I97 PolarHBondContact O-N 3.41Å; I97-V99 HydrophobicContact CG2-CG2 4.17Å; I97-L111 HydrophobicContact CG2-CD1 4.01Å; I97-K114 HydrophobicContact CD1-CB 4.03Å; I97-K114 HydrophobicContact CD1-CG 3.98Å
98	L	93.7	Very high	93.7	Very high	121 Å²	121	68.9 Å²	68.9	63%	0.634	32%	0.322	S	S	*	.			trans	-123	112.4	175.1	177.3	67.7	0	0	0	108.9
99	V	95.6	Very high	93.5	Very high	4 Å²	4	68.9 Å²	68.9	2%	0.024	32%	0.322	C	S	.	.			trans	-92.2	128.5	178.8	-175.8	0	0	0	0	108.9	I88 N89 I97 I102 D105 L111	I88-V99 HydrophobicContact CG2-CB 4.49Å; I88-V99 HydrophobicContact CG2-CG2 3.79Å; N89-V99 PolarHBondContact ND2-O 3.36Å; N89-V99 PolarHBondContact OD1-N 3.03Å; I97-V99 HydrophobicContact CG2-CG2 4.17Å; V99-I102 HydrophobicContact CG1-CG2 3.98Å; V99-D105 HydrophobicContact CG1-CB 4.06Å; V99-D105 VanDerWaalsContact CG1-OD2 3.3Å; V99-D105 WeakPolarHBondContact CG1-OD2 3.49Å; V99-L111 HydrophobicContact CB-CD2 4.34Å; V99-L111 HydrophobicContact CG1-CD2 3.8Å; V99-L111 HydrophobicContact CG2-CD1 3.53Å; V99-L111 HydrophobicContact CG2-CD2 3.54Å; V99-L111 HydrophobicContact CG2-CG 4.21Å
100	R	94.5	Very high	93.3	Very high	202 Å²	202	70.4 Å²	70.4	76%	0.762	33%	0.328	S	S	*	.	S	Bend	trans	-112.6	-35.7	177.6	-65.8	-177.1	-175	168.3	2.5	112	L85 D105	L85-R100 VanDerWaalsContact CD1-O 3.29Å; L85-R100 WeakPolarHBondContact CD1-O 3.2Å; R100-D105 PolarHBondContact N-OD2 3.05Å; R100-D105 VanDerWaalsContact N-OD2 3.14Å
101	D	94	Very high	93.2	Very high	71 Å²	71	66.4 Å²	66.4	38%	0.38	31%	0.307	S	S	.	.			trans	-137.5	107.8	179.5	-173.5	-33	0	0	0	108.2	Q103 E104 D105	D101-Q103 PolarHBondContact O-N 2.83Å; D101-Q103 WeakPolarHBondContact OD1-CB 3.43Å; D101-Q103 PolarHBondContact OD1-N 3.21Å; D101-E104 HydrophobicContact CB-CB 4.06Å; D101-E104 HydrophobicContact CB-CG 4.2Å; D101-E104 PolarHBondContact O-N 3.41Å; D101-E104 PolarHBondContact OD1-N 3.5Å; D101-D105 PolarHBondContact N-OD2 2.95Å; D101-D105 VanDerWaalsContact O-CB 3.31Å; D101-D105 WeakPolarHBondContact O-CB 3.05Å; D101-D105 VanDerWaalsContact O-CG 3.25Å; D101-D105 PolarHBondContact O-N 2.86Å; D101-D105 VanDerWaalsContact O-OD2 3.05Å
102	I	94.7	Very high	93.2	Very high	5 Å²	5	65.1 Å²	65.1	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-27.8	-177	60.7	162.9	0	0	0	112.8	L81 I88 V99 L106 L172 I175 L176 L179	L81-I102 HydrophobicContact CD2-CD1 3.28Å; L81-I102 HydrophobicContact CD2-CG1 3.8Å; I88-I102 HydrophobicContact CD1-CG2 4.26Å; V99-I102 HydrophobicContact CG1-CG2 3.98Å; I102-L106 HydrophobicContact CB-CD1 4.14Å; I102-L106 WeakPolarHBondContact O-CB 3.44Å; I102-L106 WeakPolarHBondContact O-CD1 3.48Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 2.81Å; I102-L172 HydrophobicContact CD1-CD1 4.35Å; I102-I175 HydrophobicContact CD1-CG2 4.05Å; I102-L176 HydrophobicContact CD1-CD2 3.76Å; I102-L179 HydrophobicContact CD1-CD1 3.84Å
103	Q	92.6	Very high	93.1	Very high	34 Å²	34	65.5 Å²	65.5	16%	0.159	30%	0.303	C	S	.	.	H	α-helix	trans	-73.4	-41.3	178.6	-66.5	-177.5	-114.5	0	0	110.9	D101 K170 L172 I175	D101-Q103 PolarHBondContact O-N 2.83Å; D101-Q103 WeakPolarHBondContact OD1-CB 3.43Å; D101-Q103 PolarHBondContact OD1-N 3.21Å; Q103-K170 PolarHBondContact NE2-O 3.38Å; Q103-K170 VanDerWaalsContact NE2-O 3.12Å; Q103-L172 HydrophobicContact CG-CB 4.21Å; Q103-L172 HydrophobicContact CG-CD1 3.55Å; Q103-L172 HydrophobicContact CG-CG 4.38Å; Q103-I175 HydrophobicContact CB-CD1 4.48Å; Q103-I175 HydrophobicContact CG-CD1 4.37Å
104	E	93.7	Very high	93.1	Very high	94 Å²	94	64.5 Å²	64.5	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-76.4	-23.3	178.3	-64.6	-62.2	127.6	0	0	112.8	D101 Y107 K170	D101-E104 HydrophobicContact CB-CB 4.06Å; D101-E104 HydrophobicContact CB-CG 4.2Å; D101-E104 PolarHBondContact O-N 3.41Å; D101-E104 PolarHBondContact OD1-N 3.5Å; E104-Y107 WeakPolarHBondContact O-CD1 3.32Å; E104-Y107 WeakPolarHBondContact O-CE1 3.4Å; E104-K170 WeakPolarHBondContact OE1-CD 3.48Å; E104-K170 WeakPolarHBondContact OE1-CE 3.31Å; E104-K170 IonicContact OE1-NZ 2.81Å; E104-K170 PolarHBondContact OE1-NZ 3.4Å; E104-K170 IonicContact OE2-NZ 3.64Å; E104-K170 PolarHBondContact OE2-NZ 3.35Å
105	D	93.6	Very high	93.3	Very high	59 Å²	59	56.9 Å²	56.9	32%	0.316	25%	0.254	S	S	.	.	H	α-helix	trans	-98.3	-20.5	-177.1	-65.1	-44.5	0	0	0	113.4	V99 R100 D101 L111	V99-D105 HydrophobicContact CG1-CB 4.06Å; V99-D105 VanDerWaalsContact CG1-OD2 3.3Å; V99-D105 WeakPolarHBondContact CG1-OD2 3.49Å; R100-D105 PolarHBondContact N-OD2 3.05Å; R100-D105 VanDerWaalsContact N-OD2 3.14Å; D101-D105 PolarHBondContact N-OD2 2.95Å; D101-D105 VanDerWaalsContact O-CB 3.31Å; D101-D105 WeakPolarHBondContact O-CB 3.05Å; D101-D105 VanDerWaalsContact O-CG 3.25Å; D101-D105 PolarHBondContact O-N 2.86Å; D101-D105 VanDerWaalsContact O-OD2 3.05Å; D105-L111 HydrophobicContact CB-CD2 3.57Å; D105-L111 WeakPolarHBondContact O-CB 2.94Å
106	L	93.9	Very high	93.5	Very high	5 Å²	5	52.6 Å²	52.6	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-93.9	-19.5	-178.4	-78.3	164.3	0	0	0	115.6	I102 D108 G109 L111 L112 I175 L179	I102-L106 HydrophobicContact CB-CD1 4.14Å; I102-L106 WeakPolarHBondContact O-CB 3.44Å; I102-L106 WeakPolarHBondContact O-CD1 3.48Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 2.81Å; L106-D108 VanDerWaalsContact C-N 3.28Å; L106-D108 PolarHBondContact O-N 3.2Å; L106-G109 PolarHBondContact O-N 3.12Å; L106-G109 VanDerWaalsContact O-N 3.09Å; L106-L111 HydrophobicContact CD2-CB 4.1Å; L106-L111 HydrophobicContact CD2-CD2 4.04Å; L106-L111 HydrophobicContact CD2-CG 3.99Å; L106-L111 HydrophobicContact CG-CD2 3.93Å; L106-L111 HydrophobicContact CG-CG 4.43Å; L106-L112 HydrophobicContact CD2-CB 3.72Å; L106-L112 HydrophobicContact CD2-CD1 4.36Å; L106-I175 HydrophobicContact CD1-CG2 3.52Å; L106-L179 HydrophobicContact CD1-CD1 3.71Å; L106-L179 HydrophobicContact CD1-CD2 3.99Å; L106-L179 HydrophobicContact CD1-CG 4Å
107	Y	92.3	Very high	93.5	Very high	66 Å²	66	42.9 Å²	42.9	26%	0.259	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.8	-166.4	81.2	-82.7	0	0	0	114.2	E104 G109 H168 K170	E104-Y107 WeakPolarHBondContact O-CD1 3.32Å; E104-Y107 WeakPolarHBondContact O-CE1 3.4Å; Y107-G109 VanDerWaalsContact C-N 3.34Å; Y107-H168 WeakPolarHBondContact O-CA 3.13Å; Y107-K170 HydrophobicContact CG-CG 4.1Å
108	D	89.5	Confident	93.6	Very high	28 Å²	28	43.6 Å²	43.6	15%	0.15	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.5	180	70.6	8	0	0	0	113.7	L106 Q110 Q136	L106-D108 VanDerWaalsContact C-N 3.28Å; L106-D108 PolarHBondContact O-N 3.2Å; D108-Q110 VanDerWaalsContact C-N 3.27Å; D108-Q110 PolarHBondContact O-N 2.83Å; D108-Q110 WeakPolarHBondContact OD1-CB 3.29Å; D108-Q110 PolarHBondContact OD1-N 2.97Å; D108-Q136 HydrophobicContact CB-CG 4.23Å
109	G	91.2	Very high	93.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	75.3	-3.1	-178.6	0	0	0	0	0	116.1	L106 Y107 Q113	L106-G109 PolarHBondContact O-N 3.12Å; L106-G109 VanDerWaalsContact O-N 3.09Å; Y107-G109 VanDerWaalsContact C-N 3.34Å; G109-Q113 VanDerWaalsContact O-CB 3.3Å; G109-Q113 WeakPolarHBondContact O-CB 3.33Å; G109-Q113 PolarHBondContact O-N 2.97Å
110	Q	92	Very high	93.5	Very high	59 Å²	59	40 Å²	40	28%	0.276	19%	0.186	S	C	.	.	H	α-helix	trans	-68.2	-48.8	-178.6	-170.4	176	9.7	0	0	111.6	D108 L112 Q113 K114	D108-Q110 VanDerWaalsContact C-N 3.27Å; D108-Q110 PolarHBondContact O-N 2.83Å; D108-Q110 WeakPolarHBondContact OD1-CB 3.29Å; D108-Q110 PolarHBondContact OD1-N 2.97Å; Q110-L112 VanDerWaalsContact C-N 3.31Å; Q110-L112 PolarHBondContact O-N 2.87Å; Q110-Q113 WeakPolarHBondContact O-CB 3.4Å; Q110-Q113 PolarHBondContact O-N 3.24Å; Q110-K114 WeakPolarHBondContact O-CG 3.16Å; Q110-K114 PolarHBondContact O-N 3.36Å
111	L	94	Very high	93.4	Very high	11 Å²	11	39.7 Å²	39.7	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-61.2	-43	177.6	176.7	60.6	0	0	0	111.1	I88 L92 I97 V99 D105 L106 K114 L115	I88-L111 HydrophobicContact CG2-CD1 4.26Å; L92-L111 HydrophobicContact CD1-CD1 3.3Å; I97-L111 HydrophobicContact CG2-CD1 4.01Å; V99-L111 HydrophobicContact CB-CD2 4.34Å; V99-L111 HydrophobicContact CG1-CD2 3.8Å; V99-L111 HydrophobicContact CG2-CD1 3.53Å; V99-L111 HydrophobicContact CG2-CD2 3.54Å; V99-L111 HydrophobicContact CG2-CG 4.21Å; D105-L111 HydrophobicContact CB-CD2 3.57Å; D105-L111 WeakPolarHBondContact O-CB 2.94Å; L106-L111 HydrophobicContact CD2-CB 4.1Å; L106-L111 HydrophobicContact CD2-CD2 4.04Å; L106-L111 HydrophobicContact CD2-CG 3.99Å; L106-L111 HydrophobicContact CG-CD2 3.93Å; L106-L111 HydrophobicContact CG-CG 4.43Å; L111-K114 PolarHBondContact O-N 2.96Å; L111-L115 WeakPolarHBondContact O-CB 3.26Å; L111-L115 PolarHBondContact O-N 2.87Å
112	L	95	Very high	93.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62	-44.6	177.9	-175.2	62.2	0	0	0	111.2	L106 Q110 L115 V116 L140 V143 L144 L178 I182	L106-L112 HydrophobicContact CD2-CB 3.72Å; L106-L112 HydrophobicContact CD2-CD1 4.36Å; Q110-L112 VanDerWaalsContact C-N 3.31Å; Q110-L112 PolarHBondContact O-N 2.87Å; L112-L115 PolarHBondContact O-N 3.34Å; L112-V116 HydrophobicContact CD1-CG2 4.13Å; L112-V116 HydrophobicContact CG-CG2 4.4Å; L112-V116 WeakPolarHBondContact O-CB 3.28Å; L112-V116 WeakPolarHBondContact O-CG2 3.35Å; L112-V116 PolarHBondContact O-N 3.39Å; L112-L140 HydrophobicContact CD2-CD1 4.03Å; L112-V143 HydrophobicContact CB-CG1 4.31Å; L112-V143 HydrophobicContact CD2-CG1 3.76Å; L112-V143 HydrophobicContact CG-CG1 3.73Å; L112-L144 HydrophobicContact CD2-CD2 3.91Å; L112-L178 HydrophobicContact CD1-CD2 3.99Å; L112-L178 HydrophobicContact CD2-CD2 3.72Å; L112-I182 HydrophobicContact CD1-CD1 3.72Å
113	Q	93.8	Very high	93.1	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-56.5	-53.6	176.2	-177.5	179.7	-13.2	0	0	110.7	G109 Q110 L115 V116 E117 L124 V143	G109-Q113 VanDerWaalsContact O-CB 3.3Å; G109-Q113 WeakPolarHBondContact O-CB 3.33Å; G109-Q113 PolarHBondContact O-N 2.97Å; Q110-Q113 WeakPolarHBondContact O-CB 3.4Å; Q110-Q113 PolarHBondContact O-N 3.24Å; Q113-L115 VanDerWaalsContact C-N 3.32Å; Q113-L115 PolarHBondContact O-N 3.05Å; Q113-V116 PolarHBondContact O-N 2.99Å; Q113-E117 HydrophobicContact CG-CG 4.29Å; Q113-E117 PolarHBondContact NE2-OE1 3.06Å; Q113-E117 WeakPolarHBondContact O-CB 3.46Å; Q113-E117 VanDerWaalsContact O-CG 3.26Å; Q113-E117 WeakPolarHBondContact O-CG 3.47Å; Q113-E117 PolarHBondContact O-N 3.34Å; Q113-L124 HydrophobicContact CG-CB 4.08Å; Q113-L124 HydrophobicContact CG-CD1 3.93Å; Q113-L124 PolarHBondContact NE2-O 3.42Å; Q113-V143 HydrophobicContact CB-CG2 3.9Å; Q113-V143 HydrophobicContact CG-CG2 4.22Å
114	K	93.3	Very high	93	Very high	47 Å²	47	47.3 Å²	47.3	20%	0.204	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-40.4	-179.5	-67.2	-62.3	-174.5	-172.4	0	112.5	L92 I97 Q110 L111 K118 E128	L92-K114 HydrophobicContact CD2-CB 4.38Å; I97-K114 HydrophobicContact CD1-CB 4.03Å; I97-K114 HydrophobicContact CD1-CG 3.98Å; Q110-K114 WeakPolarHBondContact O-CG 3.16Å; Q110-K114 PolarHBondContact O-N 3.36Å; L111-K114 PolarHBondContact O-N 2.96Å; K114-K118 WeakPolarHBondContact O-CB 3.44Å; K114-K118 PolarHBondContact O-N 3.42Å; K114-E128 WeakPolarHBondContact CE-OE1 3.46Å; K114-E128 IonicContact NZ-OE1 3.83Å; K114-E128 PolarHBondContact NZ-OE1 3.37Å
115	L	95.6	Very high	92.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-48.5	177.1	-176.3	62.4	0	0	0	111.1	W87 I88 E91 L92 L111 L112 Q113 K118 L119 L179	W87-L115 HydrophobicContact CH2-CD2 4.33Å; W87-L115 HydrophobicContact CZ3-CD2 4.48Å; I88-L115 HydrophobicContact CD1-CD2 4.49Å; I88-L115 HydrophobicContact CG1-CD2 4.07Å; E91-L115 HydrophobicContact CB-CD1 4.21Å; L92-L115 HydrophobicContact CD1-CB 4.44Å; L92-L115 HydrophobicContact CD1-CD1 4.47Å; L92-L115 HydrophobicContact CG-CD1 4.29Å; L111-L115 WeakPolarHBondContact O-CB 3.26Å; L111-L115 PolarHBondContact O-N 2.87Å; L112-L115 PolarHBondContact O-N 3.34Å; Q113-L115 VanDerWaalsContact C-N 3.32Å; Q113-L115 PolarHBondContact O-N 3.05Å; L115-K118 PolarHBondContact O-N 3.34Å; L115-L119 HydrophobicContact CD1-CD1 3.82Å; L115-L119 HydrophobicContact CD1-CG 4.14Å; L115-L119 HydrophobicContact CG-CD1 3.82Å; L115-L119 HydrophobicContact CG-CG 4.43Å; L115-L119 WeakPolarHBondContact O-CB 3.36Å; L115-L119 WeakPolarHBondContact O-CG 3.33Å; L115-L119 PolarHBondContact O-N 3.45Å; L115-L179 HydrophobicContact CD2-CD2 4.22Å
116	V	94.7	Very high	91.9	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-69.7	-42	-178	175.3	0	0	0	0	111.5	L112 Q113 K118 L119 A120 I122 V147 I150 I182	L112-V116 HydrophobicContact CD1-CG2 4.13Å; L112-V116 HydrophobicContact CG-CG2 4.4Å; L112-V116 WeakPolarHBondContact O-CB 3.28Å; L112-V116 WeakPolarHBondContact O-CG2 3.35Å; L112-V116 PolarHBondContact O-N 3.39Å; Q113-V116 PolarHBondContact O-N 2.99Å; V116-K118 VanDerWaalsContact C-N 3.29Å; V116-K118 PolarHBondContact O-N 2.97Å; V116-L119 PolarHBondContact O-N 3.44Å; V116-A120 WeakPolarHBondContact O-CB 3.47Å; V116-A120 PolarHBondContact O-N 2.93Å; V116-I122 HydrophobicContact CG1-CD1 4.47Å; V116-V147 HydrophobicContact CB-CG2 4.27Å; V116-V147 HydrophobicContact CG1-CG2 3.98Å; V116-V147 HydrophobicContact CG2-CG2 3.4Å; V116-V147 VanDerWaalsContact CG2-CG2 3.4Å; V116-I150 HydrophobicContact CG1-CD1 3.84Å; V116-I182 HydrophobicContact CG2-CD1 4.45Å
117	E	94.1	Very high	90.9	Very high	32 Å²	32	54 Å²	54	15%	0.15	26%	0.263	C	S	.	.	H	α-helix	trans	-54.7	-46.5	173.7	-75.5	-179.7	151.1	0	0	111.1	Q113 K121 I122 L124	Q113-E117 HydrophobicContact CG-CG 4.29Å; Q113-E117 PolarHBondContact NE2-OE1 3.06Å; Q113-E117 WeakPolarHBondContact O-CB 3.46Å; Q113-E117 VanDerWaalsContact O-CG 3.26Å; Q113-E117 WeakPolarHBondContact O-CG 3.47Å; Q113-E117 PolarHBondContact O-N 3.34Å; E117-K121 VanDerWaalsContact O-CA 3.22Å; E117-K121 WeakPolarHBondContact O-CA 3.47Å; E117-K121 PolarHBondContact O-N 2.94Å; E117-I122 VanDerWaalsContact CA-O 3.27Å; E117-I122 WeakPolarHBondContact CA-O 3.35Å; E117-I122 WeakPolarHBondContact CB-O 3.39Å; E117-I122 PolarHBondContact O-N 3.43Å; E117-I122 VanDerWaalsContact O-N 3.17Å; E117-L124 HydrophobicContact CG-CB 4.25Å; E117-L124 HydrophobicContact CG-CD1 4.27Å; E117-L124 HydrophobicContact CG-CG 4.01Å; E117-L124 PolarHBondContact OE1-N 3.03Å
118	K	94.2	Very high	89.9	Confident	66 Å²	66	55.7 Å²	55.7	29%	0.287	27%	0.274	S	S	.	.	H	α-helix	trans	-65.4	-49.8	177.7	-173.3	-85.5	178.7	-171.4	0	112	E91 L92 K114 L115 V116	E91-K118 HydrophobicContact CB-CD 4.35Å; E91-K118 VanDerWaalsContact O-CE 3.31Å; E91-K118 WeakPolarHBondContact O-CE 3.48Å; E91-K118 IonicContact OE2-NZ 2.64Å; E91-K118 PolarHBondContact OE2-NZ 3.12Å; L92-K118 HydrophobicContact CD2-CB 4.42Å; K114-K118 WeakPolarHBondContact O-CB 3.44Å; K114-K118 PolarHBondContact O-N 3.42Å; L115-K118 PolarHBondContact O-N 3.34Å; V116-K118 VanDerWaalsContact C-N 3.29Å; V116-K118 PolarHBondContact O-N 2.97Å
119	L	94.4	Very high	89	Confident	22 Å²	22	60.6 Å²	60.6	12%	0.115	30%	0.299	C	S	.	.	H	α-helix	trans	-69.8	-45.7	-172.8	-71.3	177.7	0	0	0	112.3	W87 E91 L115 V116 K121 I182 F186	W87-L119 HydrophobicContact CH2-CD1 4.05Å; W87-L119 HydrophobicContact CZ2-CD1 3.72Å; W87-L119 HydrophobicContact CZ2-CD2 4.45Å; E91-L119 HydrophobicContact CG-CD2 4.21Å; L115-L119 HydrophobicContact CD1-CD1 3.82Å; L115-L119 HydrophobicContact CD1-CG 4.14Å; L115-L119 HydrophobicContact CG-CD1 3.82Å; L115-L119 HydrophobicContact CG-CG 4.43Å; L115-L119 WeakPolarHBondContact O-CB 3.36Å; L115-L119 WeakPolarHBondContact O-CG 3.33Å; L115-L119 PolarHBondContact O-N 3.45Å; V116-L119 PolarHBondContact O-N 3.44Å; L119-K121 VanDerWaalsContact C-N 3.33Å; L119-I182 HydrophobicContact CD1-CG2 3.65Å; L119-F186 HydrophobicContact CB-CB 4.42Å; L119-F186 HydrophobicContact CB-CD1 3.76Å; L119-F186 HydrophobicContact CB-CD2 4.09Å; L119-F186 HydrophobicContact CB-CE1 3.94Å; L119-F186 HydrophobicContact CB-CE2 4.27Å; L119-F186 HydrophobicContact CB-CG 3.83Å; L119-F186 HydrophobicContact CB-CZ 4.19Å; L119-F186 HydrophobicContact CD1-CB 4.06Å; L119-F186 HydrophobicContact CD1-CD2 3.98Å; L119-F186 HydrophobicContact CD1-CG 4.03Å; L119-F186 HydrophobicContact CD2-CB 4.05Å; L119-F186 HydrophobicContact CD2-CG 4.38Å; L119-F186 HydrophobicContact CG-CB 4.41Å; L119-F186 HydrophobicContact CG-CG 4.3Å; L119-F186 WeakPolarHBondContact O-CE1 3.49Å
120	A	92.7	Very high	88.2	Confident	29 Å²	29	61.7 Å²	61.7	24%	0.24	31%	0.306	C	S	.	.	H	α-helix	trans	-84.8	-7.2	179.7	0	0	0	0	0	113.2	V116 I122 I150 F186	V116-A120 WeakPolarHBondContact O-CB 3.47Å; V116-A120 PolarHBondContact O-N 2.93Å; A120-I122 HydrophobicContact CB-CD1 4.1Å; A120-I122 HydrophobicContact CB-CG1 3.99Å; A120-I122 HydrophobicContact CB-CG2 4.22Å; A120-I122 PolarHBondContact O-N 2.77Å; A120-I150 HydrophobicContact CB-CD1 3.82Å; A120-F186 HydrophobicContact CB-CE1 4.35Å; A120-F186 HydrophobicContact CB-CZ 4.02Å
121	K	92.5	Very high	87.4	Confident	194 Å²	194	66.8 Å²	66.8	84%	0.843	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	40.7	-176	-56.4	179.8	-179	178	0	112.3	E117 L119	E117-K121 VanDerWaalsContact O-CA 3.22Å; E117-K121 WeakPolarHBondContact O-CA 3.47Å; E117-K121 PolarHBondContact O-N 2.94Å; L119-K121 VanDerWaalsContact C-N 3.33Å
122	I	93.2	Very high	87.1	Confident	65 Å²	65	69.4 Å²	69.4	33%	0.333	35%	0.349	S	S	.	.			trans	-116.7	168.8	177.1	66.5	177.9	0	0	0	109.8	V116 E117 A120 L124 T146 I150	V116-I122 HydrophobicContact CG1-CD1 4.47Å; E117-I122 VanDerWaalsContact CA-O 3.27Å; E117-I122 WeakPolarHBondContact CA-O 3.35Å; E117-I122 WeakPolarHBondContact CB-O 3.39Å; E117-I122 PolarHBondContact O-N 3.43Å; E117-I122 VanDerWaalsContact O-N 3.17Å; A120-I122 HydrophobicContact CB-CD1 4.1Å; A120-I122 HydrophobicContact CB-CG1 3.99Å; A120-I122 HydrophobicContact CB-CG2 4.22Å; A120-I122 PolarHBondContact O-N 2.77Å; I122-L124 HydrophobicContact CD1-CD2 3.99Å; I122-L124 HydrophobicContact CD1-CG 4.49Å; I122-T146 HydrophobicContact CD1-CG2 3.69Å; I122-I150 HydrophobicContact CD1-CD1 3.74Å
123	K	89.6	Confident	86.8	Confident	190 Å²	190	76.3 Å²	76.3	83%	0.826	38%	0.381	S	S	*	.			trans	-120.6	127.4	172.4	-171.3	177.6	-179.2	-176.2	0	109
124	L	88.9	Confident	86.6	Confident	15 Å²	15	81.9 Å²	81.9	8%	0.079	41%	0.41	C	S	.	.			trans	-96.7	127.2	178.1	-63.6	176.3	0	0	0	109	Q113 E117 I122 H126 V143 T146	Q113-L124 HydrophobicContact CG-CB 4.08Å; Q113-L124 HydrophobicContact CG-CD1 3.93Å; Q113-L124 PolarHBondContact NE2-O 3.42Å; E117-L124 HydrophobicContact CG-CB 4.25Å; E117-L124 HydrophobicContact CG-CD1 4.27Å; E117-L124 HydrophobicContact CG-CG 4.01Å; E117-L124 PolarHBondContact OE1-N 3.03Å; I122-L124 HydrophobicContact CD1-CD2 3.99Å; I122-L124 HydrophobicContact CD1-CG 4.49Å; L124-H126 PolarHBondContact O-N 3.26Å; L124-V143 HydrophobicContact CD1-CG1 4.34Å; L124-V143 HydrophobicContact CD1-CG2 4.18Å; L124-T146 HydrophobicContact CD2-CG2 3.6Å
125	D	83.1	Confident	86.3	Confident	161 Å²	161	80.1 Å²	80.1	86%	0.861	41%	0.405	S	S	*	.			trans	-84.5	67.4	-178.4	-165.5	26.7	0	0	0	111
126	H	81.7	Confident	86.1	Confident	53 Å²	53	81.1 Å²	81.1	25%	0.245	41%	0.409	C	S	.	.	S	Bend	trans	-124	137.9	174.3	-63.5	-47.1	0	0	0	110.5	L124 E128 R139	L124-H126 PolarHBondContact O-N 3.26Å; H126-E128 PolarHBondContact O-N 3.3Å; H126-R139 HydrophobicContact CB-CG 3.95Å
127	P	73.8	Confident	86	Confident	85 Å²	85	82.4 Å²	82.4	55%	0.552	42%	0.416	S	S	*	.			trans	-58.8	129.6	178.9	24	-32.8	0	0	0	109.4	L129 R139	P127-L129 VanDerWaalsContact C-N 3.31Å; P127-L129 PolarHBondContact O-N 3.06Å; P127-R139 VanDerWaalsContact O-CZ 3.23Å; P127-R139 PolarHBondContact O-NE 2.77Å; P127-R139 PolarHBondContact O-NH2 3.37Å
128	E	69.9	Low	85.8	Confident	101 Å²	101	86.7 Å²	86.7	47%	0.472	44%	0.436	S	S	.	.	S	Bend	trans	-67.1	-32.5	-175.1	-176.2	162.6	-143	0	0	112.5	K114 H126 R139	K114-E128 WeakPolarHBondContact CE-OE1 3.46Å; K114-E128 IonicContact NZ-OE1 3.83Å; K114-E128 PolarHBondContact NZ-OE1 3.37Å; H126-E128 PolarHBondContact O-N 3.3Å; E128-R139 PolarHBondContact O-NH2 3.03Å
129	L	70.5	Confident	85.6	Confident	131 Å²	131	83.8 Å²	83.8	69%	0.686	42%	0.423	S	S	*	.			trans	-115	111.1	178.4	-64.3	173.4	0	0	0	110	P127	P127-L129 VanDerWaalsContact C-N 3.31Å; P127-L129 PolarHBondContact O-N 3.06Å
130	T	75.6	Confident	85.6	Confident	23 Å²	23	82.8 Å²	82.8	14%	0.141	42%	0.418	C	S	.	.			trans	-131.1	112.1	172.8	-52.6	0	0	0	0	107.5	G135 Q136 R139	T130-G135 VanDerWaalsContact CG2-C 3.46Å; T130-G135 VanDerWaalsContact CG2-CA 3.42Å; T130-Q136 WeakPolarHBondContact O-CG 3.29Å; T130-Q136 PolarHBondContact O-NE2 2.82Å; T130-Q136 VanDerWaalsContact O-NE2 3.08Å; T130-R139 VanDerWaalsContact N-NH2 3.1Å; T130-R139 PolarHBondContact OG1-NH2 3.23Å; T130-R139 VanDerWaalsContact OG1-NH2 3.11Å
131	Q	75.3	Confident	85.7	Confident	167 Å²	167	87 Å²	87	78%	0.78	43%	0.428	S	S	*	.			trans	-90	-15.2	-174.9	-64.3	-64.8	-36.3	0	0	112.3
132	S	88.3	Confident	85.7	Confident	65 Å²	65	78.4 Å²	78.4	46%	0.455	39%	0.394	S	S	.	.	S	Bend	trans	-84	135.6	176.5	60.4	0	0	0	0	110.8	I134 G135 Q136	S132-I134 PolarHBondContact O-N 3.06Å; S132-G135 PolarHBondContact O-N 2.78Å; S132-G135 PolarHBondContact OG-N 2.82Å; S132-Q136 WeakPolarHBondContact O-CG 3.25Å; S132-Q136 PolarHBondContact O-N 3.09Å
133	E	87.8	Confident	85.7	Confident	146 Å²	146	75.3 Å²	75.3	68%	0.682	38%	0.378	S	S	*	.	H	α-helix	trans	-54.8	-40.9	174.5	-62.7	179.8	172.7	0	0	111.6	G135 Q136 L137	E133-G135 VanDerWaalsContact C-N 3.3Å; E133-G135 PolarHBondContact O-N 2.71Å; E133-Q136 PolarHBondContact O-N 3.03Å; E133-L137 WeakPolarHBondContact O-CB 3.49Å; E133-L137 PolarHBondContact O-N 3.5Å
134	I	89.1	Confident	86	Confident	125 Å²	125	66.7 Å²	66.7	64%	0.641	34%	0.341	S	S	*	.	H	α-helix	trans	-59.1	-43.1	176.6	-62.1	171.3	0	0	0	110.9	S132 Q138	S132-I134 PolarHBondContact O-N 3.06Å; I134-Q138 WeakPolarHBondContact O-CB 3.35Å; I134-Q138 VanDerWaalsContact O-CG 3.31Å; I134-Q138 WeakPolarHBondContact O-CG 3.29Å; I134-Q138 PolarHBondContact O-N 3.24Å
135	G	88.3	Confident	86.2	Confident	9 Å²	9	71.6 Å²	71.6	9%	0.093	36%	0.364	C	S	.	.	H	α-helix	trans	-76.1	-33.4	-177.6	0	0	0	0	0	113	T130 S132 E133 Q138 R139	T130-G135 VanDerWaalsContact CG2-C 3.46Å; T130-G135 VanDerWaalsContact CG2-CA 3.42Å; S132-G135 PolarHBondContact O-N 2.78Å; S132-G135 PolarHBondContact OG-N 2.82Å; E133-G135 VanDerWaalsContact C-N 3.3Å; E133-G135 PolarHBondContact O-N 2.71Å; G135-Q138 PolarHBondContact O-N 3.06Å; G135-R139 WeakPolarHBondContact O-CB 3.21Å; G135-R139 PolarHBondContact O-N 3.29Å
136	Q	90.2	Very high	86.7	Confident	21 Å²	21	65.4 Å²	65.4	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-47	169.5	-69.7	172.9	-3.6	0	0	110.8	D108 T130 S132 E133 Q138 R139 L140	D108-Q136 HydrophobicContact CB-CG 4.23Å; T130-Q136 WeakPolarHBondContact O-CG 3.29Å; T130-Q136 PolarHBondContact O-NE2 2.82Å; T130-Q136 VanDerWaalsContact O-NE2 3.08Å; S132-Q136 WeakPolarHBondContact O-CG 3.25Å; S132-Q136 PolarHBondContact O-N 3.09Å; E133-Q136 PolarHBondContact O-N 3.03Å; Q136-Q138 PolarHBondContact O-N 3.45Å; Q136-R139 WeakPolarHBondContact O-CB 3.43Å; Q136-R139 PolarHBondContact O-N 2.91Å; Q136-L140 WeakPolarHBondContact O-CB 3.35Å; Q136-L140 PolarHBondContact O-N 3.26Å
137	L	92.5	Very high	87.3	Confident	30 Å²	30	63 Å²	63	16%	0.157	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-40.1	176.9	-172.8	66.6	0	0	0	112.2	E133 L140 R141 A164 E165 H168	E133-L137 WeakPolarHBondContact O-CB 3.49Å; E133-L137 PolarHBondContact O-N 3.5Å; L137-L140 PolarHBondContact O-N 2.89Å; L137-R141 WeakPolarHBondContact O-CG 3.25Å; L137-R141 PolarHBondContact O-N 3.4Å; L137-A164 HydrophobicContact CD1-CB 3.8Å; L137-E165 HydrophobicContact CD1-CG 4.44Å; L137-H168 HydrophobicContact CD1-CB 3.9Å
138	Q	91.1	Very high	88.2	Confident	122 Å²	122	60.2 Å²	60.2	57%	0.57	30%	0.301	S	S	*	.	H	α-helix	trans	-63.5	-44.9	174.8	-78.6	177	-14.3	0	0	112.4	I134 G135 Q136 L140 R141 G142	I134-Q138 WeakPolarHBondContact O-CB 3.35Å; I134-Q138 VanDerWaalsContact O-CG 3.31Å; I134-Q138 WeakPolarHBondContact O-CG 3.29Å; I134-Q138 PolarHBondContact O-N 3.24Å; G135-Q138 PolarHBondContact O-N 3.06Å; Q136-Q138 PolarHBondContact O-N 3.45Å; Q138-L140 VanDerWaalsContact C-N 3.33Å; Q138-L140 PolarHBondContact O-N 3.23Å; Q138-R141 PolarHBondContact O-N 3.06Å; Q138-G142 PolarHBondContact O-N 2.89Å; Q138-G142 VanDerWaalsContact O-N 3.1Å
139	R	89.6	Confident	89.2	Confident	6 Å²	6	60.8 Å²	60.8	2%	0.023	30%	0.304	C	S	.	.	H	α-helix	trans	-56.5	-50.7	172.9	178.1	-166	-59.7	171	-5.6	110.1	H126 P127 E128 T130 G135 Q136 R141 G142 V143	H126-R139 HydrophobicContact CB-CG 3.95Å; P127-R139 VanDerWaalsContact O-CZ 3.23Å; P127-R139 PolarHBondContact O-NE 2.77Å; P127-R139 PolarHBondContact O-NH2 3.37Å; E128-R139 PolarHBondContact O-NH2 3.03Å; T130-R139 VanDerWaalsContact N-NH2 3.1Å; T130-R139 PolarHBondContact OG1-NH2 3.23Å; T130-R139 VanDerWaalsContact OG1-NH2 3.11Å; G135-R139 WeakPolarHBondContact O-CB 3.21Å; G135-R139 PolarHBondContact O-N 3.29Å; Q136-R139 WeakPolarHBondContact O-CB 3.43Å; Q136-R139 PolarHBondContact O-N 2.91Å; R139-R141 VanDerWaalsContact C-N 3.29Å; R139-R141 PolarHBondContact O-N 3.38Å; R139-G142 PolarHBondContact O-N 3.03Å; R139-G142 VanDerWaalsContact O-N 3.08Å; R139-V143 HydrophobicContact CG-CG2 4.1Å; R139-V143 VanDerWaalsContact O-CG2 3.29Å; R139-V143 WeakPolarHBondContact O-CG2 3.34Å; R139-V143 PolarHBondContact O-N 3.49Å
140	L	93.5	Very high	90.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-39.2	-177.9	-173.2	62.6	0	0	0	111.9	L112 Q136 L137 Q138 V143 L144 A164 I167 H168	L112-L140 HydrophobicContact CD2-CD1 4.03Å; Q136-L140 WeakPolarHBondContact O-CB 3.35Å; Q136-L140 PolarHBondContact O-N 3.26Å; L137-L140 PolarHBondContact O-N 2.89Å; Q138-L140 VanDerWaalsContact C-N 3.33Å; Q138-L140 PolarHBondContact O-N 3.23Å; L140-V143 PolarHBondContact O-N 3.14Å; L140-L144 HydrophobicContact CD1-CD1 4.48Å; L140-L144 HydrophobicContact CD1-CG 4.35Å; L140-L144 HydrophobicContact CG-CD1 4.21Å; L140-L144 HydrophobicContact CG-CG 4.47Å; L140-L144 VanDerWaalsContact O-CB 3.29Å; L140-L144 WeakPolarHBondContact O-CB 3.48Å; L140-L144 VanDerWaalsContact O-CG 3.22Å; L140-L144 WeakPolarHBondContact O-CG 3.24Å; L140-L144 PolarHBondContact O-N 3.41Å; L140-A164 HydrophobicContact CB-CB 4.24Å; L140-A164 HydrophobicContact CD2-CB 4.04Å; L140-A164 WeakPolarHBondContact CD2-O 3.33Å; L140-A164 HydrophobicContact CG-CB 3.94Å; L140-I167 HydrophobicContact CD1-CG2 4.03Å; L140-I167 HydrophobicContact CD2-CB 3.94Å; L140-I167 HydrophobicContact CD2-CG2 3.81Å; L140-H168 HydrophobicContact CD2-CB 4.04Å
141	R	94.7	Very high	90.7	Very high	119 Å²	119	55.2 Å²	55.2	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-60.1	-46.9	172.1	-73.8	179.4	-176.3	143.8	-2.3	112.3	L137 Q138 R139 L144 Q145 A164 E165	L137-R141 WeakPolarHBondContact O-CG 3.25Å; L137-R141 PolarHBondContact O-N 3.4Å; Q138-R141 PolarHBondContact O-N 3.06Å; R139-R141 VanDerWaalsContact C-N 3.29Å; R139-R141 PolarHBondContact O-N 3.38Å; R141-L144 PolarHBondContact O-N 3.05Å; R141-Q145 WeakPolarHBondContact O-CB 3.3Å; R141-Q145 PolarHBondContact O-N 3.39Å; R141-A164 HydrophobicContact CB-CB 4.35Å; R141-A164 HydrophobicContact CG-CB 3.4Å; R141-E165 IonicContact CZ-OE1 3.37Å; R141-E165 VanDerWaalsContact CZ-OE1 3.31Å; R141-E165 IonicContact NE-OE1 3.67Å; R141-E165 PolarHBondContact NE-OE1 2.79Å; R141-E165 VanDerWaalsContact NE-OE1 3.08Å; R141-E165 IonicContact NH2-OE1 2.67Å; R141-E165 PolarHBondContact NH2-OE1 3.03Å
142	G	92.5	Very high	91.2	Very high	13 Å²	13	53.7 Å²	53.7	13%	0.134	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-41.9	178.3	0	0	0	0	0	113.2	Q138 R139 Q145 T146	Q138-G142 PolarHBondContact O-N 2.89Å; Q138-G142 VanDerWaalsContact O-N 3.1Å; R139-G142 PolarHBondContact O-N 3.03Å; R139-G142 VanDerWaalsContact O-N 3.08Å; G142-Q145 PolarHBondContact O-N 3.44Å; G142-T146 PolarHBondContact O-N 3.45Å; G142-T146 VanDerWaalsContact O-N 3.12Å; G142-T146 PolarHBondContact O-OG1 3.39Å; G142-T146 VanDerWaalsContact O-OG1 3.05Å
143	V	94	Very high	91	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-48.2	174.3	176.4	0	0	0	0	110.2	L112 Q113 L124 R139 L140 Q145 T146 V147	L112-V143 HydrophobicContact CB-CG1 4.31Å; L112-V143 HydrophobicContact CD2-CG1 3.76Å; L112-V143 HydrophobicContact CG-CG1 3.73Å; Q113-V143 HydrophobicContact CB-CG2 3.9Å; Q113-V143 HydrophobicContact CG-CG2 4.22Å; L124-V143 HydrophobicContact CD1-CG1 4.34Å; L124-V143 HydrophobicContact CD1-CG2 4.18Å; R139-V143 HydrophobicContact CG-CG2 4.1Å; R139-V143 VanDerWaalsContact O-CG2 3.29Å; R139-V143 WeakPolarHBondContact O-CG2 3.34Å; R139-V143 PolarHBondContact O-N 3.49Å; L140-V143 PolarHBondContact O-N 3.14Å; V143-Q145 VanDerWaalsContact C-N 3.34Å; V143-Q145 PolarHBondContact O-N 2.88Å; V143-T146 PolarHBondContact O-N 3.43Å; V143-V147 HydrophobicContact CG1-CG2 4.32Å; V143-V147 VanDerWaalsContact O-CG2 3.3Å; V143-V147 WeakPolarHBondContact O-CG2 3.5Å; V143-V147 PolarHBondContact O-N 2.85Å
144	L	95.6	Very high	90.8	Very high	9 Å²	9	46.5 Å²	46.5	5%	0.047	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-35.8	179.4	-73.9	178.1	0	0	0	113	L112 L140 R141 T146 V147 N148 A164 I167 L178	L112-L144 HydrophobicContact CD2-CD2 3.91Å; L140-L144 HydrophobicContact CD1-CD1 4.48Å; L140-L144 HydrophobicContact CD1-CG 4.35Å; L140-L144 HydrophobicContact CG-CD1 4.21Å; L140-L144 HydrophobicContact CG-CG 4.47Å; L140-L144 VanDerWaalsContact O-CB 3.29Å; L140-L144 WeakPolarHBondContact O-CB 3.48Å; L140-L144 VanDerWaalsContact O-CG 3.22Å; L140-L144 WeakPolarHBondContact O-CG 3.24Å; L140-L144 PolarHBondContact O-N 3.41Å; R141-L144 PolarHBondContact O-N 3.05Å; L144-T146 VanDerWaalsContact C-N 3.33Å; L144-V147 PolarHBondContact O-N 3.1Å; L144-N148 WeakPolarHBondContact O-CB 3.2Å; L144-N148 PolarHBondContact O-N 2.85Å; L144-N148 PolarHBondContact O-ND2 3.48Å; L144-A164 HydrophobicContact CD1-CB 3.94Å; L144-A164 VanDerWaalsContact CD1-N 3.32Å; L144-I167 HydrophobicContact CD1-CD1 4.1Å; L144-I167 HydrophobicContact CD2-CD1 4.02Å; L144-L178 HydrophobicContact CD2-CD1 4.16Å; L144-L178 HydrophobicContact CD2-CD2 3.6Å
145	Q	94	Very high	90.6	Very high	118 Å²	118	48.3 Å²	48.3	55%	0.551	24%	0.237	S	C	*	.	H	α-helix	trans	-57.9	-50.7	172.4	-177.2	-174.2	-18.9	0	0	110.1	R141 G142 V143 V147 N148 E149	R141-Q145 WeakPolarHBondContact O-CB 3.3Å; R141-Q145 PolarHBondContact O-N 3.39Å; G142-Q145 PolarHBondContact O-N 3.44Å; V143-Q145 VanDerWaalsContact C-N 3.34Å; V143-Q145 PolarHBondContact O-N 2.88Å; Q145-V147 VanDerWaalsContact C-N 3.33Å; Q145-V147 PolarHBondContact O-N 3.08Å; Q145-N148 PolarHBondContact O-N 3.34Å; Q145-E149 WeakPolarHBondContact CG-OE1 3.14Å; Q145-E149 PolarHBondContact NE2-OE1 3.41Å; Q145-E149 VanDerWaalsContact NE2-OE1 3.1Å; Q145-E149 WeakPolarHBondContact O-CG 3.31Å; Q145-E149 PolarHBondContact O-N 3.33Å
146	T	93.4	Very high	90.5	Very high	30 Å²	30	51.6 Å²	51.6	18%	0.184	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-40.4	178.9	-50	0	0	0	0	111.7	I122 L124 G142 V143 L144 E149 I150	I122-T146 HydrophobicContact CD1-CG2 3.69Å; L124-T146 HydrophobicContact CD2-CG2 3.6Å; G142-T146 PolarHBondContact O-N 3.45Å; G142-T146 VanDerWaalsContact O-N 3.12Å; G142-T146 PolarHBondContact O-OG1 3.39Å; G142-T146 VanDerWaalsContact O-OG1 3.05Å; V143-T146 PolarHBondContact O-N 3.43Å; L144-T146 VanDerWaalsContact C-N 3.33Å; T146-E149 PolarHBondContact O-N 3.1Å; T146-I150 HydrophobicContact CG2-CD1 3.81Å; T146-I150 HydrophobicContact CG2-CG1 4.46Å; T146-I150 WeakPolarHBondContact O-CB 3.32Å; T146-I150 WeakPolarHBondContact O-CD1 3.38Å; T146-I150 VanDerWaalsContact O-CG1 3.22Å; T146-I150 WeakPolarHBondContact O-CG1 3.33Å; T146-I150 PolarHBondContact O-N 3.38Å
147	V	93.7	Very high	90.2	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-45.5	175.5	173.2	0	0	0	0	111.1	V116 V143 L144 Q145 E149 I150 L151 L178 I182	V116-V147 HydrophobicContact CB-CG2 4.27Å; V116-V147 HydrophobicContact CG1-CG2 3.98Å; V116-V147 HydrophobicContact CG2-CG2 3.4Å; V116-V147 VanDerWaalsContact CG2-CG2 3.4Å; V143-V147 HydrophobicContact CG1-CG2 4.32Å; V143-V147 VanDerWaalsContact O-CG2 3.3Å; V143-V147 WeakPolarHBondContact O-CG2 3.5Å; V143-V147 PolarHBondContact O-N 2.85Å; L144-V147 PolarHBondContact O-N 3.1Å; Q145-V147 VanDerWaalsContact C-N 3.33Å; Q145-V147 PolarHBondContact O-N 3.08Å; V147-E149 VanDerWaalsContact C-N 3.29Å; V147-E149 PolarHBondContact O-N 3.21Å; V147-I150 PolarHBondContact O-N 2.8Å; V147-L151 HydrophobicContact CG1-CD1 3.62Å; V147-L151 HydrophobicContact CG1-CG 3.95Å; V147-L151 WeakPolarHBondContact O-CB 3.22Å; V147-L151 VanDerWaalsContact O-CG 3.24Å; V147-L151 WeakPolarHBondContact O-CG 3.48Å; V147-L151 PolarHBondContact O-N 3.49Å; V147-L178 HydrophobicContact CG1-CD1 3.85Å; V147-I182 HydrophobicContact CG1-CD1 4.14Å; V147-I182 HydrophobicContact CG1-CG1 4.1Å
148	N	92.1	Very high	89.9	Confident	27 Å²	27	51.9 Å²	51.9	14%	0.144	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-37.9	-180	-69	-21.1	0	0	0	111.8	L144 Q145 L151 H152 V153 W162	L144-N148 WeakPolarHBondContact O-CB 3.2Å; L144-N148 PolarHBondContact O-N 2.85Å; L144-N148 PolarHBondContact O-ND2 3.48Å; Q145-N148 PolarHBondContact O-N 3.34Å; N148-L151 PolarHBondContact O-N 2.95Å; N148-H152 PolarHBondContact O-N 3.31Å; N148-V153 HydrophobicContact CB-CG2 3.85Å; N148-V153 PolarHBondContact O-N 3.29Å; N148-V153 VanDerWaalsContact O-N 3.12Å; N148-W162 PolarHBondContact OD1-NE1 2.85Å
149	E	90.9	Very high	89.9	Confident	112 Å²	112	49 Å²	49	52%	0.523	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-45.8	173.6	-71.3	171.3	-165.1	0	0	111.7	Q145 T146 V147 H152	Q145-E149 WeakPolarHBondContact CG-OE1 3.14Å; Q145-E149 PolarHBondContact NE2-OE1 3.41Å; Q145-E149 VanDerWaalsContact NE2-OE1 3.1Å; Q145-E149 WeakPolarHBondContact O-CG 3.31Å; Q145-E149 PolarHBondContact O-N 3.33Å; T146-E149 PolarHBondContact O-N 3.1Å; V147-E149 VanDerWaalsContact C-N 3.29Å; V147-E149 PolarHBondContact O-N 3.21Å; E149-H152 PolarHBondContact O-CE1 3.3Å; E149-H152 PolarHBondContact O-N 2.98Å; E149-H152 VanDerWaalsContact O-N 3.17Å; E149-H152 PolarHBondContact O-ND1 2.92Å
150	I	89.6	Confident	89.8	Confident	33 Å²	33	55.1 Å²	55.1	17%	0.169	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-40	177	-70.2	163.5	0	0	0	111.7	V116 A120 I122 T146 V147 H152 Q185 F186	V116-I150 HydrophobicContact CG1-CD1 3.84Å; A120-I150 HydrophobicContact CB-CD1 3.82Å; I122-I150 HydrophobicContact CD1-CD1 3.74Å; T146-I150 HydrophobicContact CG2-CD1 3.81Å; T146-I150 HydrophobicContact CG2-CG1 4.46Å; T146-I150 WeakPolarHBondContact O-CB 3.32Å; T146-I150 WeakPolarHBondContact O-CD1 3.38Å; T146-I150 VanDerWaalsContact O-CG1 3.22Å; T146-I150 WeakPolarHBondContact O-CG1 3.33Å; T146-I150 PolarHBondContact O-N 3.38Å; V147-I150 PolarHBondContact O-N 2.8Å; I150-H152 PolarHBondContact O-N 3.45Å; I150-Q185 PolarHBondContact O-NE2 3.2Å; I150-Q185 PolarHBondContact O-OE1 3.31Å; I150-F186 HydrophobicContact CG2-CE2 3.92Å; I150-F186 HydrophobicContact CG2-CZ 3.63Å
151	L	88	Confident	89.6	Confident	5 Å²	5	58.6 Å²	58.6	3%	0.026	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-8.9	177.6	-65.2	-179.1	0	0	0	112.7	V147 N148 V153 W162 A181 I182 Q185	V147-L151 HydrophobicContact CG1-CD1 3.62Å; V147-L151 HydrophobicContact CG1-CG 3.95Å; V147-L151 WeakPolarHBondContact O-CB 3.22Å; V147-L151 VanDerWaalsContact O-CG 3.24Å; V147-L151 WeakPolarHBondContact O-CG 3.48Å; V147-L151 PolarHBondContact O-N 3.49Å; N148-L151 PolarHBondContact O-N 2.95Å; L151-V153 HydrophobicContact CB-CG1 4.01Å; L151-V153 HydrophobicContact CB-CG2 4.11Å; L151-V153 PolarHBondContact O-N 2.85Å; L151-W162 HydrophobicContact CD1-CH2 4.39Å; L151-W162 HydrophobicContact CD1-CZ2 3.97Å; L151-A181 HydrophobicContact CD1-CB 3.99Å; L151-I182 HydrophobicContact CD1-CG1 4.41Å; L151-Q185 HydrophobicContact CD2-CB 4.14Å
152	H	86.3	Confident	89.6	Confident	135 Å²	135	53.2 Å²	53.2	63%	0.625	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	38.7	-174.9	-54	-55	0	0	0	112.9	N148 E149 I150	N148-H152 PolarHBondContact O-N 3.31Å; E149-H152 PolarHBondContact O-CE1 3.3Å; E149-H152 PolarHBondContact O-N 2.98Å; E149-H152 VanDerWaalsContact O-N 3.17Å; E149-H152 PolarHBondContact O-ND1 2.92Å; I150-H152 PolarHBondContact O-N 3.45Å
153	V	83.8	Confident	89.7	Confident	20 Å²	20	54 Å²	54	12%	0.121	27%	0.274	C	S	.	.			trans	-98.5	145.2	178.5	-65.1	0	0	0	0	110.6	N148 L151 W157 A158 W162	N148-V153 HydrophobicContact CB-CG2 3.85Å; N148-V153 PolarHBondContact O-N 3.29Å; N148-V153 VanDerWaalsContact O-N 3.12Å; L151-V153 HydrophobicContact CB-CG1 4.01Å; L151-V153 HydrophobicContact CB-CG2 4.11Å; L151-V153 PolarHBondContact O-N 2.85Å; V153-W157 HydrophobicContact CB-CE3 3.77Å; V153-W157 HydrophobicContact CB-CZ3 4.02Å; V153-W157 HydrophobicContact CG1-CE3 3.81Å; V153-W157 HydrophobicContact CG1-CH2 4.32Å; V153-W157 HydrophobicContact CG1-CZ3 3.59Å; V153-W157 HydrophobicContact CG2-CE3 4.4Å; V153-W157 HydrophobicContact CG2-CZ3 4.5Å; V153-A158 HydrophobicContact CG2-CB 4Å; V153-W162 HydrophobicContact CG2-CZ2 4.36Å
154	S	84.7	Confident	89.8	Confident	39 Å²	39	54.2 Å²	54.2	27%	0.273	28%	0.275	S	S	.	.			trans	-71.1	146.8	175.3	69.5	0	0	0	0	110.3	S156 W157 A158 H239	S154-S156 PolarHBondContact O-N 2.64Å; S154-S156 PolarHBondContact OG-OG 3.4Å; S154-S156 VanDerWaalsContact OG-OG 3.09Å; S154-W157 PolarHBondContact O-N 2.9Å; S154-W157 WeakPolarHBondContact OG-CB 3.48Å; S154-W157 PolarHBondContact OG-N 2.77Å; S154-A158 WeakPolarHBondContact O-CB 3.29Å; S154-A158 PolarHBondContact O-N 2.87Å; S154-H239 PolarHBondContact N-NE2 2.92Å
155	E	84.8	Confident	89.8	Confident	163 Å²	163	57.1 Å²	57.1	76%	0.762	29%	0.289	S	S	*	.	H	α-helix	trans	-58.4	-38.3	177.8	-173.5	177.8	-171.7	0	0	111.9	W157 A158 S159	E155-W157 VanDerWaalsContact C-N 3.34Å; E155-W157 PolarHBondContact O-N 3Å; E155-A158 PolarHBondContact O-N 3.2Å; E155-S159 WeakPolarHBondContact O-CB 3.42Å; E155-S159 PolarHBondContact O-N 2.79Å; E155-S159 PolarHBondContact O-OG 3.06Å
156	S	84.7	Confident	89.8	Confident	78 Å²	78	54 Å²	54	55%	0.545	27%	0.272	S	S	.	.	H	α-helix	trans	-62.6	-38.2	175.2	57.2	0	0	0	0	113.1	S154 S159 Q160	S154-S156 PolarHBondContact O-N 2.64Å; S154-S156 PolarHBondContact OG-OG 3.4Å; S154-S156 VanDerWaalsContact OG-OG 3.09Å; S156-S159 PolarHBondContact O-OG 2.8Å; S156-S159 VanDerWaalsContact O-OG 3.06Å; S156-Q160 WeakPolarHBondContact O-CG 3.22Å
157	W	85.5	Confident	89.9	Confident	57 Å²	57	52.7 Å²	52.7	22%	0.216	26%	0.264	C	S	.	.	H	α-helix	trans	-76.7	-39.5	180	-178.7	102.7	0	0	0	111.5	V153 S154 E155 R161 W162	V153-W157 HydrophobicContact CB-CE3 3.77Å; V153-W157 HydrophobicContact CB-CZ3 4.02Å; V153-W157 HydrophobicContact CG1-CE3 3.81Å; V153-W157 HydrophobicContact CG1-CH2 4.32Å; V153-W157 HydrophobicContact CG1-CZ3 3.59Å; V153-W157 HydrophobicContact CG2-CE3 4.4Å; V153-W157 HydrophobicContact CG2-CZ3 4.5Å; S154-W157 PolarHBondContact O-N 2.9Å; S154-W157 WeakPolarHBondContact OG-CB 3.48Å; S154-W157 PolarHBondContact OG-N 2.77Å; E155-W157 VanDerWaalsContact C-N 3.34Å; E155-W157 PolarHBondContact O-N 3Å; W157-R161 VanDerWaalsContact CD1-NH1 3.31Å; W157-R161 PolarHBondContact O-NH1 2.76Å; W157-W162 HydrophobicContact CE3-CH2 4.44Å; W157-W162 AromaticContact CH2-CH2 3.88Å; W157-W162 HydrophobicContact CH2-CH2 3.88Å; W157-W162 HydrophobicContact CH2-CZ3 4.31Å; W157-W162 AromaticContact CZ3-CH2 3.36Å; W157-W162 HydrophobicContact CZ3-CH2 3.36Å; W157-W162 AromaticContact CZ3-CZ2 3.86Å; W157-W162 HydrophobicContact CZ3-CZ2 3.86Å; W157-W162 HydrophobicContact CZ3-CZ3 4.03Å
158	A	86.3	Confident	89.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.2	-46.3	177.7	0	0	0	0	0	111.1	V153 S154 E155 Q160 R161 W162	V153-A158 HydrophobicContact CG2-CB 4Å; S154-A158 WeakPolarHBondContact O-CB 3.29Å; S154-A158 PolarHBondContact O-N 2.87Å; E155-A158 PolarHBondContact O-N 3.2Å; A158-Q160 PolarHBondContact O-N 2.87Å; A158-Q160 VanDerWaalsContact O-N 3.14Å; A158-R161 WeakPolarHBondContact O-CA 3.39Å; A158-R161 PolarHBondContact O-N 3.47Å; A158-W162 HydrophobicContact CB-CZ2 4.41Å; A158-W162 PolarHBondContact O-N 2.83Å
159	S	90	Very high	90	Very high	61 Å²	61	60.4 Å²	60.4	43%	0.427	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-24.8	-178.7	56	0	0	0	0	114.3	E155 S156 R161 T163	E155-S159 WeakPolarHBondContact O-CB 3.42Å; E155-S159 PolarHBondContact O-N 2.79Å; E155-S159 PolarHBondContact O-OG 3.06Å; S156-S159 PolarHBondContact O-OG 2.8Å; S156-S159 VanDerWaalsContact O-OG 3.06Å; S159-R161 VanDerWaalsContact C-N 3.32Å; S159-T163 WeakPolarHBondContact O-CG2 3.44Å
160	Q	87.2	Confident	90.1	Very high	135 Å²	135	58.1 Å²	58.1	63%	0.631	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-19.7	172.7	-68.8	172.8	-3.8	0	0	113.3	S156 A158	S156-Q160 WeakPolarHBondContact O-CG 3.22Å; A158-Q160 PolarHBondContact O-N 2.87Å; A158-Q160 VanDerWaalsContact O-N 3.14Å
161	R	89.1	Confident	90.3	Very high	73 Å²	73	58.1 Å²	58.1	28%	0.275	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-46.4	-171.4	-71.1	169.5	173.2	71.4	2.1	112.5	W157 A158 S159 A174	W157-R161 VanDerWaalsContact CD1-NH1 3.31Å; W157-R161 PolarHBondContact O-NH1 2.76Å; A158-R161 WeakPolarHBondContact O-CA 3.39Å; A158-R161 PolarHBondContact O-N 3.47Å; S159-R161 VanDerWaalsContact C-N 3.32Å; R161-A174 WeakPolarHBondContact O-CA 3.44Å
162	W	94.8	Very high	90.6	Very high	6 Å²	6	57.9 Å²	57.9	2%	0.023	29%	0.286	C	S	.	.			trans	-144	133.4	176.8	53.1	82.7	0	0	0	110.4	N148 L151 V153 W157 A158 I167 A174 R177 L178 A181	N148-W162 PolarHBondContact OD1-NE1 2.85Å; L151-W162 HydrophobicContact CD1-CH2 4.39Å; L151-W162 HydrophobicContact CD1-CZ2 3.97Å; V153-W162 HydrophobicContact CG2-CZ2 4.36Å; W157-W162 HydrophobicContact CE3-CH2 4.44Å; W157-W162 AromaticContact CH2-CH2 3.88Å; W157-W162 HydrophobicContact CH2-CH2 3.88Å; W157-W162 HydrophobicContact CH2-CZ3 4.31Å; W157-W162 AromaticContact CZ3-CH2 3.36Å; W157-W162 HydrophobicContact CZ3-CH2 3.36Å; W157-W162 AromaticContact CZ3-CZ2 3.86Å; W157-W162 HydrophobicContact CZ3-CZ2 3.86Å; W157-W162 HydrophobicContact CZ3-CZ3 4.03Å; A158-W162 HydrophobicContact CB-CZ2 4.41Å; A158-W162 PolarHBondContact O-N 2.83Å; W162-I167 HydrophobicContact CB-CD1 4.06Å; W162-A174 HydrophobicContact CB-CB 4.24Å; W162-R177 HydrophobicContact CE3-CB 3.89Å; W162-R177 HydrophobicContact CZ3-CB 4.13Å; W162-L178 HydrophobicContact CB-CB 4.31Å; W162-L178 HydrophobicContact CD2-CB 4.07Å; W162-L178 HydrophobicContact CD2-CD1 3.93Å; W162-L178 HydrophobicContact CE3-CB 4.15Å; W162-L178 HydrophobicContact CG-CB 4.15Å; W162-L178 HydrophobicContact CG-CD1 4.08Å; W162-L178 HydrophobicContact CZ2-CD1 4.16Å; W162-A181 HydrophobicContact CH2-CB 3.63Å; W162-A181 HydrophobicContact CZ2-CB 4.5Å; W162-A181 HydrophobicContact CZ3-CB 4.09Å
163	T	95.4	Very high	91	Very high	30 Å²	30	51.5 Å²	51.5	18%	0.184	26%	0.256	C	S	.	.			trans	-128	162.6	168.4	75.3	0	0	0	0	109	S159 E165 R166 I167	S159-T163 WeakPolarHBondContact O-CG2 3.44Å; T163-E165 VanDerWaalsContact CB-OE2 3.26Å; T163-E165 WeakPolarHBondContact CB-OE2 3.45Å; T163-E165 PolarHBondContact O-N 2.84Å; T163-E165 PolarHBondContact OG1-N 3.14Å; T163-E165 PolarHBondContact OG1-OE2 3.42Å; T163-R166 PolarHBondContact O-N 3.49Å; T163-R166 WeakPolarHBondContact OG1-CG 3.3Å; T163-R166 PolarHBondContact OG1-N 3.29Å; T163-I167 PolarHBondContact O-N 2.83Å; T163-I167 VanDerWaalsContact O-N 3.09Å
164	A	95.6	Very high	91.6	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-38.7	175.9	0	0	0	0	0	110.7	L137 L140 R141 L144 I167 H168	L137-A164 HydrophobicContact CD1-CB 3.8Å; L140-A164 HydrophobicContact CB-CB 4.24Å; L140-A164 HydrophobicContact CD2-CB 4.04Å; L140-A164 WeakPolarHBondContact CD2-O 3.33Å; L140-A164 HydrophobicContact CG-CB 3.94Å; R141-A164 HydrophobicContact CB-CB 4.35Å; R141-A164 HydrophobicContact CG-CB 3.4Å; L144-A164 HydrophobicContact CD1-CB 3.94Å; L144-A164 VanDerWaalsContact CD1-N 3.32Å; A164-I167 PolarHBondContact O-N 3.08Å; A164-H168 WeakPolarHBondContact O-CB 3.36Å; A164-H168 PolarHBondContact O-N 3.01Å
165	E	95.1	Very high	92.2	Very high	70 Å²	70	48.8 Å²	48.8	33%	0.327	24%	0.238	S	C	.	.	H	α-helix	trans	-63.6	-45.5	179.7	-60.4	71.3	-155.4	0	0	111.4	L137 R141 T163 H168 Q169	L137-E165 HydrophobicContact CD1-CG 4.44Å; R141-E165 IonicContact CZ-OE1 3.37Å; R141-E165 VanDerWaalsContact CZ-OE1 3.31Å; R141-E165 IonicContact NE-OE1 3.67Å; R141-E165 PolarHBondContact NE-OE1 2.79Å; R141-E165 VanDerWaalsContact NE-OE1 3.08Å; R141-E165 IonicContact NH2-OE1 2.67Å; R141-E165 PolarHBondContact NH2-OE1 3.03Å; T163-E165 VanDerWaalsContact CB-OE2 3.26Å; T163-E165 WeakPolarHBondContact CB-OE2 3.45Å; T163-E165 PolarHBondContact O-N 2.84Å; T163-E165 PolarHBondContact OG1-N 3.14Å; T163-E165 PolarHBondContact OG1-OE2 3.42Å; E165-H168 PolarHBondContact O-N 3.45Å; E165-Q169 WeakPolarHBondContact O-CB 3.25Å; E165-Q169 VanDerWaalsContact O-CG 3.22Å; E165-Q169 WeakPolarHBondContact O-CG 3.32Å; E165-Q169 PolarHBondContact O-N 3.36Å
166	R	94.3	Very high	92.7	Very high	54 Å²	54	41 Å²	41	20%	0.204	20%	0.202	C	C	.	.	H	α-helix	trans	-63.8	-46.9	178.8	-69.5	-177.3	70.5	167.3	7.5	111.5	T163 Q169 K170 D171 A174 E217	T163-R166 PolarHBondContact O-N 3.49Å; T163-R166 WeakPolarHBondContact OG1-CG 3.3Å; T163-R166 PolarHBondContact OG1-N 3.29Å; R166-Q169 CarbonylContact O-C 3.58Å; R166-Q169 PolarHBondContact O-N 3.2Å; R166-K170 PolarHBondContact O-N 3.33Å; R166-D171 HydrophobicContact CB-CB 4.02Å; R166-D171 IonicContact CZ-OD2 2.69Å; R166-D171 IonicContact NE-OD2 2.63Å; R166-D171 PolarHBondContact NE-OD2 3.44Å; R166-D171 IonicContact NH2-OD1 2.81Å; R166-D171 IonicContact NH2-OD2 3.08Å; R166-D171 PolarHBondContact NH2-OD2 2.97Å; R166-D171 WeakPolarHBondContact O-CB 3.44Å; R166-D171 PolarHBondContact O-N 2.89Å; R166-A174 HydrophobicContact CB-CB 3.77Å; R166-E217 IonicContact NH2-OE1 3.31Å
167	I	96.2	Very high	93.2	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-41	-179.5	-69.5	166.4	0	0	0	111	L140 L144 W162 T163 A164 Q169 K170 A174 I175 L178	L140-I167 HydrophobicContact CD1-CG2 4.03Å; L140-I167 HydrophobicContact CD2-CB 3.94Å; L140-I167 HydrophobicContact CD2-CG2 3.81Å; L144-I167 HydrophobicContact CD1-CD1 4.1Å; L144-I167 HydrophobicContact CD2-CD1 4.02Å; W162-I167 HydrophobicContact CB-CD1 4.06Å; T163-I167 PolarHBondContact O-N 2.83Å; T163-I167 VanDerWaalsContact O-N 3.09Å; A164-I167 PolarHBondContact O-N 3.08Å; I167-Q169 PolarHBondContact O-N 2.86Å; I167-K170 WeakPolarHBondContact O-CA 3.48Å; I167-K170 PolarHBondContact O-N 2.96Å; I167-A174 HydrophobicContact CG1-CB 4.07Å; I167-I175 HydrophobicContact CB-CG1 4.41Å; I167-I175 HydrophobicContact CG1-CG1 4.04Å; I167-I175 HydrophobicContact CG2-CG1 4.12Å; I167-L178 HydrophobicContact CD1-CD2 3.57Å
168	H	93.8	Very high	93.7	Very high	41 Å²	41	36.1 Å²	36.1	19%	0.19	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-31.7	175.3	-175.8	-101.4	0	0	0	112.4	Y107 L137 L140 A164 E165 K170	Y107-H168 WeakPolarHBondContact O-CA 3.13Å; L137-H168 HydrophobicContact CD1-CB 3.9Å; L140-H168 HydrophobicContact CD2-CB 4.04Å; A164-H168 WeakPolarHBondContact O-CB 3.36Å; A164-H168 PolarHBondContact O-N 3.01Å; E165-H168 PolarHBondContact O-N 3.45Å; H168-K170 PolarHBondContact O-N 3.49Å
169	Q	93.3	Very high	94.2	Very high	150 Å²	150	36.1 Å²	36.1	70%	0.701	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	11	171.5	-70.2	172.9	-2.9	0	0	113.6	E165 R166 I167 D171	E165-Q169 WeakPolarHBondContact O-CB 3.25Å; E165-Q169 VanDerWaalsContact O-CG 3.22Å; E165-Q169 WeakPolarHBondContact O-CG 3.32Å; E165-Q169 PolarHBondContact O-N 3.36Å; R166-Q169 CarbonylContact O-C 3.58Å; R166-Q169 PolarHBondContact O-N 3.2Å; I167-Q169 PolarHBondContact O-N 2.86Å; Q169-D171 PolarHBondContact O-N 3.3Å
170	K	94	Very high	94.4	Very high	64 Å²	64	33.3 Å²	33.3	28%	0.278	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	29.6	179.3	-59.6	176.2	172.6	-175.8	0	113.7	Q103 E104 Y107 R166 I167 H168 L172	Q103-K170 PolarHBondContact NE2-O 3.38Å; Q103-K170 VanDerWaalsContact NE2-O 3.12Å; E104-K170 WeakPolarHBondContact OE1-CD 3.48Å; E104-K170 WeakPolarHBondContact OE1-CE 3.31Å; E104-K170 IonicContact OE1-NZ 2.81Å; E104-K170 PolarHBondContact OE1-NZ 3.4Å; E104-K170 IonicContact OE2-NZ 3.64Å; E104-K170 PolarHBondContact OE2-NZ 3.35Å; Y107-K170 HydrophobicContact CG-CG 4.1Å; R166-K170 PolarHBondContact O-N 3.33Å; I167-K170 WeakPolarHBondContact O-CA 3.48Å; I167-K170 PolarHBondContact O-N 2.96Å; H168-K170 PolarHBondContact O-N 3.49Å; K170-L172 PolarHBondContact O-N 3.41Å
171	D	93.1	Very high	94.6	Very high	33 Å²	33	27.9 Å²	27.9	18%	0.176	13%	0.13	C	C	.	.			trans	-65.6	104.8	175.9	-176.1	-13.6	0	0	0	110.6	R166 Q169 V173 A174 I175	R166-D171 HydrophobicContact CB-CB 4.02Å; R166-D171 IonicContact CZ-OD2 2.69Å; R166-D171 IonicContact NE-OD2 2.63Å; R166-D171 PolarHBondContact NE-OD2 3.44Å; R166-D171 IonicContact NH2-OD1 2.81Å; R166-D171 IonicContact NH2-OD2 3.08Å; R166-D171 PolarHBondContact NH2-OD2 2.97Å; R166-D171 WeakPolarHBondContact O-CB 3.44Å; R166-D171 PolarHBondContact O-N 2.89Å; Q169-D171 PolarHBondContact O-N 3.3Å; D171-V173 PolarHBondContact O-N 2.79Å; D171-V173 VanDerWaalsContact OD1-CB 3.31Å; D171-V173 WeakPolarHBondContact OD1-CB 3.45Å; D171-V173 PolarHBondContact OD1-N 2.93Å; D171-A174 HydrophobicContact CB-CB 4.17Å; D171-A174 PolarHBondContact O-N 2.83Å; D171-A174 PolarHBondContact OD1-N 3.32Å; D171-I175 VanDerWaalsContact O-CG1 3.3Å; D171-I175 WeakPolarHBondContact O-CG1 3.43Å; D171-I175 PolarHBondContact O-N 3.21Å
172	L	94.6	Very high	94.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.1	-33.7	-179.7	-177.6	60.2	0	0	0	112.5	I67 Q72 L81 I102 Q103 K170 I175 L176 L198	I67-L172 HydrophobicContact CD1-CB 3.54Å; I67-L172 HydrophobicContact CD1-CD2 4.35Å; I67-L172 HydrophobicContact CD1-CG 4.46Å; Q72-L172 HydrophobicContact CG-CD2 3.95Å; L81-L172 HydrophobicContact CD2-CD1 4.19Å; I102-L172 HydrophobicContact CD1-CD1 4.35Å; Q103-L172 HydrophobicContact CG-CB 4.21Å; Q103-L172 HydrophobicContact CG-CD1 3.55Å; Q103-L172 HydrophobicContact CG-CG 4.38Å; K170-L172 PolarHBondContact O-N 3.41Å; L172-I175 PolarHBondContact O-N 2.93Å; L172-L176 HydrophobicContact CD1-CD1 3.83Å; L172-L176 HydrophobicContact CD1-CD2 4.2Å; L172-L176 HydrophobicContact CD1-CG 3.67Å; L172-L176 HydrophobicContact CD2-CD1 4.34Å; L172-L176 HydrophobicContact CG-CD1 3.76Å; L172-L176 HydrophobicContact CG-CG 4.04Å; L172-L176 WeakPolarHBondContact O-CB 3.46Å; L172-L176 VanDerWaalsContact O-CG 3.25Å; L172-L176 WeakPolarHBondContact O-CG 3.47Å; L172-L176 PolarHBondContact O-N 2.82Å; L172-L198 HydrophobicContact CB-CD1 4.49Å; L172-L198 HydrophobicContact CD2-CD1 3.89Å; L172-L198 HydrophobicContact CG-CD1 3.99Å
173	V	94.6	Very high	94.8	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-63.7	-49.1	179.9	174.5	0	0	0	0	109.7	I67 D171 R177 L198 V200 E217 I219	I67-V173 HydrophobicContact CD1-CG2 4.25Å; D171-V173 PolarHBondContact O-N 2.79Å; D171-V173 VanDerWaalsContact OD1-CB 3.31Å; D171-V173 WeakPolarHBondContact OD1-CB 3.45Å; D171-V173 PolarHBondContact OD1-N 2.93Å; V173-R177 VanDerWaalsContact CG1-CZ 3.49Å; V173-R177 WeakPolarHBondContact O-CB 3.39Å; V173-R177 VanDerWaalsContact O-CG 3.29Å; V173-R177 WeakPolarHBondContact O-CG 3.47Å; V173-R177 PolarHBondContact O-N 2.98Å; V173-L198 HydrophobicContact CG2-CB 4.1Å; V173-L198 HydrophobicContact CG2-CD1 3.85Å; V173-V200 HydrophobicContact CG2-CG2 4.14Å; V173-E217 HydrophobicContact CG1-CB 3.83Å; V173-E217 HydrophobicContact CG1-CG 4.4Å; V173-E217 HydrophobicContact CG2-CB 4.08Å; V173-I219 HydrophobicContact CB-CD1 4.22Å; V173-I219 HydrophobicContact CG1-CD1 3.83Å; V173-I219 HydrophobicContact CG2-CD1 4.4Å
174	A	95.5	Very high	94.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.5	-44.3	178.5	0	0	0	0	0	111.5	R161 W162 R166 I167 D171 R177 L178	R161-A174 WeakPolarHBondContact O-CA 3.44Å; W162-A174 HydrophobicContact CB-CB 4.24Å; R166-A174 HydrophobicContact CB-CB 3.77Å; I167-A174 HydrophobicContact CG1-CB 4.07Å; D171-A174 HydrophobicContact CB-CB 4.17Å; D171-A174 PolarHBondContact O-N 2.83Å; D171-A174 PolarHBondContact OD1-N 3.32Å; A174-R177 PolarHBondContact O-N 2.86Å; A174-L178 WeakPolarHBondContact O-CB 3.29Å; A174-L178 PolarHBondContact O-N 3.06Å
175	I	97.3	Very high	94	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-59.4	-50.9	178.2	-72	170.5	0	0	0	111	I102 Q103 L106 I167 D171 L172 L178 L179	I102-I175 HydrophobicContact CD1-CG2 4.05Å; Q103-I175 HydrophobicContact CB-CD1 4.48Å; Q103-I175 HydrophobicContact CG-CD1 4.37Å; L106-I175 HydrophobicContact CD1-CG2 3.52Å; I167-I175 HydrophobicContact CB-CG1 4.41Å; I167-I175 HydrophobicContact CG1-CG1 4.04Å; I167-I175 HydrophobicContact CG2-CG1 4.12Å; D171-I175 VanDerWaalsContact O-CG1 3.3Å; D171-I175 WeakPolarHBondContact O-CG1 3.43Å; D171-I175 PolarHBondContact O-N 3.21Å; L172-I175 PolarHBondContact O-N 2.93Å; I175-L178 PolarHBondContact O-N 3.23Å; I175-L179 HydrophobicContact CG2-CD1 4.08Å; I175-L179 HydrophobicContact CG2-CG 4.49Å; I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 WeakPolarHBondContact O-CG 3.34Å; I175-L179 PolarHBondContact O-N 2.79Å
176	L	96.8	Very high	93.8	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.8	-42.5	-178.4	-72	177.3	0	0	0	112.2	L80 L81 L84 I102 L172 L178 L179 V180 L198 I219	L80-L176 HydrophobicContact CD2-CD1 4.47Å; L81-L176 HydrophobicContact CD2-CD2 3.77Å; L81-L176 HydrophobicContact CG-CD2 4.35Å; L84-L176 HydrophobicContact CD1-CD2 3.63Å; I102-L176 HydrophobicContact CD1-CD2 3.76Å; L172-L176 HydrophobicContact CD1-CD1 3.83Å; L172-L176 HydrophobicContact CD1-CD2 4.2Å; L172-L176 HydrophobicContact CD1-CG 3.67Å; L172-L176 HydrophobicContact CD2-CD1 4.34Å; L172-L176 HydrophobicContact CG-CD1 3.76Å; L172-L176 HydrophobicContact CG-CG 4.04Å; L172-L176 WeakPolarHBondContact O-CB 3.46Å; L172-L176 VanDerWaalsContact O-CG 3.25Å; L172-L176 WeakPolarHBondContact O-CG 3.47Å; L172-L176 PolarHBondContact O-N 2.82Å; L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 PolarHBondContact O-N 3.09Å; L176-L179 PolarHBondContact O-N 3.16Å; L176-V180 WeakPolarHBondContact O-CB 3.39Å; L176-V180 VanDerWaalsContact O-CG2 3.25Å; L176-V180 WeakPolarHBondContact O-CG2 3.2Å; L176-V180 PolarHBondContact O-N 3.24Å; L176-L198 HydrophobicContact CD1-CD1 3.99Å; L176-I219 HydrophobicContact CB-CD1 4.21Å; L176-I219 HydrophobicContact CB-CG1 4.46Å; L176-I219 HydrophobicContact CB-CG2 3.59Å; L176-I219 HydrophobicContact CD1-CD1 4.43Å; L176-I219 HydrophobicContact CD1-CG1 4.29Å; L176-I219 HydrophobicContact CD1-CG2 4.46Å
177	R	94.8	Very high	93.6	Very high	29 Å²	29	28.3 Å²	28.3	11%	0.109	13%	0.13	C	C	.	.	H	α-helix	trans	-58.6	-45.3	176.7	-77.3	173.8	171.5	158.1	0.2	111.5	W162 V173 A174 A181 E217 Y218 I219	W162-R177 HydrophobicContact CE3-CB 3.89Å; W162-R177 HydrophobicContact CZ3-CB 4.13Å; V173-R177 VanDerWaalsContact CG1-CZ 3.49Å; V173-R177 WeakPolarHBondContact O-CB 3.39Å; V173-R177 VanDerWaalsContact O-CG 3.29Å; V173-R177 WeakPolarHBondContact O-CG 3.47Å; V173-R177 PolarHBondContact O-N 2.98Å; A174-R177 PolarHBondContact O-N 2.86Å; R177-A181 WeakPolarHBondContact O-CB 3.18Å; R177-A181 PolarHBondContact O-N 3.11Å; R177-E217 IonicContact CZ-OE2 3.19Å; R177-E217 IonicContact NH1-OE1 3.92Å; R177-E217 IonicContact NH1-OE2 2.72Å; R177-E217 PolarHBondContact NH1-OE2 3.16Å; R177-E217 IonicContact NH2-OE2 2.72Å; R177-E217 PolarHBondContact NH2-OE2 2.89Å; R177-Y218 VanDerWaalsContact CZ-O 3.23Å; R177-Y218 PolarHBondContact NE-O 2.86Å; R177-Y218 PolarHBondContact NH2-O 3.08Å; R177-I219 HydrophobicContact CG-CD1 4.19Å
178	L	96.5	Very high	92.9	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-51.1	176.9	177.5	65	0	0	0	111.2	L112 L144 V147 W162 I167 A174 I175 L176 V180 A181 I182	L112-L178 HydrophobicContact CD1-CD2 3.99Å; L112-L178 HydrophobicContact CD2-CD2 3.72Å; L144-L178 HydrophobicContact CD2-CD1 4.16Å; L144-L178 HydrophobicContact CD2-CD2 3.6Å; V147-L178 HydrophobicContact CG1-CD1 3.85Å; W162-L178 HydrophobicContact CB-CB 4.31Å; W162-L178 HydrophobicContact CD2-CB 4.07Å; W162-L178 HydrophobicContact CD2-CD1 3.93Å; W162-L178 HydrophobicContact CE3-CB 4.15Å; W162-L178 HydrophobicContact CG-CB 4.15Å; W162-L178 HydrophobicContact CG-CD1 4.08Å; W162-L178 HydrophobicContact CZ2-CD1 4.16Å; I167-L178 HydrophobicContact CD1-CD2 3.57Å; A174-L178 WeakPolarHBondContact O-CB 3.29Å; A174-L178 PolarHBondContact O-N 3.06Å; I175-L178 PolarHBondContact O-N 3.23Å; L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 PolarHBondContact O-N 3.09Å; L178-V180 VanDerWaalsContact C-N 3.33Å; L178-V180 PolarHBondContact O-N 3.33Å; L178-A181 WeakPolarHBondContact O-CB 3.33Å; L178-A181 PolarHBondContact O-N 3.28Å; L178-A181 VanDerWaalsContact O-N 3.14Å; L178-I182 HydrophobicContact CD1-CD1 4.01Å; L178-I182 HydrophobicContact CD1-CG1 4.31Å; L178-I182 HydrophobicContact CG-CD1 3.9Å; L178-I182 WeakPolarHBondContact O-CG1 3.3Å; L178-I182 PolarHBondContact O-N 3.18Å
179	L	97	Very high	92.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-40.9	-179.5	-73.4	-179.3	0	0	0	112.4	L84 I88 I102 L106 L115 I175 L176 A181 I182 A183	L84-L179 HydrophobicContact CD1-CB 4.01Å; L84-L179 HydrophobicContact CD1-CD1 4.19Å; L84-L179 HydrophobicContact CD2-CB 4.11Å; I88-L179 HydrophobicContact CD1-CD1 3.92Å; I88-L179 HydrophobicContact CD1-CD2 3.84Å; I102-L179 HydrophobicContact CD1-CD1 3.84Å; L106-L179 HydrophobicContact CD1-CD1 3.71Å; L106-L179 HydrophobicContact CD1-CD2 3.99Å; L106-L179 HydrophobicContact CD1-CG 4Å; L115-L179 HydrophobicContact CD2-CD2 4.22Å; I175-L179 HydrophobicContact CG2-CD1 4.08Å; I175-L179 HydrophobicContact CG2-CG 4.49Å; I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 WeakPolarHBondContact O-CG 3.34Å; I175-L179 PolarHBondContact O-N 2.79Å; L176-L179 PolarHBondContact O-N 3.16Å; L179-A181 VanDerWaalsContact C-N 3.32Å; L179-A181 PolarHBondContact O-N 3.14Å; L179-I182 PolarHBondContact O-N 2.84Å; L179-A183 WeakPolarHBondContact O-CB 3.38Å; L179-A183 PolarHBondContact O-N 2.64Å
180	V	93.9	Very high	92.1	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.012	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-41.8	175.1	166.1	0	0	0	0	110.8	L80 L84 L176 L178 R184 F192 I219 T220	L80-V180 HydrophobicContact CD1-CG2 3.98Å; L80-V180 HydrophobicContact CD2-CG2 4.4Å; L84-V180 HydrophobicContact CD1-CG2 4.34Å; L176-V180 WeakPolarHBondContact O-CB 3.39Å; L176-V180 VanDerWaalsContact O-CG2 3.25Å; L176-V180 WeakPolarHBondContact O-CG2 3.2Å; L176-V180 PolarHBondContact O-N 3.24Å; L178-V180 VanDerWaalsContact C-N 3.33Å; L178-V180 PolarHBondContact O-N 3.33Å; V180-R184 HydrophobicContact CG1-CG 4.47Å; V180-R184 WeakPolarHBondContact O-CB 3.31Å; V180-R184 WeakPolarHBondContact O-CD 3.26Å; V180-R184 WeakPolarHBondContact O-CG 3.5Å; V180-R184 PolarHBondContact O-N 2.9Å; V180-F192 HydrophobicContact CB-CE2 4.37Å; V180-F192 HydrophobicContact CG1-CD2 3.91Å; V180-F192 HydrophobicContact CG1-CE2 4.02Å; V180-F192 HydrophobicContact CG2-CD2 4.41Å; V180-F192 HydrophobicContact CG2-CE2 4.26Å; V180-F192 HydrophobicContact CG2-CZ 4.33Å; V180-I219 HydrophobicContact CG2-CG2 4.14Å; V180-T220 HydrophobicContact CG1-CG2 4.36Å
181	A	91.5	Very high	91.6	Very high	20 Å²	20	37.1 Å²	37.1	17%	0.165	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-47.2	176.9	0	0	0	0	0	112.1	L151 W162 R177 L178 L179 A183 R184 Q185	L151-A181 HydrophobicContact CD1-CB 3.99Å; W162-A181 HydrophobicContact CH2-CB 3.63Å; W162-A181 HydrophobicContact CZ2-CB 4.5Å; W162-A181 HydrophobicContact CZ3-CB 4.09Å; R177-A181 WeakPolarHBondContact O-CB 3.18Å; R177-A181 PolarHBondContact O-N 3.11Å; L178-A181 WeakPolarHBondContact O-CB 3.33Å; L178-A181 PolarHBondContact O-N 3.28Å; L178-A181 VanDerWaalsContact O-N 3.14Å; L179-A181 VanDerWaalsContact C-N 3.32Å; L179-A181 PolarHBondContact O-N 3.14Å; A181-A183 PolarHBondContact O-N 2.89Å; A181-R184 PolarHBondContact O-N 3.47Å; A181-Q185 PolarHBondContact O-N 2.72Å
182	I	94.6	Very high	91.4	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-61.3	-47.3	176.6	-61.7	169.9	0	0	0	110.5	W87 L112 V116 L119 V147 L151 L178 L179 R184 Q185 F186	W87-I182 HydrophobicContact CH2-CB 4.33Å; W87-I182 HydrophobicContact CH2-CG2 3.84Å; L112-I182 HydrophobicContact CD1-CD1 3.72Å; V116-I182 HydrophobicContact CG2-CD1 4.45Å; L119-I182 HydrophobicContact CD1-CG2 3.65Å; V147-I182 HydrophobicContact CG1-CD1 4.14Å; V147-I182 HydrophobicContact CG1-CG1 4.1Å; L151-I182 HydrophobicContact CD1-CG1 4.41Å; L178-I182 HydrophobicContact CD1-CD1 4.01Å; L178-I182 HydrophobicContact CD1-CG1 4.31Å; L178-I182 HydrophobicContact CG-CD1 3.9Å; L178-I182 WeakPolarHBondContact O-CG1 3.3Å; L178-I182 PolarHBondContact O-N 3.18Å; L179-I182 PolarHBondContact O-N 2.84Å; I182-R184 VanDerWaalsContact C-N 3.35Å; I182-R184 PolarHBondContact O-N 3.24Å; I182-Q185 PolarHBondContact O-N 2.72Å; I182-F186 HydrophobicContact CG2-CD2 3.76Å; I182-F186 HydrophobicContact CG2-CE2 4.26Å; I182-F186 WeakPolarHBondContact O-CD2 3.27Å; I182-F186 PolarHBondContact O-N 3.04Å
183	A	92.4	Very high	91	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.3	-45.1	178	0	0	0	0	0	112.8	L84 W87 L179 A181 Q185 F186 K187 M190 F192	L84-A183 HydrophobicContact CD2-CB 4.26Å; W87-A183 HydrophobicContact CE3-CB 4.1Å; W87-A183 HydrophobicContact CH2-CB 3.88Å; W87-A183 HydrophobicContact CZ2-CB 4.37Å; W87-A183 HydrophobicContact CZ3-CB 3.73Å; L179-A183 WeakPolarHBondContact O-CB 3.38Å; L179-A183 PolarHBondContact O-N 2.64Å; A181-A183 PolarHBondContact O-N 2.89Å; A183-Q185 PolarHBondContact O-N 2.89Å; A183-F186 PolarHBondContact O-N 2.91Å; A183-K187 CarbonylContact O-C 3.6Å; A183-K187 VanDerWaalsContact O-C 3.25Å; A183-K187 VanDerWaalsContact O-CA 3.3Å; A183-K187 WeakPolarHBondContact O-CA 3.2Å; A183-K187 PolarHBondContact O-N 3.44Å; A183-M190 HydrophobicContact CB-CE 3.3Å; A183-F192 HydrophobicContact CB-CE2 3.77Å; A183-F192 HydrophobicContact CB-CZ 3.62Å
184	R	86.9	Confident	90.5	Very high	86 Å²	86	46.4 Å²	46.4	33%	0.325	22%	0.221	S	C	.	.	H	α-helix	trans	-61	-33.8	179.8	-78.8	167.7	170.3	-170.3	-14.9	112.6	V180 A181 I182 F192 E221	V180-R184 HydrophobicContact CG1-CG 4.47Å; V180-R184 WeakPolarHBondContact O-CB 3.31Å; V180-R184 WeakPolarHBondContact O-CD 3.26Å; V180-R184 WeakPolarHBondContact O-CG 3.5Å; V180-R184 PolarHBondContact O-N 2.9Å; A181-R184 PolarHBondContact O-N 3.47Å; I182-R184 VanDerWaalsContact C-N 3.35Å; I182-R184 PolarHBondContact O-N 3.24Å; R184-F192 HydrophobicContact CG-CD2 4.28Å; R184-F192 HydrophobicContact CG-CE2 4.19Å; R184-E221 IonicContact CZ-OE1 3.14Å; R184-E221 VanDerWaalsContact CZ-OE1 3.27Å; R184-E221 IonicContact NH1-OE1 3.99Å; R184-E221 PolarHBondContact NH1-OE1 3.47Å; R184-E221 IonicContact NH2-OE1 3.93Å; R184-E221 PolarHBondContact NH2-OE1 2.81Å; R184-E221 IonicContact NH2-OE2 2.91Å
185	Q	87.6	Confident	90	Very high	59 Å²	59	47.4 Å²	47.4	28%	0.276	23%	0.23	S	C	.	.	H	α-helix	trans	-79.5	-46.5	178.7	177.4	159.7	-19.9	0	0	112.9	I150 L151 A181 I182 A183	I150-Q185 PolarHBondContact O-NE2 3.2Å; I150-Q185 PolarHBondContact O-OE1 3.31Å; L151-Q185 HydrophobicContact CD2-CB 4.14Å; A181-Q185 PolarHBondContact O-N 2.72Å; I182-Q185 PolarHBondContact O-N 2.72Å; A183-Q185 PolarHBondContact O-N 2.89Å
186	F	90.7	Very high	89.7	Confident	61 Å²	61	47.8 Å²	47.8	27%	0.268	23%	0.232	S	C	.	.	H	α-helix	trans	-93.5	-16.3	-171.7	-71.8	-76.4	0	0	0	114.4	L119 A120 I150 I182 A183	L119-F186 HydrophobicContact CB-CB 4.42Å; L119-F186 HydrophobicContact CB-CD1 3.76Å; L119-F186 HydrophobicContact CB-CD2 4.09Å; L119-F186 HydrophobicContact CB-CE1 3.94Å; L119-F186 HydrophobicContact CB-CE2 4.27Å; L119-F186 HydrophobicContact CB-CG 3.83Å; L119-F186 HydrophobicContact CB-CZ 4.19Å; L119-F186 HydrophobicContact CD1-CB 4.06Å; L119-F186 HydrophobicContact CD1-CD2 3.98Å; L119-F186 HydrophobicContact CD1-CG 4.03Å; L119-F186 HydrophobicContact CD2-CB 4.05Å; L119-F186 HydrophobicContact CD2-CG 4.38Å; L119-F186 HydrophobicContact CG-CB 4.41Å; L119-F186 HydrophobicContact CG-CG 4.3Å; L119-F186 WeakPolarHBondContact O-CE1 3.49Å; A120-F186 HydrophobicContact CB-CE1 4.35Å; A120-F186 HydrophobicContact CB-CZ 4.02Å; I150-F186 HydrophobicContact CG2-CE2 3.92Å; I150-F186 HydrophobicContact CG2-CZ 3.63Å; I182-F186 HydrophobicContact CG2-CD2 3.76Å; I182-F186 HydrophobicContact CG2-CE2 4.26Å; I182-F186 WeakPolarHBondContact O-CD2 3.27Å; I182-F186 PolarHBondContact O-N 3.04Å; A183-F186 PolarHBondContact O-N 2.91Å
187	K	90.2	Very high	89.4	Confident	40 Å²	40	50.6 Å²	50.6	17%	0.174	25%	0.245	C	C	.	.			trans	-140.8	63.8	180	-161.9	165.1	-166.1	151.8	0	111.5	W87 E91 A183 E189 M190	W87-K187 HydrophobicContact CG-CD 3.98Å; W87-K187 VanDerWaalsContact NE1-CD 3.32Å; E91-K187 IonicContact OE1-NZ 3.1Å; E91-K187 PolarHBondContact OE1-NZ 3.09Å; E91-K187 VanDerWaalsContact OE1-NZ 3.1Å; A183-K187 CarbonylContact O-C 3.6Å; A183-K187 VanDerWaalsContact O-C 3.25Å; A183-K187 VanDerWaalsContact O-CA 3.3Å; A183-K187 WeakPolarHBondContact O-CA 3.2Å; A183-K187 PolarHBondContact O-N 3.44Å; K187-E189 HydrophobicContact CG-CG 4.03Å; K187-E189 WeakPolarHBondContact CG-OE1 3.1Å; K187-E189 PolarHBondContact O-N 2.69Å; K187-E189 VanDerWaalsContact O-N 3.1Å; K187-M190 HydrophobicContact CB-CB 4.34Å; K187-M190 HydrophobicContact CD-CB 4.23Å; K187-M190 HydrophobicContact CD-CE 4.45Å; K187-M190 HydrophobicContact CG-CB 3.92Å; K187-M190 WeakPolarHBondContact O-CB 3.41Å; K187-M190 PolarHBondContact O-N 2.71Å
188	P	80.9	Confident	89.2	Confident	86 Å²	86	49.2 Å²	49.2	56%	0.558	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.4	-174.6	26.1	-35.9	0	0	0	114.4	M190	P188-M190 PolarHBondContact O-N 3.35Å
189	E	83.8	Confident	88.9	Confident	127 Å²	127	50 Å²	50	59%	0.593	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-24.2	171.5	64.4	-89	-153	0	0	113.2	K187 R191	K187-E189 HydrophobicContact CG-CG 4.03Å; K187-E189 WeakPolarHBondContact CG-OE1 3.1Å; K187-E189 PolarHBondContact O-N 2.69Å; K187-E189 VanDerWaalsContact O-N 3.1Å; E189-R191 PolarHBondContact O-N 3.08Å; E189-R191 VanDerWaalsContact O-N 3.13Å
190	M	86.4	Confident	88.5	Confident	28 Å²	28	50.6 Å²	50.6	14%	0.138	25%	0.248	C	C	.	.	S	Bend	trans	-81.1	92.5	176	-173.4	170.2	60	0	0	110	L84 W87 A183 K187 P188 F192	L84-M190 HydrophobicContact CD2-CE 4.37Å; W87-M190 HydrophobicContact CB-CE 3.99Å; W87-M190 HydrophobicContact CB-SD 3.75Å; W87-M190 HydrophobicContact CD2-CE 3.6Å; W87-M190 HydrophobicContact CE3-CE 3.8Å; W87-M190 HydrophobicContact CG-CE 3.7Å; W87-M190 HydrophobicContact CG-SD 4.05Å; A183-M190 HydrophobicContact CB-CE 3.3Å; K187-M190 HydrophobicContact CB-CB 4.34Å; K187-M190 HydrophobicContact CD-CB 4.23Å; K187-M190 HydrophobicContact CD-CE 4.45Å; K187-M190 HydrophobicContact CG-CB 3.92Å; K187-M190 WeakPolarHBondContact O-CB 3.41Å; K187-M190 PolarHBondContact O-N 2.71Å; P188-M190 PolarHBondContact O-N 3.35Å; M190-F192 HydrophobicContact CE-CE1 4.2Å; M190-F192 HydrophobicContact CE-CE2 4.43Å; M190-F192 HydrophobicContact CE-CZ 3.58Å; M190-F192 HydrophobicContact CG-CE1 4.18Å; M190-F192 HydrophobicContact CG-CZ 4.16Å; M190-F192 HydrophobicContact SD-CE1 4.31Å; M190-F192 HydrophobicContact SD-CZ 4.25Å
191	R	84.7	Confident	88.1	Confident	201 Å²	201	51.1 Å²	51.1	76%	0.758	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-86.3	138.1	178	-62.3	-173	178.7	96.5	0.1	112	E189	E189-R191 PolarHBondContact O-N 3.08Å; E189-R191 VanDerWaalsContact O-N 3.13Å
192	F	88.1	Confident	87.8	Confident	28 Å²	28	50.7 Å²	50.7	12%	0.123	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-103.5	147.8	172.9	-53.5	-69.6	0	0	0	110.1	L80 L84 V180 A183 R184 M190 T220	L80-F192 HydrophobicContact CD1-CD1 3.25Å; L80-F192 HydrophobicContact CD1-CE1 3.53Å; L80-F192 HydrophobicContact CD1-CG 4.06Å; L84-F192 HydrophobicContact CD2-CE1 3.89Å; L84-F192 HydrophobicContact CD2-CZ 3.68Å; L84-F192 HydrophobicContact CG-CE1 4.26Å; V180-F192 HydrophobicContact CB-CE2 4.37Å; V180-F192 HydrophobicContact CG1-CD2 3.91Å; V180-F192 HydrophobicContact CG1-CE2 4.02Å; V180-F192 HydrophobicContact CG2-CD2 4.41Å; V180-F192 HydrophobicContact CG2-CE2 4.26Å; V180-F192 HydrophobicContact CG2-CZ 4.33Å; A183-F192 HydrophobicContact CB-CE2 3.77Å; A183-F192 HydrophobicContact CB-CZ 3.62Å; R184-F192 HydrophobicContact CG-CD2 4.28Å; R184-F192 HydrophobicContact CG-CE2 4.19Å; M190-F192 HydrophobicContact CE-CE1 4.2Å; M190-F192 HydrophobicContact CE-CE2 4.43Å; M190-F192 HydrophobicContact CE-CZ 3.58Å; M190-F192 HydrophobicContact CG-CE1 4.18Å; M190-F192 HydrophobicContact CG-CZ 4.16Å; M190-F192 HydrophobicContact SD-CE1 4.31Å; M190-F192 HydrophobicContact SD-CZ 4.25Å; F192-T220 HydrophobicContact CB-CG2 3.91Å
193	Q	86.5	Confident	87.3	Confident	114 Å²	114	50.7 Å²	50.7	53%	0.533	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-67.6	140.5	171.9	-68.6	178.1	-21.3	0	0	109	I196 T220	Q193-I196 HydrophobicContact CB-CD1 4.23Å; Q193-I196 HydrophobicContact CB-CG1 4.39Å; Q193-I196 WeakPolarHBondContact O-CD1 3.22Å; Q193-I196 WeakPolarHBondContact O-CG1 3.45Å; Q193-T220 WeakPolarHBondContact O-CB 3.38Å; Q193-T220 PolarHBondContact O-OG1 3.33Å; Q193-T220 VanDerWaalsContact O-OG1 3.06Å
194	P	84.7	Confident	87	Confident	87 Å²	87	55.9 Å²	55.9	57%	0.565	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	158.3	174	30.6	-34.4	0	0	0	111.1	I196 E221	P194-I196 VanDerWaalsContact C-N 3.34Å; P194-I196 PolarHBondContact O-N 3.12Å; P194-E221 CarbonylContact C-O 3.25Å; P194-E221 VanDerWaalsContact CA-O 3.28Å; P194-E221 WeakPolarHBondContact CA-O 3.41Å; P194-E221 VanDerWaalsContact CB-O 3.26Å; P194-E221 WeakPolarHBondContact CB-O 3.37Å
195	G	84.2	Confident	86.8	Confident	20 Å²	20	54.6 Å²	54.6	21%	0.206	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	15.9	172	0	0	0	0	0	115.6	F197 T220 E221	G195-F197 WeakPolarHBondContact O-CD1 3.15Å; G195-F197 PolarHBondContact O-N 3.01Å; G195-T220 PolarHBondContact N-OG1 3.26Å; G195-E221 PolarHBondContact N-O 2.99Å
196	I	90.6	Very high	86.6	Confident	10 Å²	10	54 Å²	54	5%	0.051	26%	0.261	C	S	.	.			trans	-68	125.7	170.3	-55.1	174.8	0	0	0	108.7	V77 L80 Q193 P194 I219 T220	V77-I196 HydrophobicContact CG2-CG2 3.99Å; L80-I196 HydrophobicContact CB-CD1 4.16Å; L80-I196 HydrophobicContact CD2-CD1 4.14Å; L80-I196 HydrophobicContact CD2-CG2 4.1Å; Q193-I196 HydrophobicContact CB-CD1 4.23Å; Q193-I196 HydrophobicContact CB-CG1 4.39Å; Q193-I196 WeakPolarHBondContact O-CD1 3.22Å; Q193-I196 WeakPolarHBondContact O-CG1 3.45Å; P194-I196 VanDerWaalsContact C-N 3.34Å; P194-I196 PolarHBondContact O-N 3.12Å; I196-I219 PolarHBondContact O-N 3.38Å; I196-T220 HydrophobicContact CB-CG2 4.28Å; I196-T220 WeakPolarHBondContact CB-OG1 3.35Å; I196-T220 HydrophobicContact CD1-CG2 4.1Å; I196-T220 HydrophobicContact CG1-CG2 4.41Å; I196-T220 PolarHBondContact N-OG1 3.26Å; I196-T220 PolarHBondContact O-N 3.17Å
197	F	90.8	Very high	86.3	Confident	60 Å²	60	58.3 Å²	58.3	26%	0.263	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	156.7	177.7	65	-91.7	0	0	0	111.7	G195 R216 E217 Y218	G195-F197 WeakPolarHBondContact O-CD1 3.15Å; G195-F197 PolarHBondContact O-N 3.01Å; F197-R216 HydrophobicContact CD2-CB 4.13Å; F197-R216 HydrophobicContact CD2-CG 3.9Å; F197-R216 HydrophobicContact CE2-CG 4.04Å; F197-R216 HydrophobicContact CG-CB 4.47Å; F197-E217 WeakPolarHBondContact CA-O 3.43Å; F197-Y218 HydrophobicContact CB-CD1 3.69Å; F197-Y218 HydrophobicContact CB-CE1 3.92Å; F197-Y218 HydrophobicContact CB-CG 4.05Å; F197-Y218 HydrophobicContact CD1-CD1 4.37Å; F197-Y218 AromaticContact CD1-CE1 3.85Å; F197-Y218 HydrophobicContact CD1-CE1 3.85Å; F197-Y218 HydrophobicContact CG-CD1 4.45Å; F197-Y218 HydrophobicContact CG-CE1 4.21Å
198	L	91.8	Very high	85.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.5	166.5	-77.9	168.1	0	0	0	109.2	I67 S71 Q72 V77 L172 V173 L176 E217 I219	I67-L198 HydrophobicContact CD1-CD1 4.39Å; I67-L198 HydrophobicContact CG2-CD2 3.95Å; S71-L198 WeakPolarHBondContact OG-CA 3.42Å; Q72-L198 HydrophobicContact CB-CD2 4.34Å; V77-L198 HydrophobicContact CG1-CD2 4.1Å; V77-L198 HydrophobicContact CG2-CD2 3.9Å; V77-L198 HydrophobicContact CG2-CG 4.34Å; L172-L198 HydrophobicContact CB-CD1 4.49Å; L172-L198 HydrophobicContact CD2-CD1 3.89Å; L172-L198 HydrophobicContact CG-CD1 3.99Å; V173-L198 HydrophobicContact CG2-CB 4.1Å; V173-L198 HydrophobicContact CG2-CD1 3.85Å; L176-L198 HydrophobicContact CD1-CD1 3.99Å; L198-E217 PolarHBondContact N-O 2.76Å; L198-E217 PolarHBondContact O-N 3.08Å; L198-I219 HydrophobicContact CD1-CD1 4.18Å; L198-I219 HydrophobicContact CD1-CG1 4.43Å; L198-I219 HydrophobicContact CG-CG1 4.5Å
199	T	89.4	Confident	85.8	Confident	19 Å²	19	62.4 Å²	62.4	12%	0.117	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	120.9	170	-49.4	0	0	0	0	108.7	E68 S71 Y214 E215	E68-T199 HydrophobicContact CB-CG2 4.23Å; E68-T199 WeakPolarHBondContact CB-O 3.41Å; E68-T199 PolarHBondContact N-O 3.28Å; E68-T199 WeakPolarHBondContact OE2-CB 3.3Å; E68-T199 WeakPolarHBondContact OE2-CG2 3.09Å; E68-T199 PolarHBondContact OE2-OG1 2.99Å; S71-T199 PolarHBondContact OG-N 3.39Å; T199-Y214 HydrophobicContact CG2-CD1 3.96Å; T199-E215 CarbonylContact C-O 3.41Å; T199-E215 WeakPolarHBondContact CA-O 3.2Å
200	V	88.4	Confident	85.7	Confident	13 Å²	13	58.8 Å²	58.8	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.6	174.2	178.5	0	0	0	0	108.9	F66 I67 V173 I202 Y214 E215 E217	F66-V200 CarbonylContact O-C 3.56Å; F66-V200 WeakPolarHBondContact O-CA 3.49Å; I67-V200 HydrophobicContact CG1-CG2 4.41Å; V173-V200 HydrophobicContact CG2-CG2 4.14Å; V200-I202 HydrophobicContact CG1-CG1 4.17Å; V200-Y214 WeakPolarHBondContact O-CA 3.37Å; V200-E215 PolarHBondContact N-O 3.27Å; V200-E215 PolarHBondContact O-N 3.28Å; V200-E217 HydrophobicContact CB-CG 4.35Å; V200-E217 HydrophobicContact CG2-CB 4.12Å; V200-E217 HydrophobicContact CG2-CG 3.73Å
201	I	86.2	Confident	85.6	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.067	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	118.4	174.1	-47.1	178.1	0	0	0	107.4	S65 F66 E68 Y212 Y214	S65-I201 CarbonylContact C-O 3.48Å; S65-I201 WeakPolarHBondContact CA-O 3.34Å; F66-I201 PolarHBondContact N-O 2.9Å; F66-I201 PolarHBondContact O-N 3.12Å; E68-I201 HydrophobicContact CB-CD1 4.01Å; E68-I201 HydrophobicContact CB-CG1 4.03Å; E68-I201 HydrophobicContact CG-CD1 4.13Å; I201-Y212 HydrophobicContact CG2-CD1 4.15Å; I201-Y214 HydrophobicContact CD1-CE1 3.91Å; I201-Y214 HydrophobicContact CG1-CD1 3.85Å; I201-Y214 HydrophobicContact CG1-CE1 3.72Å; I201-Y214 HydrophobicContact CG2-CE1 4.22Å
202	I	85.8	Confident	85.6	Confident	12 Å²	12	57.1 Å²	57.1	6%	0.062	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.9	174.8	-55.3	171.4	0	0	0	107.7	E63 R64 V200 Y212 R213 E215	E63-I202 HydrophobicContact CG-CG2 3.29Å; E63-I202 WeakPolarHBondContact OE2-CG2 3.37Å; R64-I202 WeakPolarHBondContact O-CA 3.13Å; V200-I202 HydrophobicContact CG1-CG1 4.17Å; I202-Y212 WeakPolarHBondContact O-CA 3.4Å; I202-R213 HydrophobicContact CB-CG 3.6Å; I202-R213 HydrophobicContact CD1-CG 4.2Å; I202-R213 HydrophobicContact CG1-CG 4.33Å; I202-R213 HydrophobicContact CG2-CG 4.18Å; I202-R213 PolarHBondContact N-O 2.94Å; I202-R213 PolarHBondContact O-N 3.36Å; I202-E215 HydrophobicContact CD1-CB 4.4Å; I202-E215 HydrophobicContact CD1-CG 3.87Å; I202-E215 VanDerWaalsContact CD1-OE2 3.3Å; I202-E215 WeakPolarHBondContact CD1-OE2 3.2Å
203	A	83.8	Confident	85.4	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.5	178.7	0	0	0	0	0	109.6	L58 E63 R64 F66 E211 Y212	L58-A203 HydrophobicContact CD1-CB 4.13Å; E63-A203 WeakPolarHBondContact CA-O 3.46Å; R64-A203 PolarHBondContact N-O 3.3Å; R64-A203 PolarHBondContact O-N 3.38Å; F66-A203 HydrophobicContact CE2-CB 4.39Å; A203-E211 CarbonylContact C-O 3Å; A203-E211 WeakPolarHBondContact CA-O 3.3Å; A203-Y212 HydrophobicContact CB-CD1 3.7Å; A203-Y212 HydrophobicContact CB-CE1 3.59Å
204	R	84.9	Confident	85.3	Confident	108 Å²	108	61.8 Å²	61.8	41%	0.408	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.8	177.5	-168.2	178.5	-165.4	175.9	6.8	110.4	Q62 E63 L206 L210 E211	Q62-R204 WeakPolarHBondContact O-CA 3.38Å; E63-R204 HydrophobicContact CB-CG 4.36Å; R204-L206 HydrophobicContact CG-CD2 4.45Å; R204-L206 HydrophobicContact CG-CG 4.14Å; R204-L210 CarbonylContact O-C 3.54Å; R204-L210 WeakPolarHBondContact O-CA 3.26Å; R204-E211 PolarHBondContact N-O 3.49Å; R204-E211 PolarHBondContact O-N 2.87Å
205	K	83	Confident	85.4	Confident	59 Å²	59	61.1 Å²	61.1	26%	0.257	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117.6	173.2	-167.5	177	177.5	-175.2	0	110.6	L58 G61 Q62 K209 L210	L58-K205 HydrophobicContact CB-CB 3.99Å; L58-K205 HydrophobicContact CB-CD 4.35Å; L58-K205 WeakPolarHBondContact O-CD 3.34Å; L58-K205 PolarHBondContact O-NZ 3.48Å; G61-K205 WeakPolarHBondContact CA-O 3.35Å; G61-K205 PolarHBondContact N-O 3.34Å; Q62-K205 PolarHBondContact O-N 2.88Å; K205-K209 CarbonylContact C-O 3.55Å; K205-K209 WeakPolarHBondContact CA-O 3.13Å; K205-L210 HydrophobicContact CB-CD2 3.89Å; K205-L210 HydrophobicContact CG-CD2 4.19Å
206	L	83.3	Confident	85.6	Confident	47 Å²	47	67.8 Å²	67.8	25%	0.246	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.2	176.4	-66.6	179.5	0	0	0	110.5	E60 R204 G208 K209	E60-L206 VanDerWaalsContact OE1-CA 3.3Å; E60-L206 WeakPolarHBondContact OE1-CA 3.38Å; R204-L206 HydrophobicContact CG-CD2 4.45Å; R204-L206 HydrophobicContact CG-CG 4.14Å; L206-G208 PolarHBondContact O-N 3Å; L206-K209 PolarHBondContact N-O 3.23Å; L206-K209 PolarHBondContact O-N 2.94Å; L206-K209 VanDerWaalsContact O-O 3.1Å
207	N	85.9	Confident	85.7	Confident	151 Å²	151	69.7 Å²	69.7	81%	0.807	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	41.2	-175	-57.2	-57.3	0	0	0	112.9	E60 K209	E60-N207 WeakPolarHBondContact OE1-CA 3.44Å; E60-N207 PolarHBondContact OE1-N 3.5Å; N207-K209 PolarHBondContact O-N 2.97Å
208	G	79.7	Confident	85.7	Confident	53 Å²	53	70.4 Å²	70.4	55%	0.546	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	1.1	-177.4	0	0	0	0	0	115.5	E60 L206	E60-G208 PolarHBondContact OE2-N 3.19Å; L206-G208 PolarHBondContact O-N 3Å
209	K	80.7	Confident	85.5	Confident	160 Å²	160	70.9 Å²	70.9	70%	0.696	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	146.5	174.4	-65.4	-178.3	-178.3	177.2	0	110.4	K205 L206 N207	K205-K209 CarbonylContact C-O 3.55Å; K205-K209 WeakPolarHBondContact CA-O 3.13Å; L206-K209 PolarHBondContact N-O 3.23Å; L206-K209 PolarHBondContact O-N 2.94Å; L206-K209 VanDerWaalsContact O-O 3.1Å; N207-K209 PolarHBondContact O-N 2.97Å
210	L	81.4	Confident	85.4	Confident	51 Å²	51	70.1 Å²	70.1	27%	0.267	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.2	172.2	-67.4	168.6	0	0	0	109.2	L58 R204 K205 Y212	L58-L210 HydrophobicContact CB-CD2 4.33Å; L58-L210 HydrophobicContact CD1-CD2 3.83Å; L58-L210 HydrophobicContact CG-CD2 4.42Å; R204-L210 CarbonylContact O-C 3.54Å; R204-L210 WeakPolarHBondContact O-CA 3.26Å; K205-L210 HydrophobicContact CB-CD2 3.89Å; K205-L210 HydrophobicContact CG-CD2 4.19Å; L210-Y212 HydrophobicContact CB-CE2 3.84Å; L210-Y212 VanDerWaalsContact CB-OH 3.25Å; L210-Y212 WeakPolarHBondContact CB-OH 3.5Å; L210-Y212 VanDerWaalsContact CD1-OH 3.23Å; L210-Y212 WeakPolarHBondContact CD1-OH 3.45Å
211	E	84.3	Confident	84.5	Confident	107 Å²	107	72.5 Å²	72.5	50%	0.5	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.3	170.8	-66.6	-174.1	176.7	0	0	109.4	A203 R204	A203-E211 CarbonylContact C-O 3Å; A203-E211 WeakPolarHBondContact CA-O 3.3Å; R204-E211 PolarHBondContact N-O 3.49Å; R204-E211 PolarHBondContact O-N 2.87Å
212	Y	83.5	Confident	83.2	Confident	86 Å²	86	76.1 Å²	76.1	34%	0.337	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.5	-179.5	-56.2	-85.2	0	0	0	109.6	P53 I201 I202 A203 L210	P53-Y212 HydrophobicContact CB-CE1 3.59Å; P53-Y212 WeakPolarHBondContact CB-OH 3.46Å; P53-Y212 HydrophobicContact CG-CE1 4.22Å; I201-Y212 HydrophobicContact CG2-CD1 4.15Å; I202-Y212 WeakPolarHBondContact O-CA 3.4Å; A203-Y212 HydrophobicContact CB-CD1 3.7Å; A203-Y212 HydrophobicContact CB-CE1 3.59Å; L210-Y212 HydrophobicContact CB-CE2 3.84Å; L210-Y212 VanDerWaalsContact CB-OH 3.25Å; L210-Y212 WeakPolarHBondContact CB-OH 3.5Å; L210-Y212 VanDerWaalsContact CD1-OH 3.23Å; L210-Y212 WeakPolarHBondContact CD1-OH 3.45Å
213	R	84.4	Confident	81.3	Confident	113 Å²	113	79.8 Å²	79.8	43%	0.426	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144	166.6	64.2	-179.1	167.7	149.1	-6.7	109.2	E63 I202 E215	E63-R213 IonicContact OE1-NH2 2.77Å; E63-R213 PolarHBondContact OE1-NH2 3.37Å; E63-R213 IonicContact OE2-CZ 2.68Å; E63-R213 IonicContact OE2-NE 2.78Å; E63-R213 IonicContact OE2-NH2 3.27Å; E63-R213 PolarHBondContact OE2-NH2 3Å; I202-R213 HydrophobicContact CB-CG 3.6Å; I202-R213 HydrophobicContact CD1-CG 4.2Å; I202-R213 HydrophobicContact CG1-CG 4.33Å; I202-R213 HydrophobicContact CG2-CG 4.18Å; I202-R213 PolarHBondContact N-O 2.94Å; I202-R213 PolarHBondContact O-N 3.36Å; R213-E215 IonicContact CZ-OE1 2.93Å; R213-E215 IonicContact NE-OE1 2.68Å; R213-E215 IonicContact NH1-OE1 3.71Å; R213-E215 PolarHBondContact NH1-OE1 3.36Å
214	Y	85.5	Confident	79.2	Confident	127 Å²	127	85 Å²	85	50%	0.498	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.6	179.2	-64.3	-101.8	0	0	0	108.1	T199 V200 I201	T199-Y214 HydrophobicContact CG2-CD1 3.96Å; V200-Y214 WeakPolarHBondContact O-CA 3.37Å; I201-Y214 HydrophobicContact CD1-CE1 3.91Å; I201-Y214 HydrophobicContact CG1-CD1 3.85Å; I201-Y214 HydrophobicContact CG1-CE1 3.72Å; I201-Y214 HydrophobicContact CG2-CE1 4.22Å
215	E	86.6	Confident	76.8	Confident	74 Å²	74	86.2 Å²	86.2	35%	0.346	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.7	179.9	-66.4	-170.3	179.8	0	0	110.1	T199 V200 I202 R213	T199-E215 CarbonylContact C-O 3.41Å; T199-E215 WeakPolarHBondContact CA-O 3.2Å; V200-E215 PolarHBondContact N-O 3.27Å; V200-E215 PolarHBondContact O-N 3.28Å; I202-E215 HydrophobicContact CD1-CB 4.4Å; I202-E215 HydrophobicContact CD1-CG 3.87Å; I202-E215 VanDerWaalsContact CD1-OE2 3.3Å; I202-E215 WeakPolarHBondContact CD1-OE2 3.2Å; R213-E215 IonicContact CZ-OE1 2.93Å; R213-E215 IonicContact NE-OE1 2.68Å; R213-E215 IonicContact NH1-OE1 3.71Å; R213-E215 PolarHBondContact NH1-OE1 3.36Å
216	R	88.3	Confident	74.8	Confident	160 Å²	160	87.6 Å²	87.6	60%	0.604	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	115	176.6	-68.8	-175.2	-178.8	174.9	0.6	109.4	F197 Y218	F197-R216 HydrophobicContact CD2-CB 4.13Å; F197-R216 HydrophobicContact CD2-CG 3.9Å; F197-R216 HydrophobicContact CE2-CG 4.04Å; F197-R216 HydrophobicContact CG-CB 4.47Å; R216-Y218 HydrophobicContact CB-CE2 4.27Å
217	E	91.5	Very high	72.6	Confident	49 Å²	49	90.5 Å²	90.5	23%	0.229	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	103	177.6	-75.1	-87.4	-139.9	0	0	109.5	R166 V173 R177 F197 L198 V200	R166-E217 IonicContact NH2-OE1 3.31Å; V173-E217 HydrophobicContact CG1-CB 3.83Å; V173-E217 HydrophobicContact CG1-CG 4.4Å; V173-E217 HydrophobicContact CG2-CB 4.08Å; R177-E217 IonicContact CZ-OE2 3.19Å; R177-E217 IonicContact NH1-OE1 3.92Å; R177-E217 IonicContact NH1-OE2 2.72Å; R177-E217 PolarHBondContact NH1-OE2 3.16Å; R177-E217 IonicContact NH2-OE2 2.72Å; R177-E217 PolarHBondContact NH2-OE2 2.89Å; F197-E217 WeakPolarHBondContact CA-O 3.43Å; L198-E217 PolarHBondContact N-O 2.76Å; L198-E217 PolarHBondContact O-N 3.08Å; V200-E217 HydrophobicContact CB-CG 4.35Å; V200-E217 HydrophobicContact CG2-CB 4.12Å; V200-E217 HydrophobicContact CG2-CG 3.73Å
218	Y	90.3	Very high	70.4	Confident	75 Å²	75	88.5 Å²	88.5	29%	0.294	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	130	-179.1	-70.9	-87.6	0	0	0	111.7	R177 F197 R216 F222	R177-Y218 VanDerWaalsContact CZ-O 3.23Å; R177-Y218 PolarHBondContact NE-O 2.86Å; R177-Y218 PolarHBondContact NH2-O 3.08Å; F197-Y218 HydrophobicContact CB-CD1 3.69Å; F197-Y218 HydrophobicContact CB-CE1 3.92Å; F197-Y218 HydrophobicContact CB-CG 4.05Å; F197-Y218 HydrophobicContact CD1-CD1 4.37Å; F197-Y218 AromaticContact CD1-CE1 3.85Å; F197-Y218 HydrophobicContact CD1-CE1 3.85Å; F197-Y218 HydrophobicContact CG-CD1 4.45Å; F197-Y218 HydrophobicContact CG-CE1 4.21Å; R216-Y218 HydrophobicContact CB-CE2 4.27Å; Y218-F222 HydrophobicContact CD1-CB 4.06Å; Y218-F222 HydrophobicContact CE1-CB 4.03Å; Y218-F222 HydrophobicContact CE1-CD2 4.03Å; Y218-F222 HydrophobicContact CE1-CG 4.11Å
219	I	89.6	Confident	68.4	Low	11 Å²	11	88.9 Å²	88.9	6%	0.056	45%	0.447	C	S	.	.	S	Bend	trans	-90.7	-42.9	177.5	-55	-52.8	0	0	0	110.6	L80 V173 L176 R177 V180 I196 L198	L80-I219 HydrophobicContact CD2-CB 4.4Å; L80-I219 HydrophobicContact CD2-CG2 3.72Å; V173-I219 HydrophobicContact CB-CD1 4.22Å; V173-I219 HydrophobicContact CG1-CD1 3.83Å; V173-I219 HydrophobicContact CG2-CD1 4.4Å; L176-I219 HydrophobicContact CB-CD1 4.21Å; L176-I219 HydrophobicContact CB-CG1 4.46Å; L176-I219 HydrophobicContact CB-CG2 3.59Å; L176-I219 HydrophobicContact CD1-CD1 4.43Å; L176-I219 HydrophobicContact CD1-CG1 4.29Å; L176-I219 HydrophobicContact CD1-CG2 4.46Å; R177-I219 HydrophobicContact CG-CD1 4.19Å; V180-I219 HydrophobicContact CG2-CG2 4.14Å; I196-I219 PolarHBondContact O-N 3.38Å; L198-I219 HydrophobicContact CD1-CD1 4.18Å; L198-I219 HydrophobicContact CD1-CG1 4.43Å; L198-I219 HydrophobicContact CG-CG1 4.5Å
220	T	85.5	Confident	66.5	Low	3 Å²	3	83.1 Å²	83.1	2%	0.018	43%	0.427	C	S	.	.	S	Bend	trans	-112.7	150.6	176.5	57.8	0	0	0	0	109.6	V180 F192 Q193 G195 I196 F222	V180-T220 HydrophobicContact CG1-CG2 4.36Å; F192-T220 HydrophobicContact CB-CG2 3.91Å; Q193-T220 WeakPolarHBondContact O-CB 3.38Å; Q193-T220 PolarHBondContact O-OG1 3.33Å; Q193-T220 VanDerWaalsContact O-OG1 3.06Å; G195-T220 PolarHBondContact N-OG1 3.26Å; I196-T220 HydrophobicContact CB-CG2 4.28Å; I196-T220 WeakPolarHBondContact CB-OG1 3.35Å; I196-T220 HydrophobicContact CD1-CG2 4.1Å; I196-T220 HydrophobicContact CG1-CG2 4.41Å; I196-T220 PolarHBondContact N-OG1 3.26Å; I196-T220 PolarHBondContact O-N 3.17Å; T220-F222 PolarHBondContact O-N 2.96Å
221	E	70.6	Confident	64.4	Low	63 Å²	63	84.9 Å²	84.9	29%	0.294	44%	0.441	S	S	.	.			trans	-44.8	132.9	176.2	-75.5	149.2	-134.6	0	0	112.4	R184 P194 G195 T223 H238	R184-E221 IonicContact CZ-OE1 3.14Å; R184-E221 VanDerWaalsContact CZ-OE1 3.27Å; R184-E221 IonicContact NH1-OE1 3.99Å; R184-E221 PolarHBondContact NH1-OE1 3.47Å; R184-E221 IonicContact NH2-OE1 3.93Å; R184-E221 PolarHBondContact NH2-OE1 2.81Å; R184-E221 IonicContact NH2-OE2 2.91Å; P194-E221 CarbonylContact C-O 3.25Å; P194-E221 VanDerWaalsContact CA-O 3.28Å; P194-E221 WeakPolarHBondContact CA-O 3.41Å; P194-E221 VanDerWaalsContact CB-O 3.26Å; P194-E221 WeakPolarHBondContact CB-O 3.37Å; G195-E221 PolarHBondContact N-O 2.99Å; E221-T223 PolarHBondContact O-N 2.63Å; E221-H238 IonicContact OE2-NE2 2.61Å
222	F	57.8	Low	62.3	Low	89 Å²	89	84.6 Å²	84.6	39%	0.39	44%	0.443	S	S	.	.			trans	-93.3	94	168.9	-179.5	-115.9	0	0	0	106.8	Y218 T220 E224	Y218-F222 HydrophobicContact CD1-CB 4.06Å; Y218-F222 HydrophobicContact CE1-CB 4.03Å; Y218-F222 HydrophobicContact CE1-CD2 4.03Å; Y218-F222 HydrophobicContact CE1-CG 4.11Å; T220-F222 PolarHBondContact O-N 2.96Å; F222-E224 HydrophobicContact CD1-CB 3.72Å; F222-E224 HydrophobicContact CD1-CG 4.21Å; F222-E224 HydrophobicContact CE1-CB 3.41Å; F222-E224 VanDerWaalsContact CE1-CB 3.41Å; F222-E224 HydrophobicContact CE1-CG 3.38Å; F222-E224 VanDerWaalsContact CE1-OE1 3.32Å; F222-E224 WeakPolarHBondContact CE1-OE1 3.42Å; F222-E224 HydrophobicContact CZ-CB 4.1Å; F222-E224 HydrophobicContact CZ-CG 3.81Å; F222-E224 PolarHBondContact O-N 2.81Å
223	T	45.9	Very low	60.4	Low	89 Å²	89	84.4 Å²	84.4	55%	0.546	45%	0.447	S	S	.	.			trans	-72.4	77.8	167.6	-44.7	0	0	0	0	107.2	E221 T225	E221-T223 PolarHBondContact O-N 2.63Å; T223-T225 PolarHBondContact O-N 2.67Å
224	E	40.2	Very low	58.2	Low	109 Å²	109	81.6 Å²	81.6	51%	0.509	45%	0.448	S	S	.	.			trans	-59.6	113.6	161	-148.4	168.2	-139.6	0	0	104.4	F222 L226	F222-E224 HydrophobicContact CD1-CB 3.72Å; F222-E224 HydrophobicContact CD1-CG 4.21Å; F222-E224 HydrophobicContact CE1-CB 3.41Å; F222-E224 VanDerWaalsContact CE1-CB 3.41Å; F222-E224 HydrophobicContact CE1-CG 3.38Å; F222-E224 VanDerWaalsContact CE1-OE1 3.32Å; F222-E224 WeakPolarHBondContact CE1-OE1 3.42Å; F222-E224 HydrophobicContact CZ-CB 4.1Å; F222-E224 HydrophobicContact CZ-CG 3.81Å; F222-E224 PolarHBondContact O-N 2.81Å; E224-L226 HydrophobicContact CB-CD1 4.25Å; E224-L226 HydrophobicContact CB-CD2 4.47Å; E224-L226 HydrophobicContact CB-CG 3.8Å; E224-L226 HydrophobicContact CG-CD1 4.39Å; E224-L226 HydrophobicContact CG-CD2 3.84Å; E224-L226 HydrophobicContact CG-CG 3.73Å; E224-L226 PolarHBondContact O-N 2.81Å; E224-L226 WeakPolarHBondContact OE2-CD1 3.35Å
225	T	34.4	Very low	56	Low	135 Å²	135	78.1 Å²	78.1	83%	0.828	44%	0.438	S	S	*	.			trans	-71.1	54.3	174.6	31.7	0	0	0	0	108.4	T223 S227	T223-T225 PolarHBondContact O-N 2.67Å; T225-S227 VanDerWaalsContact C-N 3.3Å; T225-S227 PolarHBondContact O-N 2.93Å
226	L	41.4	Very low	54.1	Low	87 Å²	87	76.7 Å²	76.7	46%	0.455	44%	0.436	S	S	.	.			trans	-63.6	98.1	177.4	-72.3	176.8	0	0	0	107.1	E224 A228	E224-L226 HydrophobicContact CB-CD1 4.25Å; E224-L226 HydrophobicContact CB-CD2 4.47Å; E224-L226 HydrophobicContact CB-CG 3.8Å; E224-L226 HydrophobicContact CG-CD1 4.39Å; E224-L226 HydrophobicContact CG-CD2 3.84Å; E224-L226 HydrophobicContact CG-CG 3.73Å; E224-L226 PolarHBondContact O-N 2.81Å; E224-L226 WeakPolarHBondContact OE2-CD1 3.35Å; L226-A228 PolarHBondContact O-N 2.82Å
227	S	36.9	Very low	52.2	Low	109 Å²	109	74.7 Å²	74.7	76%	0.762	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-25.5	111.8	140.5	57.9	0	0	0	0	110.2	T225	T225-S227 VanDerWaalsContact C-N 3.3Å; T225-S227 PolarHBondContact O-N 2.93Å
228	A	39.2	Very low	50.1	Low	109 Å²	109	76.3 Å²	76.3	90%	0.901	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	9.9	165	0	0	0	0	0	120	L226	L226-A228 PolarHBondContact O-N 2.82Å
229	S	38.8	Very low	48.4	Very low	60 Å²	60	73.7 Å²	73.7	42%	0.42	43%	0.431	S	S	.	.			trans	-78.7	138.2	158.8	49.6	0	0	0	0	110
230	S	41.1	Very low	46.6	Very low	40 Å²	40	78.3 Å²	78.3	28%	0.28	45%	0.454	S	S	.	.			trans	-62.9	149.1	-172.2	172.3	0	0	0	0	110.5	L232 D233	S230-L232 PolarHBondContact O-N 3.32Å; S230-L232 PolarHBondContact OG-N 2.72Å; S230-D233 PolarHBondContact N-OD2 2.8Å; S230-D233 PolarHBondContact O-N 3.1Å
231	P	37.5	Very low	44.9	Very low	88 Å²	88	81.1 Å²	81.1	57%	0.571	47%	0.471	S	S	*	.	H	α-helix	trans	-49.7	-26.1	171.4	-25.7	32.6	0	0	0	113.6	A234 I235	P231-A234 PolarHBondContact O-N 2.82Å; P231-I235 WeakPolarHBondContact O-CD1 3.35Å; P231-I235 WeakPolarHBondContact O-CG1 3.1Å; P231-I235 PolarHBondContact O-N 3.32Å
232	L	40	Very low	44.1	Very low	101 Å²	101	79 Å²	79	53%	0.529	46%	0.462	S	S	.	.	H	α-helix	trans	-68.3	-33.3	176	-67.9	176.1	0	0	0	113.7	S230 I235 S236	S230-L232 PolarHBondContact O-N 3.32Å; S230-L232 PolarHBondContact OG-N 2.72Å; L232-I235 HydrophobicContact CD2-CD1 4.1Å; L232-I235 CarbonylContact O-C 3.57Å; L232-I235 WeakPolarHBondContact O-CB 3.45Å; L232-I235 PolarHBondContact O-N 3.01Å; L232-S236 WeakPolarHBondContact O-CB 3.31Å; L232-S236 PolarHBondContact O-N 3.32Å
233	D	42	Very low	43.8	Very low	81 Å²	81	77.6 Å²	77.6	43%	0.433	46%	0.456	S	S	.	.	H	α-helix	trans	-68.7	-41.7	176.5	-62.7	-38.2	0	0	0	110	S230 I235 S236 E237	S230-D233 PolarHBondContact N-OD2 2.8Å; S230-D233 PolarHBondContact O-N 3.1Å; D233-I235 VanDerWaalsContact C-N 3.27Å; D233-I235 PolarHBondContact O-N 2.84Å; D233-S236 WeakPolarHBondContact O-CB 3.35Å; D233-S236 PolarHBondContact O-N 2.75Å; D233-E237 PolarHBondContact O-N 2.91Å
234	A	39.4	Very low	44.2	Very low	54 Å²	54	76.2 Å²	76.2	45%	0.446	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-37.7	172	0	0	0	0	0	111.7	P231 S236 H238	P231-A234 PolarHBondContact O-N 2.82Å; A234-S236 VanDerWaalsContact C-N 3.35Å; A234-H238 PolarHBondContact O-ND1 2.85Å
235	I	39.3	Very low	44.9	Very low	54 Å²	54	73.5 Å²	73.5	28%	0.277	45%	0.445	S	S	.	.	H	α-helix	trans	-67.7	-36.6	173.3	-67.5	159.7	0	0	0	110.9	P231 L232 D233 E237 H238 V241 L242	P231-I235 WeakPolarHBondContact O-CD1 3.35Å; P231-I235 WeakPolarHBondContact O-CG1 3.1Å; P231-I235 PolarHBondContact O-N 3.32Å; L232-I235 HydrophobicContact CD2-CD1 4.1Å; L232-I235 CarbonylContact O-C 3.57Å; L232-I235 WeakPolarHBondContact O-CB 3.45Å; L232-I235 PolarHBondContact O-N 3.01Å; D233-I235 VanDerWaalsContact C-N 3.27Å; D233-I235 PolarHBondContact O-N 2.84Å; I235-E237 VanDerWaalsContact C-N 3.31Å; I235-E237 PolarHBondContact O-N 3.44Å; I235-H238 CarbonylContact O-C 3.47Å; I235-H238 PolarHBondContact O-N 2.93Å; I235-H238 VanDerWaalsContact O-N 3.13Å; I235-V241 HydrophobicContact CG2-CB 4.28Å; I235-V241 HydrophobicContact CG2-CG1 3.72Å; I235-L242 HydrophobicContact CG2-CD2 3.9Å
236	S	46.7	Very low	46.1	Very low	44 Å²	44	67.5 Å²	67.5	31%	0.308	41%	0.407	S	S	.	.	H	α-helix	trans	-64.6	-33.2	-178	-168.3	0	0	0	0	113.3	L232 D233 A234 H238 L242	L232-S236 WeakPolarHBondContact O-CB 3.31Å; L232-S236 PolarHBondContact O-N 3.32Å; D233-S236 WeakPolarHBondContact O-CB 3.35Å; D233-S236 PolarHBondContact O-N 2.75Å; A234-S236 VanDerWaalsContact C-N 3.35Å; S236-H238 VanDerWaalsContact C-N 3.32Å; S236-L242 WeakPolarHBondContact O-CD1 3.47Å
237	E	47.1	Very low	46.8	Very low	119 Å²	119	67.3 Å²	67.3	56%	0.556	41%	0.41	S	S	*	.	H	α-helix	trans	-70.6	-32.6	175.2	-68.5	-171.2	170.5	0	0	112.2	D233 I235 H239	D233-E237 PolarHBondContact O-N 2.91Å; I235-E237 VanDerWaalsContact C-N 3.31Å; I235-E237 PolarHBondContact O-N 3.44Å; E237-H239 PolarHBondContact O-N 2.82Å
238	H	49	Very low	47.7	Very low	82 Å²	82	64.2 Å²	64.2	38%	0.38	38%	0.383	S	S	.	.			trans	-79.6	73.2	171.8	-62.4	82	0	0	0	108.8	E221 A234 I235 S236 M240 V241 L242	E221-H238 IonicContact OE2-NE2 2.61Å; A234-H238 PolarHBondContact O-ND1 2.85Å; I235-H238 CarbonylContact O-C 3.47Å; I235-H238 PolarHBondContact O-N 2.93Å; I235-H238 VanDerWaalsContact O-N 3.13Å; S236-H238 VanDerWaalsContact C-N 3.32Å; H238-M240 PolarHBondContact O-N 3.23Å; H238-V241 HydrophobicContact CB-CB 3.86Å; H238-V241 HydrophobicContact CB-CG2 3.55Å; H238-V241 WeakPolarHBondContact O-CA 3.45Å; H238-V241 WeakPolarHBondContact O-CB 3.25Å; H238-V241 PolarHBondContact O-N 3.41Å; H238-L242 PolarHBondContact O-N 2.8Å
239	H	53.7	Low	48.5	Very low	20 Å²	20	59.6 Å²	59.6	9%	0.093	34%	0.343	C	S	.	.	H	α-helix	trans	-49.1	-32.9	176.2	-172.8	79.4	0	0	0	112.3	S154 E237 V241 L242 Q243	S154-H239 PolarHBondContact N-NE2 2.92Å; E237-H239 PolarHBondContact O-N 2.82Å; H239-V241 PolarHBondContact O-N 2.68Å; H239-L242 PolarHBondContact O-N 2.89Å; H239-Q243 WeakPolarHBondContact O-CB 3.2Å; H239-Q243 WeakPolarHBondContact O-CG 3.44Å; H239-Q243 PolarHBondContact O-N 3.02Å
240	M	51.7	Low	49.6	Very low	109 Å²	109	58.2 Å²	58.2	54%	0.537	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-38.4	172.5	-63.5	178.5	70.7	0	0	113.1	H238 A244	H238-M240 PolarHBondContact O-N 3.23Å; M240-A244 WeakPolarHBondContact O-CB 3.19Å; M240-A244 PolarHBondContact O-N 3.32Å
241	V	50.6	Low	50.5	Low	62 Å²	62	60.2 Å²	60.2	38%	0.376	34%	0.342	S	S	.	.	H	α-helix	trans	-70.6	-44.3	174.2	-179.3	0	0	0	0	110	I235 H238 H239 Q243 A244 V245	I235-V241 HydrophobicContact CG2-CB 4.28Å; I235-V241 HydrophobicContact CG2-CG1 3.72Å; H238-V241 HydrophobicContact CB-CB 3.86Å; H238-V241 HydrophobicContact CB-CG2 3.55Å; H238-V241 WeakPolarHBondContact O-CA 3.45Å; H238-V241 WeakPolarHBondContact O-CB 3.25Å; H238-V241 PolarHBondContact O-N 3.41Å; H239-V241 PolarHBondContact O-N 2.68Å; V241-Q243 VanDerWaalsContact C-N 3.27Å; V241-Q243 PolarHBondContact O-N 3.25Å; V241-A244 PolarHBondContact O-N 3.39Å; V241-V245 HydrophobicContact CG1-CG2 4.35Å; V241-V245 WeakPolarHBondContact O-CB 3.07Å; V241-V245 VanDerWaalsContact O-CG2 3.25Å; V241-V245 WeakPolarHBondContact O-CG2 3.43Å; V241-V245 PolarHBondContact O-N 3.24Å
242	L	52.6	Low	51.3	Low	19 Å²	19	60.8 Å²	60.8	10%	0.099	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-41.5	174	-69.2	-179.9	0	0	0	111.8	I235 S236 H238 H239 V245 L246 L263	I235-L242 HydrophobicContact CG2-CD2 3.9Å; S236-L242 WeakPolarHBondContact O-CD1 3.47Å; H238-L242 PolarHBondContact O-N 2.8Å; H239-L242 PolarHBondContact O-N 2.89Å; L242-V245 PolarHBondContact O-N 2.74Å; L242-L246 WeakPolarHBondContact O-CB 3.42Å; L242-L246 PolarHBondContact O-N 2.85Å; L242-L263 HydrophobicContact CB-CD2 4.07Å; L242-L263 HydrophobicContact CD2-CD2 3.63Å; L242-L263 HydrophobicContact CG-CD2 4.43Å; L242-L263 WeakPolarHBondContact O-CD2 3.22Å
243	Q	53.3	Low	51.9	Low	59 Å²	59	57.8 Å²	57.8	28%	0.276	32%	0.321	S	S	.	.	H	α-helix	trans	-71.8	-36.8	177.5	-73	-61.1	-28.7	0	0	113	H239 V241 V245 L246 T247	H239-Q243 WeakPolarHBondContact O-CB 3.2Å; H239-Q243 WeakPolarHBondContact O-CG 3.44Å; H239-Q243 PolarHBondContact O-N 3.02Å; V241-Q243 VanDerWaalsContact C-N 3.27Å; V241-Q243 PolarHBondContact O-N 3.25Å; Q243-V245 VanDerWaalsContact C-N 3.29Å; Q243-V245 PolarHBondContact O-N 2.76Å; Q243-L246 VanDerWaalsContact NE2-CD1 3.33Å; Q243-L246 WeakPolarHBondContact O-CB 3.37Å; Q243-L246 PolarHBondContact O-N 2.7Å; Q243-T247 WeakPolarHBondContact O-CB 3.46Å; Q243-T247 PolarHBondContact O-N 2.66Å; Q243-T247 PolarHBondContact O-OG1 3.4Å
244	A	53.6	Low	52.8	Low	60 Å²	60	60.3 Å²	60.3	50%	0.496	33%	0.33	S	S	.	.	H	α-helix	trans	-62.3	-39.8	171	0	0	0	0	0	111.1	M240 V241 F248	M240-A244 WeakPolarHBondContact O-CB 3.19Å; M240-A244 PolarHBondContact O-N 3.32Å; V241-A244 PolarHBondContact O-N 3.39Å; A244-F248 VanDerWaalsContact O-CB 3.24Å; A244-F248 WeakPolarHBondContact O-CB 3.08Å; A244-F248 PolarHBondContact O-N 2.97Å
245	V	54.5	Low	53.4	Low	52 Å²	52	66 Å²	66	32%	0.315	35%	0.347	S	S	.	.	H	α-helix	trans	-66.7	-42.3	173.9	172.1	0	0	0	0	111.3	V241 L242 Q243 F248 I249 L263	V241-V245 HydrophobicContact CG1-CG2 4.35Å; V241-V245 WeakPolarHBondContact O-CB 3.07Å; V241-V245 VanDerWaalsContact O-CG2 3.25Å; V241-V245 WeakPolarHBondContact O-CG2 3.43Å; V241-V245 PolarHBondContact O-N 3.24Å; L242-V245 PolarHBondContact O-N 2.74Å; Q243-V245 VanDerWaalsContact C-N 3.29Å; Q243-V245 PolarHBondContact O-N 2.76Å; V245-F248 WeakPolarHBondContact O-CB 3.42Å; V245-F248 PolarHBondContact O-N 2.83Å; V245-I249 HydrophobicContact CG1-CD1 3.67Å; V245-I249 HydrophobicContact CG1-CG1 4.31Å; V245-I249 WeakPolarHBondContact O-CB 3.44Å; V245-I249 VanDerWaalsContact O-CG1 3.27Å; V245-I249 WeakPolarHBondContact O-CG1 3.47Å; V245-I249 PolarHBondContact O-N 2.84Å; V245-L263 HydrophobicContact CB-CD2 4.15Å; V245-L263 HydrophobicContact CG1-CD2 3.86Å
246	L	59.4	Low	54	Low	8 Å²	8	69.1 Å²	69.1	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-59.7	-49	173.7	-88.8	160.8	0	0	0	112	L242 Q243 F248 I249 N250 V260 L263	L242-L246 WeakPolarHBondContact O-CB 3.42Å; L242-L246 PolarHBondContact O-N 2.85Å; Q243-L246 VanDerWaalsContact NE2-CD1 3.33Å; Q243-L246 WeakPolarHBondContact O-CB 3.37Å; Q243-L246 PolarHBondContact O-N 2.7Å; L246-F248 VanDerWaalsContact C-N 3.29Å; L246-F248 PolarHBondContact O-N 3.32Å; L246-I249 PolarHBondContact O-N 3.21Å; L246-N250 WeakPolarHBondContact O-CB 3.4Å; L246-N250 PolarHBondContact O-N 3.42Å; L246-N250 PolarHBondContact O-ND2 3.04Å; L246-V260 HydrophobicContact CD2-CB 3.8Å; L246-V260 HydrophobicContact CD2-CG1 3.39Å; L246-V260 WeakPolarHBondContact CD2-O 3.47Å; L246-L263 HydrophobicContact CD1-CB 3.75Å; L246-L263 HydrophobicContact CD2-CB 3.85Å; L246-L263 HydrophobicContact CD2-CD1 4.2Å; L246-L263 HydrophobicContact CG-CB 3.66Å; L246-L263 HydrophobicContact CG-CD1 4.26Å; L246-L263 HydrophobicContact CG-CD2 4.24Å; L246-L263 HydrophobicContact CG-CG 4.29Å
247	T	57	Low	54.2	Low	84 Å²	84	70.5 Å²	70.5	52%	0.515	39%	0.39	S	S	.	.	H	α-helix	trans	-62.6	-41.2	179.2	-56.1	0	0	0	0	109.9	Q243 T251	Q243-T247 WeakPolarHBondContact O-CB 3.46Å; Q243-T247 PolarHBondContact O-N 2.66Å; Q243-T247 PolarHBondContact O-OG1 3.4Å; T247-T251 WeakPolarHBondContact O-CB 3.34Å; T247-T251 PolarHBondContact O-N 2.78Å; T247-T251 PolarHBondContact O-OG1 2.87Å
248	F	55.7	Low	54.3	Low	43 Å²	43	68.4 Å²	68.4	19%	0.189	38%	0.379	C	S	.	.	H	α-helix	trans	-61.6	-50.7	173.7	175.5	-89.6	0	0	0	112	A244 V245 L246 N250 T251 H252	A244-F248 VanDerWaalsContact O-CB 3.24Å; A244-F248 WeakPolarHBondContact O-CB 3.08Å; A244-F248 PolarHBondContact O-N 2.97Å; V245-F248 WeakPolarHBondContact O-CB 3.42Å; V245-F248 PolarHBondContact O-N 2.83Å; L246-F248 VanDerWaalsContact C-N 3.29Å; L246-F248 PolarHBondContact O-N 3.32Å; F248-N250 VanDerWaalsContact C-N 3.34Å; F248-N250 PolarHBondContact O-N 2.98Å; F248-T251 PolarHBondContact O-N 2.77Å; F248-H252 AromaticContact CD2-CD2 3.23Å; F248-H252 WeakPolarHBondContact CD2-CD2 3.07Å; F248-H252 AromaticContact CD2-NE2 3.58Å; F248-H252 AromaticContact CE2-CD2 3.15Å; F248-H252 WeakPolarHBondContact CE2-CD2 3.23Å; F248-H252 AromaticContact CE2-NE2 3.4Å; F248-H252 WeakPolarHBondContact CE2-NE2 3.25Å; F248-H252 AromaticContact CG-CD2 3.78Å; F248-H252 AromaticContact CZ-CD2 3.65Å; F248-H252 WeakPolarHBondContact O-CB 3.35Å; F248-H252 PolarHBondContact O-CD2 2.84Å; F248-H252 VanDerWaalsContact O-CD2 3.26Å; F248-H252 PolarHBondContact O-N 2.93Å
249	I	54.9	Low	54.5	Low	13 Å²	13	70.6 Å²	70.6	7%	0.067	39%	0.389	C	S	.	.	H	α-helix	trans	-56.1	-51.3	178.3	-78.1	166.4	0	0	0	109.5	V245 L246 H252 L253 F258 V260 L263 F296	V245-I249 HydrophobicContact CG1-CD1 3.67Å; V245-I249 HydrophobicContact CG1-CG1 4.31Å; V245-I249 WeakPolarHBondContact O-CB 3.44Å; V245-I249 VanDerWaalsContact O-CG1 3.27Å; V245-I249 WeakPolarHBondContact O-CG1 3.47Å; V245-I249 PolarHBondContact O-N 2.84Å; L246-I249 PolarHBondContact O-N 3.21Å; I249-H252 PolarHBondContact O-N 3.4Å; I249-L253 HydrophobicContact CB-CD1 4.48Å; I249-L253 HydrophobicContact CG1-CD1 4.49Å; I249-L253 HydrophobicContact CG2-CD1 3.9Å; I249-L253 WeakPolarHBondContact O-CA 3.33Å; I249-L253 WeakPolarHBondContact O-CB 3.45Å; I249-L253 WeakPolarHBondContact O-CG 3.26Å; I249-L253 PolarHBondContact O-N 3.47Å; I249-F258 HydrophobicContact CG2-CD1 4.27Å; I249-V260 HydrophobicContact CG2-CB 4.02Å; I249-V260 HydrophobicContact CG2-CG2 3.46Å; I249-V260 VanDerWaalsContact CG2-CG2 3.46Å; I249-L263 HydrophobicContact CD1-CD1 3.71Å; I249-F296 HydrophobicContact CG1-CE2 4.3Å
250	N	62.9	Low	54.5	Low	31 Å²	31	70 Å²	70	17%	0.166	39%	0.386	C	S	.	.	H	α-helix	trans	-66.8	-42.7	-178.3	-68.6	-21.1	0	0	0	111	L246 F248 H252 E254 V260	L246-N250 WeakPolarHBondContact O-CB 3.4Å; L246-N250 PolarHBondContact O-N 3.42Å; L246-N250 PolarHBondContact O-ND2 3.04Å; F248-N250 VanDerWaalsContact C-N 3.34Å; F248-N250 PolarHBondContact O-N 2.98Å; N250-H252 VanDerWaalsContact C-N 3.34Å; N250-H252 PolarHBondContact O-N 3.49Å; N250-E254 WeakPolarHBondContact O-CB 3.5Å; N250-E254 PolarHBondContact O-N 2.69Å; N250-V260 PolarHBondContact ND2-O 3.29Å; N250-V260 PolarHBondContact OD1-N 2.74Å; N250-V260 PolarHBondContact OD1-O 2.68Å
251	T	60.6	Low	54.9	Low	82 Å²	82	69.6 Å²	69.6	50%	0.503	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-37.5	179.6	-56.1	0	0	0	0	112.7	T247 F248	T247-T251 WeakPolarHBondContact O-CB 3.34Å; T247-T251 PolarHBondContact O-N 2.78Å; T247-T251 PolarHBondContact O-OG1 2.87Å; F248-T251 PolarHBondContact O-N 2.77Å
252	H	53.4	Low	54.9	Low	99 Å²	99	68.8 Å²	68.8	46%	0.458	39%	0.388	S	S	.	.	H	α-helix	trans	-96.5	-30.7	-174.7	-70.8	-67.1	0	0	0	114.2	F248 I249 N250	F248-H252 AromaticContact CD2-CD2 3.23Å; F248-H252 WeakPolarHBondContact CD2-CD2 3.07Å; F248-H252 AromaticContact CD2-NE2 3.58Å; F248-H252 AromaticContact CE2-CD2 3.15Å; F248-H252 WeakPolarHBondContact CE2-CD2 3.23Å; F248-H252 AromaticContact CE2-NE2 3.4Å; F248-H252 WeakPolarHBondContact CE2-NE2 3.25Å; F248-H252 AromaticContact CG-CD2 3.78Å; F248-H252 AromaticContact CZ-CD2 3.65Å; F248-H252 WeakPolarHBondContact O-CB 3.35Å; F248-H252 PolarHBondContact O-CD2 2.84Å; F248-H252 VanDerWaalsContact O-CD2 3.26Å; F248-H252 PolarHBondContact O-N 2.93Å; I249-H252 PolarHBondContact O-N 3.4Å; N250-H252 VanDerWaalsContact C-N 3.34Å; N250-H252 PolarHBondContact O-N 3.49Å
253	L	52.2	Low	54.7	Low	39 Å²	39	68.3 Å²	68.3	20%	0.204	39%	0.386	C	S	.	.	H	α-helix	trans	-97.7	-10.2	-177.8	-57.2	179	0	0	0	113.6	I249 Q255 V256 G257 F258 F296	I249-L253 HydrophobicContact CB-CD1 4.48Å; I249-L253 HydrophobicContact CG1-CD1 4.49Å; I249-L253 HydrophobicContact CG2-CD1 3.9Å; I249-L253 WeakPolarHBondContact O-CA 3.33Å; I249-L253 WeakPolarHBondContact O-CB 3.45Å; I249-L253 WeakPolarHBondContact O-CG 3.26Å; I249-L253 PolarHBondContact O-N 3.47Å; L253-Q255 PolarHBondContact O-N 3.04Å; L253-V256 HydrophobicContact CD2-CG2 4.48Å; L253-V256 CarbonylContact O-C 3.53Å; L253-V256 WeakPolarHBondContact O-CA 3.22Å; L253-V256 PolarHBondContact O-N 2.76Å; L253-G257 PolarHBondContact O-N 3.45Å; L253-F258 CarbonylContact C-O 3.48Å; L253-F258 HydrophobicContact CB-CB 3.8Å; L253-F258 HydrophobicContact CB-CD1 4.4Å; L253-F258 HydrophobicContact CD1-CD1 3.99Å; L253-F258 PolarHBondContact O-N 3.27Å; L253-F296 HydrophobicContact CD1-CD2 3.91Å; L253-F296 HydrophobicContact CD1-CE2 3.9Å; L253-F296 HydrophobicContact CD2-CD2 4.24Å; L253-F296 HydrophobicContact CG-CD2 4.49Å
254	E	60.9	Low	54.5	Low	133 Å²	133	68.1 Å²	68.1	62%	0.621	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-58.6	-31.5	168.5	179.7	171.1	-140.4	0	0	111.1	N250 V256 G257 F258	N250-E254 WeakPolarHBondContact O-CB 3.5Å; N250-E254 PolarHBondContact O-N 2.69Å; E254-V256 PolarHBondContact O-N 2.85Å; E254-V256 VanDerWaalsContact O-N 3.16Å; E254-G257 PolarHBondContact O-N 2.9Å; E254-F258 PolarHBondContact N-O 3.35Å
255	Q	53.1	Low	54.2	Low	174 Å²	174	71.3 Å²	71.3	81%	0.813	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-62.4	-20.8	172.8	-60.9	-174	11.4	0	0	113.7	L253	L253-Q255 PolarHBondContact O-N 3.04Å
256	V	51.1	Low	53.8	Low	120 Å²	120	72.2 Å²	72.2	73%	0.727	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-105	3.6	178.7	-159.2	0	0	0	0	110.9	L253 E254	L253-V256 HydrophobicContact CD2-CG2 4.48Å; L253-V256 CarbonylContact O-C 3.53Å; L253-V256 WeakPolarHBondContact O-CA 3.22Å; L253-V256 PolarHBondContact O-N 2.76Å; E254-V256 PolarHBondContact O-N 2.85Å; E254-V256 VanDerWaalsContact O-N 3.16Å
257	G	51.8	Low	53.1	Low	73 Å²	73	75.1 Å²	75.1	75%	0.753	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	20.3	-179	0	0	0	0	0	114.5	L253 E254	L253-G257 PolarHBondContact O-N 3.45Å; E254-G257 PolarHBondContact O-N 2.9Å
258	F	47.9	Very low	52.1	Low	74 Å²	74	75 Å²	75	33%	0.325	41%	0.41	S	S	.	.			trans	-103	131.5	177.7	-157.8	-107.3	0	0	0	110.9	I249 L253 E254 V260 L290	I249-F258 HydrophobicContact CG2-CD1 4.27Å; L253-F258 CarbonylContact C-O 3.48Å; L253-F258 HydrophobicContact CB-CB 3.8Å; L253-F258 HydrophobicContact CB-CD1 4.4Å; L253-F258 HydrophobicContact CD1-CD1 3.99Å; L253-F258 PolarHBondContact O-N 3.27Å; E254-F258 PolarHBondContact N-O 3.35Å; F258-V260 HydrophobicContact CD1-CG2 3.72Å; F258-V260 HydrophobicContact CE1-CG2 3.21Å; F258-V260 HydrophobicContact CZ-CG2 4.1Å; F258-L290 HydrophobicContact CE1-CD2 4.41Å; F258-L290 HydrophobicContact CE2-CD2 3.77Å; F258-L290 HydrophobicContact CZ-CD1 3.93Å; F258-L290 HydrophobicContact CZ-CD2 3.72Å; F258-L290 HydrophobicContact CZ-CG 4.32Å
259	H	54.5	Low	50.9	Low	129 Å²	129	79.3 Å²	79.3	60%	0.597	44%	0.435	S	S	*	.			trans	-135.3	123.7	176.9	-167.6	85.3	0	0	0	109.3
260	V	53.3	Low	49.9	Very low	6 Å²	6	83 Å²	83	4%	0.036	46%	0.458	C	S	.	.			trans	-108.3	118.2	177.7	-176.6	0	0	0	0	107.8	L246 I249 N250 F258 L263 D266	L246-V260 HydrophobicContact CD2-CB 3.8Å; L246-V260 HydrophobicContact CD2-CG1 3.39Å; L246-V260 WeakPolarHBondContact CD2-O 3.47Å; I249-V260 HydrophobicContact CG2-CB 4.02Å; I249-V260 HydrophobicContact CG2-CG2 3.46Å; I249-V260 VanDerWaalsContact CG2-CG2 3.46Å; N250-V260 PolarHBondContact ND2-O 3.29Å; N250-V260 PolarHBondContact OD1-N 2.74Å; N250-V260 PolarHBondContact OD1-O 2.68Å; F258-V260 HydrophobicContact CD1-CG2 3.72Å; F258-V260 HydrophobicContact CE1-CG2 3.21Å; F258-V260 HydrophobicContact CZ-CG2 4.1Å; V260-L263 HydrophobicContact CG1-CD1 4.07Å; V260-D266 HydrophobicContact CG1-CB 3.95Å; V260-D266 VanDerWaalsContact CG1-OD2 3.29Å; V260-D266 WeakPolarHBondContact CG1-OD2 3.32Å
261	S	59	Low	48.5	Very low	101 Å²	101	89.8 Å²	89.8	71%	0.706	48%	0.482	S	S	*	.	S	Bend	trans	-92.9	-30.3	179.9	55	0	0	0	0	112
262	D	50.3	Low	47.2	Very low	45 Å²	45	91.5 Å²	91.5	24%	0.241	49%	0.489	C	S	.	.			trans	-146.2	97.8	-178.3	-170.3	-14.6	0	0	0	110.2	S264 K265 D266	D262-S264 PolarHBondContact O-N 2.94Å; D262-S264 VanDerWaalsContact O-N 3.15Å; D262-S264 VanDerWaalsContact OD1-CB 3.3Å; D262-S264 WeakPolarHBondContact OD1-CB 3.13Å; D262-S264 PolarHBondContact OD1-N 3.47Å; D262-S264 VanDerWaalsContact OD1-N 3.13Å; D262-S264 PolarHBondContact OD1-OG 3.16Å; D262-K265 HydrophobicContact CB-CB 4.2Å; D262-K265 HydrophobicContact CB-CD 4.32Å; D262-K265 HydrophobicContact CB-CG 4.31Å; D262-K265 PolarHBondContact O-N 2.85Å; D262-K265 PolarHBondContact OD1-N 3.33Å; D262-K265 WeakPolarHBondContact OD2-CD 3.41Å; D262-K265 WeakPolarHBondContact OD2-CE 3.43Å; D262-K265 WeakPolarHBondContact OD2-CG 3.29Å; D262-K265 IonicContact OD2-NZ 3.82Å; D262-K265 PolarHBondContact OD2-NZ 2.85Å; D262-D266 WeakPolarHBondContact O-CB 3.5Å; D262-D266 PolarHBondContact O-N 3.04Å
263	L	49.6	Very low	46.1	Very low	10 Å²	10	91 Å²	91	5%	0.052	49%	0.489	C	S	.	.	H	α-helix	trans	-57.3	-32.8	180	-155.9	67	0	0	0	111.9	L242 V245 L246 I249 V260 K265 V267	L242-L263 HydrophobicContact CB-CD2 4.07Å; L242-L263 HydrophobicContact CD2-CD2 3.63Å; L242-L263 HydrophobicContact CG-CD2 4.43Å; L242-L263 WeakPolarHBondContact O-CD2 3.22Å; V245-L263 HydrophobicContact CB-CD2 4.15Å; V245-L263 HydrophobicContact CG1-CD2 3.86Å; L246-L263 HydrophobicContact CD1-CB 3.75Å; L246-L263 HydrophobicContact CD2-CB 3.85Å; L246-L263 HydrophobicContact CD2-CD1 4.2Å; L246-L263 HydrophobicContact CG-CB 3.66Å; L246-L263 HydrophobicContact CG-CD1 4.26Å; L246-L263 HydrophobicContact CG-CD2 4.24Å; L246-L263 HydrophobicContact CG-CG 4.29Å; I249-L263 HydrophobicContact CD1-CD1 3.71Å; V260-L263 HydrophobicContact CG1-CD1 4.07Å; L263-K265 VanDerWaalsContact C-N 3.26Å; L263-K265 PolarHBondContact O-N 3.41Å; L263-V267 HydrophobicContact CD1-CB 4.46Å; L263-V267 HydrophobicContact CD1-CG2 3.38Å; L263-V267 HydrophobicContact CG-CB 4.37Å; L263-V267 HydrophobicContact CG-CG2 3.77Å; L263-V267 VanDerWaalsContact O-CB 3.28Å; L263-V267 WeakPolarHBondContact O-CB 3.18Å; L263-V267 PolarHBondContact O-N 2.92Å
264	S	48.1	Very low	45.1	Very low	55 Å²	55	94.1 Å²	94.1	39%	0.385	51%	0.512	S	S	.	.	H	α-helix	trans	-68.9	-27.3	-179.5	-44.5	0	0	0	0	111.6	D262 L268	D262-S264 PolarHBondContact O-N 2.94Å; D262-S264 VanDerWaalsContact O-N 3.15Å; D262-S264 VanDerWaalsContact OD1-CB 3.3Å; D262-S264 WeakPolarHBondContact OD1-CB 3.13Å; D262-S264 PolarHBondContact OD1-N 3.47Å; D262-S264 VanDerWaalsContact OD1-N 3.13Å; D262-S264 PolarHBondContact OD1-OG 3.16Å; S264-L268 WeakPolarHBondContact O-CB 3.3Å
265	K	48.2	Very low	43.6	Very low	127 Å²	127	96.1 Å²	96.1	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-88.9	-47.4	172.9	-69.3	-177.9	-173.3	118.8	0	111	D262 L263 L269	D262-K265 HydrophobicContact CB-CB 4.2Å; D262-K265 HydrophobicContact CB-CD 4.32Å; D262-K265 HydrophobicContact CB-CG 4.31Å; D262-K265 PolarHBondContact O-N 2.85Å; D262-K265 PolarHBondContact OD1-N 3.33Å; D262-K265 WeakPolarHBondContact OD2-CD 3.41Å; D262-K265 WeakPolarHBondContact OD2-CE 3.43Å; D262-K265 WeakPolarHBondContact OD2-CG 3.29Å; D262-K265 IonicContact OD2-NZ 3.82Å; D262-K265 PolarHBondContact OD2-NZ 2.85Å; L263-K265 VanDerWaalsContact C-N 3.26Å; L263-K265 PolarHBondContact O-N 3.41Å; K265-L269 VanDerWaalsContact O-CB 3.29Å; K265-L269 WeakPolarHBondContact O-CB 3.45Å; K265-L269 WeakPolarHBondContact O-CD1 3.39Å; K265-L269 WeakPolarHBondContact O-CG 3.49Å; K265-L269 PolarHBondContact O-N 3.02Å
266	D	46.3	Very low	42.5	Very low	71 Å²	71	90.6 Å²	90.6	38%	0.38	50%	0.502	S	S	.	.	H	α-helix	trans	-74.3	-34.3	-169.2	-66.1	-25.9	0	0	0	112.6	V260 D262	V260-D266 HydrophobicContact CG1-CB 3.95Å; V260-D266 VanDerWaalsContact CG1-OD2 3.29Å; V260-D266 WeakPolarHBondContact CG1-OD2 3.32Å; D262-D266 WeakPolarHBondContact O-CB 3.5Å; D262-D266 PolarHBondContact O-N 3.04Å
267	V	43.4	Very low	41.4	Very low	69 Å²	69	94.2 Å²	94.2	42%	0.418	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-42.3	178.1	-179.7	0	0	0	0	111.4	L263 L269 T270	L263-V267 HydrophobicContact CD1-CB 4.46Å; L263-V267 HydrophobicContact CD1-CG2 3.38Å; L263-V267 HydrophobicContact CG-CB 4.37Å; L263-V267 HydrophobicContact CG-CG2 3.77Å; L263-V267 VanDerWaalsContact O-CB 3.28Å; L263-V267 WeakPolarHBondContact O-CB 3.18Å; L263-V267 PolarHBondContact O-N 2.92Å; V267-L269 PolarHBondContact O-N 3.28Å; V267-T270 PolarHBondContact O-N 2.93Å; V267-T270 PolarHBondContact O-OG1 2.89Å
268	L	36.1	Very low	40	Very low	80 Å²	80	99 Å²	99	42%	0.419	51%	0.505	S	S	.	.	H	α-helix	trans	-71.4	-30.7	-171.9	-139.6	109.9	0	0	0	113	S264 T270 Y271	S264-L268 WeakPolarHBondContact O-CB 3.3Å; L268-T270 PolarHBondContact O-N 3.46Å; L268-Y271 PolarHBondContact O-N 2.95Å
269	L	31.3	Very low	38.8	Very low	134 Å²	134	99.9 Å²	99.9	70%	0.702	52%	0.518	S	S	*	.	H	α-helix	trans	-65.2	-26.7	174.5	-74.5	173.5	0	0	0	112.7	K265 V267	K265-L269 VanDerWaalsContact O-CB 3.29Å; K265-L269 WeakPolarHBondContact O-CB 3.45Å; K265-L269 WeakPolarHBondContact O-CD1 3.39Å; K265-L269 WeakPolarHBondContact O-CG 3.49Å; K265-L269 PolarHBondContact O-N 3.02Å; V267-L269 PolarHBondContact O-N 3.28Å
270	T	33.3	Very low	37.4	Very low	90 Å²	90	99.6 Å²	99.6	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-73.3	-32.1	-180	66.6	0	0	0	0	112.7	V267 L268	V267-T270 PolarHBondContact O-N 2.93Å; V267-T270 PolarHBondContact O-OG1 2.89Å; L268-T270 PolarHBondContact O-N 3.46Å
271	Y	33.3	Very low	35.9	Very low	174 Å²	174	105 Å²	105	68%	0.682	56%	0.563	S	S	*	*	H	α-helix	trans	-80.4	-41.7	-177.2	-170.3	-102.1	0	0	0	112.9	L268 N273	L268-Y271 PolarHBondContact O-N 2.95Å; Y271-N273 PolarHBondContact O-N 3.25Å
272	N	33.3	Very low	34.1	Very low	119 Å²	119	102.9 Å²	102.9	64%	0.636	56%	0.557	S	S	*	*	S	Bend	trans	-78.6	-1.5	-173.4	-75.1	-37.3	0	0	0	114.2
273	N	31.3	Very low	32.8	Very low	88 Å²	88	109.3 Å²	109.3	47%	0.471	59%	0.586	S	S	.	*			trans	-150.7	71.9	176.8	-150.4	-27.2	0	0	0	114.7	Y271 K275 A276	Y271-N273 PolarHBondContact O-N 3.25Å; N273-K275 PolarHBondContact O-N 2.64Å; N273-A276 HydrophobicContact CB-CB 3.99Å; N273-A276 WeakPolarHBondContact ND2-CB 3.48Å; N273-A276 PolarHBondContact O-N 2.92Å; N273-A276 VanDerWaalsContact OD1-CB 3.32Å; N273-A276 WeakPolarHBondContact OD1-CB 3.45Å; N273-A276 PolarHBondContact OD1-N 3.49Å
274	P	30.6	Very low	31.5	Very low	105 Å²	105	114.4 Å²	114.4	68%	0.682	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-8	177.5	24.7	-32.4	0	0	0	114
275	K	30.7	Very low	30.4	Very low	174 Å²	174	118.2 Å²	118.2	76%	0.757	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	-7.7	-179	-73.6	-173.4	176.7	-179.7	0	114.9	N273 Y277	N273-K275 PolarHBondContact O-N 2.64Å; K275-Y277 VanDerWaalsContact C-N 3.26Å; K275-Y277 PolarHBondContact O-N 2.92Å
276	A	28.6	Very low	29.2	Very low	58 Å²	58	120.3 Å²	120.3	48%	0.479	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	-10.4	-175.9	0	0	0	0	0	115.1	N273	N273-A276 HydrophobicContact CB-CB 3.99Å; N273-A276 WeakPolarHBondContact ND2-CB 3.48Å; N273-A276 PolarHBondContact O-N 2.92Å; N273-A276 VanDerWaalsContact OD1-CB 3.32Å; N273-A276 WeakPolarHBondContact OD1-CB 3.45Å; N273-A276 PolarHBondContact OD1-N 3.49Å
277	Y	28.3	Very low	28.2	Very low	197 Å²	197	122.8 Å²	122.8	77%	0.773	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	59.6	175.6	-78.4	-86.4	0	0	0	111.8	K275	K275-Y277 VanDerWaalsContact C-N 3.26Å; K275-Y277 PolarHBondContact O-N 2.92Å
278	F	22.9	Very low	27.4	Very low	173 Å²	173	123.3 Å²	123.3	76%	0.759	70%	0.699	S	S	*	*			trans	-122.1	66	158.7	-75.5	-84.9	0	0	0	110.6	S280	F278-S280 PolarHBondContact O-N 2.97Å
279	P	22.2	Very low	27	Very low	92 Å²	92	126.8 Å²	126.8	60%	0.597	72%	0.717	S	S	*	*			trans	-76.5	111.8	165.2	30.3	-26.4	0	0	0	108	V281	P279-V281 HydrophobicContact CB-CG2 4.24Å; P279-V281 PolarHBondContact O-N 2.97Å
280	S	24.4	Very low	27.1	Very low	123 Å²	123	125.5 Å²	125.5	86%	0.86	71%	0.71	S	S	*	*			trans	-65.3	76	166.1	49.4	0	0	0	0	110	F278	F278-S280 PolarHBondContact O-N 2.97Å
281	V	22.9	Very low	27.3	Very low	119 Å²	119	125.9 Å²	125.9	72%	0.721	71%	0.709	S	S	*	*			trans	-148	106.9	178.4	-165.9	0	0	0	0	105.5	P279	P279-V281 HydrophobicContact CB-CG2 4.24Å; P279-V281 PolarHBondContact O-N 2.97Å
282	G	21.1	Very low	27.7	Very low	57 Å²	57	120.7 Å²	120.7	59%	0.588	70%	0.695	S	S	*	*				76.1	68.7	69.6	0	0	0	0	0	109.5
283	H	23.1	Very low	28.1	Very low	181 Å²	181	118.7 Å²	118.7	84%	0.838	68%	0.684	S	S	*	*	S	Bend	trans	59.6	124.8	166.7	-62.7	71.7	0	0	0	116.9
284	S	23	Very low	28.6	Very low	117 Å²	117	115.4 Å²	115.4	82%	0.818	67%	0.669	S	S	*	*			trans	68.7	60.6	156.3	65.3	0	0	0	0	119
285	V	24.1	Very low	29.2	Very low	134 Å²	134	119.3 Å²	119.3	81%	0.812	67%	0.67	S	S	*	*			trans	-145.8	125.5	143.5	-173.4	0	0	0	0	108	P287	V285-P287 WeakPolarHBondContact O-CD 3.3Å
286	L	22.4	Very low	30	Very low	172 Å²	172	113.6 Å²	113.6	90%	0.901	65%	0.646	S	S	*	*			trans	-50.9	115.8	174	-81.1	127.3	0	0	0	110.4	G288	L286-G288 PolarHBondContact O-N 3.12Å
287	P	25	Very low	31	Very low	122 Å²	122	111.3 Å²	111.3	79%	0.792	63%	0.626	S	S	*	*			trans	-79.3	117.7	-176.2	-5.1	21.7	0	0	0	110.6	V285 L289	V285-P287 WeakPolarHBondContact O-CD 3.3Å; P287-L289 PolarHBondContact O-N 3.34Å
288	G	28.2	Very low	31.8	Very low	81 Å²	81	107.8 Å²	107.8	84%	0.835	62%	0.615	S	S	*	*			trans	-74.9	61.2	174.5	0	0	0	0	0	114.1	L286	L286-G288 PolarHBondContact O-N 3.12Å
289	L	27.6	Very low	33.1	Very low	152 Å²	152	102.7 Å²	102.7	80%	0.796	60%	0.601	S	S	*	*			trans	-95.7	115.3	154.6	-152.7	74.6	0	0	0	105.4	P287 D291	P287-L289 PolarHBondContact O-N 3.34Å; L289-D291 PolarHBondContact O-N 3.25Å
290	L	33.6	Very low	34.6	Very low	108 Å²	108	100.6 Å²	100.6	57%	0.565	58%	0.584	S	S	*	*			trans	-60.7	89	167.4	-82.4	157.2	0	0	0	106.5	F258 V292	F258-L290 HydrophobicContact CE1-CD2 4.41Å; F258-L290 HydrophobicContact CE2-CD2 3.77Å; F258-L290 HydrophobicContact CZ-CD1 3.93Å; F258-L290 HydrophobicContact CZ-CD2 3.72Å; F258-L290 HydrophobicContact CZ-CG 4.32Å; L290-V292 HydrophobicContact CB-CG2 4.29Å; L290-V292 WeakPolarHBondContact O-CG2 2.95Å; L290-V292 PolarHBondContact O-N 3.39Å
291	D	36.6	Very low	35.8	Very low	98 Å²	98	95.6 Å²	95.6	52%	0.524	55%	0.548	S	S	.	.			trans	-55	92.4	151.2	-165.3	21.4	0	0	0	103.5	L289 D293	L289-D291 PolarHBondContact O-N 3.25Å; D291-D293 PolarHBondContact O-N 3.01Å
292	V	41	Very low	37.2	Very low	65 Å²	65	98.7 Å²	98.7	39%	0.394	55%	0.547	S	S	.	.			trans	-68.7	88.1	178	-177.1	0	0	0	0	103.8	L290 A294 F296	L290-V292 HydrophobicContact CB-CG2 4.29Å; L290-V292 WeakPolarHBondContact O-CG2 2.95Å; L290-V292 PolarHBondContact O-N 3.39Å; V292-A294 PolarHBondContact O-N 3.31Å; V292-F296 HydrophobicContact CG1-CB 3.77Å; V292-F296 HydrophobicContact CG1-CD1 3.14Å; V292-F296 HydrophobicContact CG1-CE1 3.92Å; V292-F296 HydrophobicContact CG1-CG 3.7Å
293	D	42.9	Very low	38.6	Very low	77 Å²	77	102 Å²	102	41%	0.412	54%	0.542	S	S	.	.			trans	-42.4	137.4	-175.2	-176.2	-18.5	0	0	0	107.6	D291 R295 F296 C297	D291-D293 PolarHBondContact O-N 3.01Å; D293-R295 HydrophobicContact CB-CB 4.36Å; D293-R295 CarbonylContact O-C 3.57Å; D293-R295 PolarHBondContact O-N 3.27Å; D293-R295 WeakPolarHBondContact OD1-CG 3.34Å; D293-R295 PolarHBondContact OD1-N 3.28Å; D293-R295 VanDerWaalsContact OD2-CD 3.29Å; D293-R295 WeakPolarHBondContact OD2-CD 3.39Å; D293-R295 IonicContact OD2-NE 3.69Å; D293-F296 WeakPolarHBondContact O-CA 3.42Å; D293-F296 WeakPolarHBondContact O-CB 3.19Å; D293-F296 PolarHBondContact O-N 3.46Å; D293-C297 PolarHBondContact O-N 3.16Å
294	A	41.3	Very low	39.8	Very low	18 Å²	18	95 Å²	95	15%	0.149	51%	0.51	C	S	.	.	H	α-helix	trans	-41.7	-37.1	172.6	0	0	0	0	0	110.6	V292 F296 C297 F298 Y326	V292-A294 PolarHBondContact O-N 3.31Å; A294-F296 PolarHBondContact O-N 2.83Å; A294-C297 PolarHBondContact O-N 2.94Å; A294-F298 HydrophobicContact CB-CD2 4.13Å; A294-F298 HydrophobicContact CB-CE2 4.18Å; A294-F298 WeakPolarHBondContact O-CB 3.41Å; A294-F298 WeakPolarHBondContact O-CD2 3.41Å; A294-F298 PolarHBondContact O-N 2.91Å; A294-Y326 HydrophobicContact CB-CD2 4.02Å; A294-Y326 HydrophobicContact CB-CE2 3.54Å
295	R	43.2	Very low	41.1	Very low	188 Å²	188	94.3 Å²	94.3	71%	0.709	49%	0.494	S	S	*	.	H	α-helix	trans	-55.7	-42.4	174.6	-62.6	179.9	-169	-152.8	-0.3	114.6	D293 S299	D293-R295 HydrophobicContact CB-CB 4.36Å; D293-R295 CarbonylContact O-C 3.57Å; D293-R295 PolarHBondContact O-N 3.27Å; D293-R295 WeakPolarHBondContact OD1-CG 3.34Å; D293-R295 PolarHBondContact OD1-N 3.28Å; D293-R295 VanDerWaalsContact OD2-CD 3.29Å; D293-R295 WeakPolarHBondContact OD2-CD 3.39Å; D293-R295 IonicContact OD2-NE 3.69Å; R295-S299 VanDerWaalsContact O-CB 3.3Å; R295-S299 WeakPolarHBondContact O-CB 3.33Å; R295-S299 PolarHBondContact O-N 2.71Å; R295-S299 PolarHBondContact O-OG 2.96Å
296	F	48.6	Very low	42.2	Very low	54 Å²	54	96.2 Å²	96.2	24%	0.237	49%	0.491	C	S	.	.	H	α-helix	trans	-66.3	-49.9	175.3	178.8	-88.3	0	0	0	110.6	I249 L253 V292 D293 A294 F298 S299 L300	I249-F296 HydrophobicContact CG1-CE2 4.3Å; L253-F296 HydrophobicContact CD1-CD2 3.91Å; L253-F296 HydrophobicContact CD1-CE2 3.9Å; L253-F296 HydrophobicContact CD2-CD2 4.24Å; L253-F296 HydrophobicContact CG-CD2 4.49Å; V292-F296 HydrophobicContact CG1-CB 3.77Å; V292-F296 HydrophobicContact CG1-CD1 3.14Å; V292-F296 HydrophobicContact CG1-CE1 3.92Å; V292-F296 HydrophobicContact CG1-CG 3.7Å; D293-F296 WeakPolarHBondContact O-CA 3.42Å; D293-F296 WeakPolarHBondContact O-CB 3.19Å; D293-F296 PolarHBondContact O-N 3.46Å; A294-F296 PolarHBondContact O-N 2.83Å; F296-F298 VanDerWaalsContact C-N 3.3Å; F296-F298 PolarHBondContact O-N 3.2Å; F296-S299 PolarHBondContact O-N 2.95Å; F296-S299 VanDerWaalsContact O-N 3.16Å; F296-L300 HydrophobicContact CE1-CD2 4.02Å; F296-L300 WeakPolarHBondContact O-CB 3.48Å; F296-L300 PolarHBondContact O-N 2.88Å
297	C	47.6	Very low	43.3	Very low	10 Å²	10	91.7 Å²	91.7	7%	0.068	47%	0.471	C	S	.	.	H	α-helix	trans	-57.8	-43.8	178.1	-69.8	0	0	0	0	111.4	D293 A294 L301 I314 L328	D293-C297 PolarHBondContact O-N 3.16Å; A294-C297 PolarHBondContact O-N 2.94Å; C297-L301 VanDerWaalsContact O-CB 3.28Å; C297-L301 WeakPolarHBondContact O-CB 3.4Å; C297-L301 PolarHBondContact O-N 3.03Å; C297-I314 HydrophobicContact CB-CD1 3.97Å; C297-L328 HydrophobicContact CB-CD1 4.2Å
298	F	47.1	Very low	44.2	Very low	122 Å²	122	92.4 Å²	92.4	54%	0.535	46%	0.461	S	S	.	.	H	α-helix	trans	-65	-41.8	176.5	-84.8	-66.9	0	0	0	112.5	A294 F296 R302 I314	A294-F298 HydrophobicContact CB-CD2 4.13Å; A294-F298 HydrophobicContact CB-CE2 4.18Å; A294-F298 WeakPolarHBondContact O-CB 3.41Å; A294-F298 WeakPolarHBondContact O-CD2 3.41Å; A294-F298 PolarHBondContact O-N 2.91Å; F296-F298 VanDerWaalsContact C-N 3.3Å; F296-F298 PolarHBondContact O-N 3.2Å; F298-R302 VanDerWaalsContact O-CB 3.25Å; F298-R302 WeakPolarHBondContact O-CB 3.31Å; F298-R302 PolarHBondContact O-N 3.22Å; F298-I314 HydrophobicContact CD1-CD1 3.9Å; F298-I314 HydrophobicContact CE1-CD1 4.08Å; F298-I314 HydrophobicContact CG-CD1 4.15Å; F298-I314 HydrophobicContact CZ-CD1 4.47Å
299	S	49.7	Very low	45.1	Very low	67 Å²	67	94.7 Å²	94.7	47%	0.469	46%	0.462	S	S	.	.	H	α-helix	trans	-66.2	-43.2	179	-60.3	0	0	0	0	111.5	R295 F296 W303	R295-S299 VanDerWaalsContact O-CB 3.3Å; R295-S299 WeakPolarHBondContact O-CB 3.33Å; R295-S299 PolarHBondContact O-N 2.71Å; R295-S299 PolarHBondContact O-OG 2.96Å; F296-S299 PolarHBondContact O-N 2.95Å; F296-S299 VanDerWaalsContact O-N 3.16Å; S299-W303 PolarHBondContact O-N 3.41Å; S299-W303 VanDerWaalsContact O-N 3.11Å
300	L	53.2	Low	45.9	Very low	47 Å²	47	92 Å²	92	25%	0.246	45%	0.446	C	S	.	.	H	α-helix	trans	-64.5	-44.9	176	-172.3	67.2	0	0	0	111.5	F296 R302 W303 L304	F296-L300 HydrophobicContact CE1-CD2 4.02Å; F296-L300 WeakPolarHBondContact O-CB 3.48Å; F296-L300 PolarHBondContact O-N 2.88Å; L300-R302 PolarHBondContact O-N 3.03Å; L300-W303 PolarHBondContact O-N 2.94Å; L300-L304 HydrophobicContact CG-CD1 4.31Å; L300-L304 WeakPolarHBondContact O-CG 3.41Å; L300-L304 PolarHBondContact O-N 2.95Å
301	L	49.6	Very low	46.7	Very low	19 Å²	19	93.7 Å²	93.7	10%	0.099	46%	0.456	C	S	.	.	H	α-helix	trans	-62.2	-44.7	177.8	-159.3	96.3	0	0	0	111.9	C297 W303 L304 Q305 A312 I314 L328	C297-L301 VanDerWaalsContact O-CB 3.28Å; C297-L301 WeakPolarHBondContact O-CB 3.4Å; C297-L301 PolarHBondContact O-N 3.03Å; L301-W303 PolarHBondContact O-N 3.1Å; L301-L304 PolarHBondContact O-N 3.41Å; L301-Q305 WeakPolarHBondContact O-CG 3.18Å; L301-Q305 PolarHBondContact O-N 3.48Å; L301-A312 HydrophobicContact CD1-CB 3.65Å; L301-A312 HydrophobicContact CG-CB 4.35Å; L301-I314 HydrophobicContact CB-CD1 4.1Å; L301-I314 HydrophobicContact CB-CG1 4.42Å; L301-I314 HydrophobicContact CD1-CD1 4.29Å; L301-I314 HydrophobicContact CD1-CG1 3.69Å; L301-I314 HydrophobicContact CD2-CD1 4.12Å; L301-I314 HydrophobicContact CD2-CG1 4.03Å; L301-I314 HydrophobicContact CG-CD1 4.4Å; L301-I314 HydrophobicContact CG-CG1 4.26Å; L301-L328 HydrophobicContact CB-CD1 4.28Å; L301-L328 HydrophobicContact CD1-CD1 3.69Å; L301-L328 HydrophobicContact CD1-CD2 4.13Å; L301-L328 HydrophobicContact CD1-CG 3.8Å
302	R	52.1	Low	47.3	Very low	183 Å²	183	89.1 Å²	89.1	69%	0.691	43%	0.432	S	S	*	.	H	α-helix	trans	-65.5	-30.2	-180	-160	178.5	-162.8	173	5.2	111.9	F298 L300 K306	F298-R302 VanDerWaalsContact O-CB 3.25Å; F298-R302 WeakPolarHBondContact O-CB 3.31Å; F298-R302 PolarHBondContact O-N 3.22Å; L300-R302 PolarHBondContact O-N 3.03Å; R302-K306 WeakPolarHBondContact O-CG 3.37Å; R302-K306 PolarHBondContact O-N 3.37Å
303	W	51.4	Low	47.6	Very low	128 Å²	128	92.3 Å²	92.3	49%	0.485	44%	0.442	S	S	.	.	H	α-helix	trans	-73.5	-47.4	172.6	179.8	86.3	0	0	0	111.8	S299 L300 L301 Q305 K306 T307	S299-W303 PolarHBondContact O-N 3.41Å; S299-W303 VanDerWaalsContact O-N 3.11Å; L300-W303 PolarHBondContact O-N 2.94Å; L301-W303 PolarHBondContact O-N 3.1Å; W303-Q305 VanDerWaalsContact C-N 3.31Å; W303-Q305 PolarHBondContact O-N 3.1Å; W303-K306 WeakPolarHBondContact O-CA 3.47Å; W303-K306 WeakPolarHBondContact O-CB 3.4Å; W303-K306 PolarHBondContact O-N 3.13Å; W303-T307 HydrophobicContact CD2-CG2 3.97Å; W303-T307 VanDerWaalsContact CE2-CG2 3.44Å; W303-T307 HydrophobicContact CG-CG2 4.4Å; W303-T307 HydrophobicContact CH2-CG2 4.31Å; W303-T307 HydrophobicContact CZ2-CG2 3.65Å; W303-T307 PolarHBondContact O-N 3.48Å; W303-T307 PolarHBondContact O-OG1 3.48Å
304	L	46.8	Very low	47.8	Very low	34 Å²	34	90.6 Å²	90.6	18%	0.178	43%	0.432	C	S	.	.	H	α-helix	trans	-54	-49.9	176.8	-75.4	164.6	0	0	0	110.7	L300 L301 K306 T307 K308 L328 L330	L300-L304 HydrophobicContact CG-CD1 4.31Å; L300-L304 WeakPolarHBondContact O-CG 3.41Å; L300-L304 PolarHBondContact O-N 2.95Å; L301-L304 PolarHBondContact O-N 3.41Å; L304-K306 PolarHBondContact O-N 2.95Å; L304-T307 PolarHBondContact O-N 3.22Å; L304-T307 PolarHBondContact O-OG1 2.95Å; L304-K308 CarbonylContact C-O 3.51Å; L304-K308 CarbonylContact O-C 3.6Å; L304-K308 PolarHBondContact O-N 2.91Å; L304-L328 HydrophobicContact CD1-CD2 3.85Å; L304-L330 HydrophobicContact CD1-CD2 3.72Å
305	Q	50.1	Low	47.8	Very low	102 Å²	102	92.1 Å²	92.1	48%	0.477	44%	0.442	S	S	.	.	H	α-helix	trans	-60	-27.9	176.8	-73.4	179.2	-20.3	0	0	113.9	L301 W303	L301-Q305 WeakPolarHBondContact O-CG 3.18Å; L301-Q305 PolarHBondContact O-N 3.48Å; W303-Q305 VanDerWaalsContact C-N 3.31Å; W303-Q305 PolarHBondContact O-N 3.1Å
306	K	47.8	Very low	47.6	Very low	174 Å²	174	89 Å²	89	76%	0.757	43%	0.431	S	S	*	.	H	α-helix	trans	-81.8	-35.9	178	-88.9	-174.9	174.3	-174	0	113.4	R302 W303 L304	R302-K306 WeakPolarHBondContact O-CG 3.37Å; R302-K306 PolarHBondContact O-N 3.37Å; W303-K306 WeakPolarHBondContact O-CA 3.47Å; W303-K306 WeakPolarHBondContact O-CB 3.4Å; W303-K306 PolarHBondContact O-N 3.13Å; L304-K306 PolarHBondContact O-N 2.95Å
307	T	45.8	Very low	47.3	Very low	76 Å²	76	90.1 Å²	90.1	47%	0.466	44%	0.439	S	S	.	.	H	α-helix	trans	-86	-33.2	-175.6	54.6	0	0	0	0	112.4	W303 L304	W303-T307 HydrophobicContact CD2-CG2 3.97Å; W303-T307 VanDerWaalsContact CE2-CG2 3.44Å; W303-T307 HydrophobicContact CG-CG2 4.4Å; W303-T307 HydrophobicContact CH2-CG2 4.31Å; W303-T307 HydrophobicContact CZ2-CG2 3.65Å; W303-T307 PolarHBondContact O-N 3.48Å; W303-T307 PolarHBondContact O-OG1 3.48Å; L304-T307 PolarHBondContact O-N 3.22Å; L304-T307 PolarHBondContact O-OG1 2.95Å
308	K	43.2	Very low	47.2	Very low	137 Å²	137	94.8 Å²	94.8	60%	0.596	47%	0.469	S	S	*	.	S	Bend	trans	-149	128.8	166.2	-86.9	-175.3	177	176	0	109.1	L304 M310	L304-K308 CarbonylContact C-O 3.51Å; L304-K308 CarbonylContact O-C 3.6Å; L304-K308 PolarHBondContact O-N 2.91Å; K308-M310 VanDerWaalsContact C-N 3.27Å; K308-M310 HydrophobicContact CB-CG 4.2Å; K308-M310 HydrophobicContact CD-CE 4.04Å; K308-M310 PolarHBondContact O-N 3.26Å
309	P	48.5	Very low	47	Very low	130 Å²	130	91.3 Å²	91.3	84%	0.844	46%	0.46	S	S	*	.			trans	-63.6	94.1	170.3	26.8	-31.5	0	0	0	108.9
310	M	44.6	Very low	46.7	Very low	96 Å²	96	100.2 Å²	100.2	47%	0.473	48%	0.483	S	S	.	.			trans	-104.7	145.6	170.9	-69.9	-67.1	-163.9	0	0	107.8	K308 A312	K308-M310 VanDerWaalsContact C-N 3.27Å; K308-M310 HydrophobicContact CB-CG 4.2Å; K308-M310 HydrophobicContact CD-CE 4.04Å; K308-M310 PolarHBondContact O-N 3.26Å; M310-A312 PolarHBondContact O-N 3.13Å
311	D	48.9	Very low	46.1	Very low	143 Å²	143	103.4 Å²	103.4	77%	0.765	50%	0.501	S	S	*	.			trans	-74.9	61.1	172.4	-78	-27.1	0	0	0	110.7
312	A	49.7	Very low	45.6	Very low	2 Å²	2	111.8 Å²	111.8	2%	0.017	54%	0.542	C	S	.	.			trans	-86.1	129.6	176.5	0	0	0	0	0	110.5	L301 M310 S329 L330	L301-A312 HydrophobicContact CD1-CB 3.65Å; L301-A312 HydrophobicContact CG-CB 4.35Å; M310-A312 PolarHBondContact O-N 3.13Å; A312-S329 CarbonylContact C-O 3.43Å; A312-S329 WeakPolarHBondContact CA-O 3.5Å; A312-L330 HydrophobicContact CB-CD2 3.92Å
313	H	47.7	Very low	45.1	Very low	131 Å²	131	110.6 Å²	110.6	61%	0.606	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.2	176.7	-73.3	-77	0	0	0	112.2	S329	H313-S329 PolarHBondContact N-O 3.47Å; H313-S329 PolarHBondContact O-N 3.4Å
314	I	46.3	Very low	44.7	Very low	41 Å²	41	107.1 Å²	107.1	21%	0.21	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125.4	170.8	-55	-179.6	0	0	0	107.9	C297 F298 L301 Y326 L328	C297-I314 HydrophobicContact CB-CD1 3.97Å; F298-I314 HydrophobicContact CD1-CD1 3.9Å; F298-I314 HydrophobicContact CE1-CD1 4.08Å; F298-I314 HydrophobicContact CG-CD1 4.15Å; F298-I314 HydrophobicContact CZ-CD1 4.47Å; L301-I314 HydrophobicContact CB-CD1 4.1Å; L301-I314 HydrophobicContact CB-CG1 4.42Å; L301-I314 HydrophobicContact CD1-CD1 4.29Å; L301-I314 HydrophobicContact CD1-CG1 3.69Å; L301-I314 HydrophobicContact CD2-CD1 4.12Å; L301-I314 HydrophobicContact CD2-CG1 4.03Å; L301-I314 HydrophobicContact CG-CD1 4.4Å; L301-I314 HydrophobicContact CG-CG1 4.26Å; I314-Y326 HydrophobicContact CG2-CD1 3.8Å; I314-Y326 HydrophobicContact CG2-CG 4.26Å; I314-L328 HydrophobicContact CD1-CD1 4.32Å; I314-L328 HydrophobicContact CG1-CD1 3.96Å
315	S	41.6	Very low	44.6	Very low	50 Å²	50	108.2 Å²	108.2	35%	0.35	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.3	172.7	54.6	0	0	0	0	110.1	Y326 K327	S315-Y326 WeakPolarHBondContact O-CA 3.31Å; S315-K327 PolarHBondContact N-O 3.44Å; S315-K327 PolarHBondContact O-N 3.2Å; S315-K327 PolarHBondContact OG-O 3.36Å
316	Y	40.3	Very low	44.2	Very low	124 Å²	124	107 Å²	107	49%	0.486	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	125.4	169.8	177.9	-101.7	0	0	0	108.7	P318 Y326	Y316-P318 HydrophobicContact CD1-CB 4.44Å; Y316-P318 HydrophobicContact CE1-CB 3.98Å; Y316-P318 WeakPolarHBondContact O-CD 3.22Å; Y316-Y326 HydrophobicContact CD2-CD1 4.47Å; Y316-Y326 HydrophobicContact CD2-CE1 4.01Å
317	L	42.6	Very low	44.1	Very low	77 Å²	77	104.3 Å²	104.3	40%	0.403	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	113	168.8	-76.2	167.5	0	0	0	107.4	S319 T325 K327	L317-S319 VanDerWaalsContact C-N 3.33Å; L317-S319 PolarHBondContact O-N 3.49Å; L317-T325 HydrophobicContact CB-CG2 4.47Å; L317-T325 HydrophobicContact CD1-CG2 4.17Å; L317-T325 PolarHBondContact N-O 3.37Å; L317-K327 HydrophobicContact CD1-CB 3.8Å; L317-K327 HydrophobicContact CD1-CD 4.39Å; L317-K327 HydrophobicContact CG-CB 4.17Å
318	P	43.6	Very low	44	Very low	107 Å²	107	103 Å²	103	70%	0.695	51%	0.511	S	S	*	.			trans	-65.4	97.7	172.2	24.9	-29.5	0	0	0	108.3	Y316	Y316-P318 HydrophobicContact CD1-CB 4.44Å; Y316-P318 HydrophobicContact CE1-CB 3.98Å; Y316-P318 WeakPolarHBondContact O-CD 3.22Å
319	S	43.8	Very low	44	Very low	50 Å²	50	99 Å²	99	35%	0.35	50%	0.501	S	S	.	.			trans	-76.2	144.3	169	-159.6	0	0	0	0	108.8	L317 D321	L317-S319 VanDerWaalsContact C-N 3.33Å; L317-S319 PolarHBondContact O-N 3.49Å; S319-D321 PolarHBondContact O-N 3.04Å
320	R	43.8	Very low	43.6	Very low	253 Å²	253	99.2 Å²	99.2	96%	0.955	49%	0.494	S	S	*	.	S	Bend	trans	-72	-13.8	170.9	-111	-176.8	173.7	-172.7	-2	112
321	D	39.5	Very low	43.5	Very low	115 Å²	115	99.4 Å²	99.4	62%	0.615	50%	0.495	S	S	*	.	S	Bend	trans	-95.5	151.5	176.6	-59.4	-41.3	0	0	0	109.9	S319 Y323	S319-D321 PolarHBondContact O-N 3.04Å; D321-Y323 HydrophobicContact CB-CD2 4.47Å; D321-Y323 PolarHBondContact O-N 2.75Å
322	M	38.8	Very low	43.3	Very low	195 Å²	195	97.1 Å²	97.1	96%	0.961	48%	0.481	S	S	*	.	S	Bend	trans	-60.5	14.5	-171.4	-72.1	179.5	86.6	0	0	116.3
323	Y	42.1	Very low	42.9	Very low	158 Å²	158	102.3 Å²	102.3	62%	0.62	51%	0.507	S	S	*	.	S	Bend	trans	-113	141.1	-175.1	-58.8	-80.3	0	0	0	111.6	D321 T325	D321-Y323 HydrophobicContact CB-CD2 4.47Å; D321-Y323 PolarHBondContact O-N 2.75Å; Y323-T325 PolarHBondContact O-N 3.14Å
324	S	43.1	Very low	42.6	Very low	54 Å²	54	100.6 Å²	100.6	38%	0.378	50%	0.501	S	S	.	.			trans	-86.7	101	179.9	-69	0	0	0	0	110.3	Y326	S324-Y326 WeakPolarHBondContact O-CD2 3.38Å; S324-Y326 WeakPolarHBondContact O-CE2 3.44Å
325	T	44.5	Very low	42.4	Very low	57 Å²	57	104.4 Å²	104.4	35%	0.35	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.4	176.2	-48.6	0	0	0	0	110.5	L317 Y323	L317-T325 HydrophobicContact CB-CG2 4.47Å; L317-T325 HydrophobicContact CD1-CG2 4.17Å; L317-T325 PolarHBondContact N-O 3.37Å; Y323-T325 PolarHBondContact O-N 3.14Å
326	Y	43	Very low	42.4	Very low	76 Å²	76	108 Å²	108	30%	0.298	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.7	177.3	-61.1	-88.9	0	0	0	110.7	A294 I314 S315 Y316 S324	A294-Y326 HydrophobicContact CB-CD2 4.02Å; A294-Y326 HydrophobicContact CB-CE2 3.54Å; I314-Y326 HydrophobicContact CG2-CD1 3.8Å; I314-Y326 HydrophobicContact CG2-CG 4.26Å; S315-Y326 WeakPolarHBondContact O-CA 3.31Å; Y316-Y326 HydrophobicContact CD2-CD1 4.47Å; Y316-Y326 HydrophobicContact CD2-CE1 4.01Å; S324-Y326 WeakPolarHBondContact O-CD2 3.38Å; S324-Y326 WeakPolarHBondContact O-CE2 3.44Å
327	K	45.6	Very low	42.6	Very low	119 Å²	119	106.9 Å²	106.9	52%	0.517	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	122.1	173.9	-175	177.7	-178.9	-178.2	0	110	S315 L317	S315-K327 PolarHBondContact N-O 3.44Å; S315-K327 PolarHBondContact O-N 3.2Å; S315-K327 PolarHBondContact OG-O 3.36Å; L317-K327 HydrophobicContact CD1-CB 3.8Å; L317-K327 HydrophobicContact CD1-CD 4.39Å; L317-K327 HydrophobicContact CG-CB 4.17Å
328	L	42.1	Very low	42.6	Very low	47 Å²	47	109.2 Å²	109.2	25%	0.246	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.2	169.2	-139.6	107	0	0	0	108.8	C297 L301 L304 I314 L330	C297-L328 HydrophobicContact CB-CD1 4.2Å; L301-L328 HydrophobicContact CB-CD1 4.28Å; L301-L328 HydrophobicContact CD1-CD1 3.69Å; L301-L328 HydrophobicContact CD1-CD2 4.13Å; L301-L328 HydrophobicContact CD1-CG 3.8Å; L304-L328 HydrophobicContact CD1-CD2 3.85Å; I314-L328 HydrophobicContact CD1-CD1 4.32Å; I314-L328 HydrophobicContact CG1-CD1 3.96Å; L328-L330 HydrophobicContact CD2-CD2 4.24Å; L328-L330 HydrophobicContact CD2-CG 4.41Å
329	S	45	Very low	42.5	Very low	55 Å²	55	109.3 Å²	109.3	39%	0.385	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128	169.5	-56.3	0	0	0	0	107.9	A312 H313	A312-S329 CarbonylContact C-O 3.43Å; A312-S329 WeakPolarHBondContact CA-O 3.5Å; H313-S329 PolarHBondContact N-O 3.47Å; H313-S329 PolarHBondContact O-N 3.4Å
330	L	39.1	Very low	42.4	Very low	133 Å²	133	114.7 Å²	114.7	70%	0.696	55%	0.547	S	S	*	.			trans	-98.2	0	-179.6	-74	170.9	0	0	0	111.4	L304 A312 L328	L304-L330 HydrophobicContact CD1-CD2 3.72Å; A312-L330 HydrophobicContact CB-CD2 3.92Å; L328-L330 HydrophobicContact CD2-CD2 4.24Å; L328-L330 HydrophobicContact CD2-CG 4.41Å

Retrieved 330 of 330 residues in 156.8 ms (Link to these results)

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