A0A061IL75_CRIGR Loading...

DCC-interacting protein 13-beta

AlphaFold DB , UniProt , Accession A0A061IL75, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Appl2, Length 662 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	40.7	Very low	76.5	Confident	207 Å²	207	99.9 Å²	99.9	100%	1.02	53%	0.527	S	S	*	.				0	133.5	0	-77.5	-172.5	162.3	0	0	107.5
2	P	42.1	Very low	78.2	Confident	117 Å²	117	91.8 Å²	91.8	76%	0.76	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-57.1	146.1	172	-14.2	27.4	0	0	0	109.2	V4	P2-V4 PolarHBondContact O-N 3.43Å
3	A	54.3	Low	79.6	Confident	91 Å²	91	92.2 Å²	92.2	75%	0.752	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-56.1	130.2	172.1	0	0	0	0	0	108.2	D5	A3-D5 PolarHBondContact O-N 3.15Å
4	V	61.8	Low	80.9	Confident	36 Å²	36	95.5 Å²	95.5	22%	0.218	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-64.2	117	168.9	178.3	0	0	0	0	105.2	P2 R6 Q189	P2-V4 PolarHBondContact O-N 3.43Å; V4-R6 PolarHBondContact O-N 2.68Å; V4-Q189 HydrophobicContact CG1-CB 3.53Å; V4-Q189 HydrophobicContact CG1-CG 3.8Å
5	D	73.9	Confident	82	Confident	130 Å²	130	91.8 Å²	91.8	70%	0.695	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-51.7	134	170.3	-73.1	-39.2	0	0	0	107.7	A3 F26	A3-D5 PolarHBondContact O-N 3.15Å; D5-F26 WeakPolarHBondContact O-CZ 3.39Å
6	R	89.9	Confident	83	Confident	158 Å²	158	87.3 Å²	87.3	60%	0.596	46%	0.458	S	S	*	.			trans	-127.7	136.1	-167.5	-171.1	-175.5	175	-179.5	-2.5	109.7	V4 L8 N186	V4-R6 PolarHBondContact O-N 2.68Å; R6-L8 PolarHBondContact O-N 3.47Å; R6-N186 HydrophobicContact CG-CB 4.5Å; R6-N186 VanDerWaalsContact CG-OD1 3.29Å; R6-N186 WeakPolarHBondContact CG-OD1 3.41Å
7	L	94.8	Very high	83.8	Confident	2 Å²	2	88.4 Å²	88.4	1%	0.01	47%	0.472	C	S	.	.			trans	-69	119.1	167.3	-67.9	169.2	0	0	0	109.2	L22 L23 F26 Y182 L185 N186	L7-L22 HydrophobicContact CD2-CB 4.43Å; L7-L22 HydrophobicContact CD2-CD2 4.05Å; L7-L22 HydrophobicContact CD2-CG 3.88Å; L7-L23 HydrophobicContact CD1-CD1 3.85Å; L7-L23 HydrophobicContact CD2-CB 4.45Å; L7-F26 HydrophobicContact CD1-CB 4.35Å; L7-F26 HydrophobicContact CD1-CD1 4Å; L7-F26 HydrophobicContact CD1-CD2 4.35Å; L7-F26 HydrophobicContact CD1-CE1 4.31Å; L7-F26 HydrophobicContact CD1-CG 3.99Å; L7-F26 HydrophobicContact CD2-CD2 3.98Å; L7-F26 HydrophobicContact CD2-CE2 4.02Å; L7-F26 HydrophobicContact CD2-CG 4.44Å; L7-F26 HydrophobicContact CG-CD1 4.17Å; L7-F26 HydrophobicContact CG-CD2 4Å; L7-F26 HydrophobicContact CG-CE1 4.06Å; L7-F26 HydrophobicContact CG-CE2 3.9Å; L7-F26 HydrophobicContact CG-CG 4.11Å; L7-F26 HydrophobicContact CG-CZ 3.89Å; L7-Y182 HydrophobicContact CB-CD2 4.1Å; L7-Y182 HydrophobicContact CB-CG 4.1Å; L7-Y182 HydrophobicContact CD1-CD1 4.06Å; L7-Y182 HydrophobicContact CD1-CG 4.05Å; L7-L185 HydrophobicContact CD1-CB 3.91Å; L7-L185 HydrophobicContact CD1-CD1 3.74Å; L7-N186 PolarHBondContact N-OD1 3.3Å; L7-N186 PolarHBondContact O-ND2 3.16Å
8	L	95.9	Very high	84.4	Confident	96 Å²	96	92.7 Å²	92.7	50%	0.503	49%	0.488	S	S	.	.			trans	-73.4	126.1	177	-59.9	179.1	0	0	0	109.5	R6 E11	R6-L8 PolarHBondContact O-N 3.47Å; L8-E11 HydrophobicContact CB-CB 4.25Å; L8-E11 HydrophobicContact CB-CG 3.9Å; L8-E11 HydrophobicContact CD1-CG 4.13Å
9	L	96.6	Very high	85	Confident	41 Å²	41	88.5 Å²	88.5	22%	0.215	47%	0.467	C	S	.	.	S	Bend	trans	-77.9	-28.6	-178.1	-61.5	-179.9	0	0	0	111.1	E11 A12 L179	L9-E11 PolarHBondContact O-N 2.96Å; L9-A12 VanDerWaalsContact O-CB 3.22Å; L9-A12 WeakPolarHBondContact O-CB 3.36Å; L9-A12 PolarHBondContact O-N 3.46Å; L9-L179 HydrophobicContact CB-CD2 3.85Å; L9-L179 HydrophobicContact CD2-CD2 4.16Å; L9-L179 HydrophobicContact CG-CD2 4.49Å; L9-L179 WeakPolarHBondContact O-CD2 3.41Å
10	E	96.4	Very high	85.6	Confident	154 Å²	154	88 Å²	88	72%	0.72	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.9	178.7	-56	79.6	-171	0	0	111.7	A12	E10-A12 VanDerWaalsContact C-N 3.33Å
11	E	95.2	Very high	86.1	Confident	67 Å²	67	87.1 Å²	87.1	31%	0.313	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-6.1	179.8	-65	-65.8	147.9	0	0	113.3	L8 L9 L13 Q14 D15 T19	L8-E11 HydrophobicContact CB-CB 4.25Å; L8-E11 HydrophobicContact CB-CG 3.9Å; L8-E11 HydrophobicContact CD1-CG 4.13Å; L9-E11 PolarHBondContact O-N 2.96Å; E11-L13 PolarHBondContact O-N 3.32Å; E11-Q14 PolarHBondContact O-N 3.18Å; E11-D15 PolarHBondContact O-N 3.12Å; E11-T19 HydrophobicContact CB-CG2 4.21Å
12	A	96.6	Very high	88.7	Confident	3 Å²	3	80.6 Å²	80.6	3%	0.025	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-38.4	-172.6	0	0	0	0	0	113	L9 E10 L179 Y182	L9-A12 VanDerWaalsContact O-CB 3.22Å; L9-A12 WeakPolarHBondContact O-CB 3.36Å; L9-A12 PolarHBondContact O-N 3.46Å; E10-A12 VanDerWaalsContact C-N 3.33Å; A12-L179 HydrophobicContact CB-CD2 3.86Å; A12-L179 HydrophobicContact CB-CG 4.33Å; A12-Y182 HydrophobicContact CB-CD2 4.09Å; A12-Y182 HydrophobicContact CB-CE2 3.87Å
13	L	97.1	Very high	91.4	Very high	97 Å²	97	75.2 Å²	75.2	51%	0.508	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-33.2	178.3	-178	60.6	0	0	0	112.7	E11 D15 R171 H175	E11-L13 PolarHBondContact O-N 3.32Å; L13-D15 PolarHBondContact O-N 3.26Å; L13-R171 HydrophobicContact CD1-CG 4.17Å; L13-H175 HydrophobicContact CD1-CB 3.96Å
14	Q	97.2	Very high	93.5	Very high	138 Å²	138	73.8 Å²	73.8	65%	0.645	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-28.9	178.8	-177.9	169.6	-21.9	0	0	111.3	E11 S16	E11-Q14 PolarHBondContact O-N 3.18Å; Q14-S16 PolarHBondContact O-N 3.24Å
15	D	97.3	Very high	95.1	Very high	40 Å²	40	76.1 Å²	76.1	21%	0.214	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	41.9	175.3	-161.6	31.7	0	0	0	112.9	E11 L13 R20 Q174	E11-D15 PolarHBondContact O-N 3.12Å; L13-D15 PolarHBondContact O-N 3.26Å; D15-R20 IonicContact OD1-CZ 3.71Å; D15-R20 IonicContact OD1-NE 3.59Å; D15-R20 PolarHBondContact OD1-NE 2.94Å; D15-R20 IonicContact OD1-NH2 3.42Å; D15-R20 PolarHBondContact OD1-NH2 3.09Å; D15-R20 IonicContact OD2-CZ 2.95Å; D15-R20 IonicContact OD2-NE 3.86Å; D15-R20 IonicContact OD2-NH2 2.71Å; D15-R20 PolarHBondContact OD2-NH2 2.95Å; D15-Q174 PolarHBondContact OD2-NE2 2.98Å
16	S	97.8	Very high	96.3	Very high	20 Å²	20	70.5 Å²	70.5	14%	0.14	36%	0.362	C	S	.	.			trans	-66.2	151.5	-174.3	84	0	0	0	0	111.3	Q14 Q18 T19 R20	Q14-S16 PolarHBondContact O-N 3.24Å; S16-Q18 PolarHBondContact O-N 2.74Å; S16-Q18 VanDerWaalsContact O-N 3.13Å; S16-Q18 PolarHBondContact OG-N 2.97Å; S16-T19 WeakPolarHBondContact O-CB 3.4Å; S16-T19 PolarHBondContact O-N 2.99Å; S16-T19 PolarHBondContact OG-N 3.33Å; S16-T19 PolarHBondContact OG-OG1 3.34Å; S16-R20 PolarHBondContact O-N 2.91Å
17	P	97.3	Very high	96.6	Very high	106 Å²	106	65.3 Å²	65.3	69%	0.688	34%	0.344	S	S	*	.	H	α-helix	trans	-56	-30.3	173.3	-26.9	35.3	0	0	0	113.3	S21	P17-S21 WeakPolarHBondContact O-CB 3.31Å; P17-S21 PolarHBondContact O-N 3.32Å; P17-S21 PolarHBondContact O-OG 3.1Å
18	Q	94.8	Very high	96.8	Very high	165 Å²	165	71.8 Å²	71.8	77%	0.771	38%	0.375	S	S	*	.	H	α-helix	trans	-69.3	-43	175.2	-174.2	171.2	-1.6	0	0	111.5	S16 R20 S21 L22	S16-Q18 PolarHBondContact O-N 2.74Å; S16-Q18 VanDerWaalsContact O-N 3.13Å; S16-Q18 PolarHBondContact OG-N 2.97Å; Q18-R20 VanDerWaalsContact C-N 3.34Å; Q18-R20 PolarHBondContact O-N 2.92Å; Q18-S21 PolarHBondContact O-N 2.71Å; Q18-L22 PolarHBondContact O-N 2.97Å
19	T	95.7	Very high	96.8	Very high	14 Å²	14	69.9 Å²	69.9	9%	0.086	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-43.6	173.7	-49.5	0	0	0	0	110.8	E11 S16 S21 L22 L23 Y182	E11-T19 HydrophobicContact CB-CG2 4.21Å; S16-T19 WeakPolarHBondContact O-CB 3.4Å; S16-T19 PolarHBondContact O-N 2.99Å; S16-T19 PolarHBondContact OG-N 3.33Å; S16-T19 PolarHBondContact OG-OG1 3.34Å; T19-S21 PolarHBondContact O-N 3.39Å; T19-L22 PolarHBondContact O-N 3.36Å; T19-L23 WeakPolarHBondContact O-CB 3.47Å; T19-L23 PolarHBondContact O-N 3.41Å; T19-Y182 HydrophobicContact CG2-CE2 3.88Å
20	R	97.1	Very high	96.8	Very high	77 Å²	77	68.5 Å²	68.5	29%	0.291	36%	0.359	S	S	.	.	H	α-helix	trans	-64.1	-36.7	175.6	-74	-72.4	-171.5	136.6	9.7	113	D15 S16 Q18 L23 S24 F133 S137	D15-R20 IonicContact OD1-CZ 3.71Å; D15-R20 IonicContact OD1-NE 3.59Å; D15-R20 PolarHBondContact OD1-NE 2.94Å; D15-R20 IonicContact OD1-NH2 3.42Å; D15-R20 PolarHBondContact OD1-NH2 3.09Å; D15-R20 IonicContact OD2-CZ 2.95Å; D15-R20 IonicContact OD2-NE 3.86Å; D15-R20 IonicContact OD2-NH2 2.71Å; D15-R20 PolarHBondContact OD2-NH2 2.95Å; S16-R20 PolarHBondContact O-N 2.91Å; Q18-R20 VanDerWaalsContact C-N 3.34Å; Q18-R20 PolarHBondContact O-N 2.92Å; R20-L23 WeakPolarHBondContact O-CB 3.3Å; R20-L23 PolarHBondContact O-N 2.86Å; R20-S24 PolarHBondContact O-N 3.21Å; R20-S24 PolarHBondContact O-OG 2.98Å; R20-F133 VanDerWaalsContact CZ-CZ 3.42Å; R20-S137 PolarHBondContact NH2-OG 3.26Å
21	S	96.1	Very high	96.9	Very high	70 Å²	70	62.7 Å²	62.7	49%	0.49	34%	0.341	S	S	.	.	H	α-helix	trans	-67.8	-40.7	175.8	-58.6	0	0	0	0	111.8	P17 Q18 T19 S24 V25	P17-S21 WeakPolarHBondContact O-CB 3.31Å; P17-S21 PolarHBondContact O-N 3.32Å; P17-S21 PolarHBondContact O-OG 3.1Å; Q18-S21 PolarHBondContact O-N 2.71Å; T19-S21 PolarHBondContact O-N 3.39Å; S21-S24 PolarHBondContact O-N 3Å; S21-S24 PolarHBondContact O-OG 2.97Å; S21-V25 PolarHBondContact O-N 3.49Å
22	L	95.9	Very high	97	Very high	70 Å²	70	63.7 Å²	63.7	37%	0.366	35%	0.352	S	S	.	.	H	α-helix	trans	-65.7	-43.2	173.1	-176.9	60.9	0	0	0	111	L7 Q18 T19 S24 V25 F26	L7-L22 HydrophobicContact CD2-CB 4.43Å; L7-L22 HydrophobicContact CD2-CD2 4.05Å; L7-L22 HydrophobicContact CD2-CG 3.88Å; Q18-L22 PolarHBondContact O-N 2.97Å; T19-L22 PolarHBondContact O-N 3.36Å; L22-S24 VanDerWaalsContact C-N 3.32Å; L22-S24 PolarHBondContact O-N 3.46Å; L22-V25 WeakPolarHBondContact O-CB 3.47Å; L22-V25 PolarHBondContact O-N 3.18Å; L22-V25 VanDerWaalsContact O-N 3.13Å; L22-F26 HydrophobicContact CD1-CD2 4.32Å; L22-F26 HydrophobicContact CD1-CE2 3.93Å; L22-F26 HydrophobicContact CG-CD2 4.32Å; L22-F26 HydrophobicContact CG-CE2 4.03Å; L22-F26 WeakPolarHBondContact O-CD2 3.35Å; L22-F26 PolarHBondContact O-N 3.48Å
23	L	97.7	Very high	97.1	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.021	36%	0.355	C	S	.	.	H	α-helix	trans	-55	-46.7	175	179.4	64.3	0	0	0	111.4	L7 T19 R20 V25 F26 E27 F133 Y181 Y182 L185	L7-L23 HydrophobicContact CD1-CD1 3.85Å; L7-L23 HydrophobicContact CD2-CB 4.45Å; T19-L23 WeakPolarHBondContact O-CB 3.47Å; T19-L23 PolarHBondContact O-N 3.41Å; R20-L23 WeakPolarHBondContact O-CB 3.3Å; R20-L23 PolarHBondContact O-N 2.86Å; L23-V25 PolarHBondContact O-N 2.99Å; L23-F26 WeakPolarHBondContact O-CA 3.43Å; L23-F26 WeakPolarHBondContact O-CB 3.28Å; L23-F26 PolarHBondContact O-N 3.05Å; L23-E27 HydrophobicContact CG-CG 4.41Å; L23-E27 WeakPolarHBondContact O-CG 3.47Å; L23-E27 PolarHBondContact O-N 2.91Å; L23-F133 HydrophobicContact CD2-CD1 4.4Å; L23-F133 HydrophobicContact CD2-CE1 3.65Å; L23-F133 HydrophobicContact CD2-CZ 4.34Å; L23-Y181 HydrophobicContact CD1-CD1 4.13Å; L23-Y181 HydrophobicContact CD1-CE1 3.84Å; L23-Y181 HydrophobicContact CD2-CE1 4.37Å; L23-Y181 HydrophobicContact CG-CE1 4.44Å; L23-Y182 HydrophobicContact CD1-CD1 3.85Å; L23-Y182 HydrophobicContact CD1-CE1 3.58Å; L23-Y182 HydrophobicContact CD2-CE1 3.69Å; L23-Y182 HydrophobicContact CG-CE1 4.13Å; L23-L185 HydrophobicContact CD1-CD1 3.46Å; L23-L185 VanDerWaalsContact CD1-CD1 3.46Å
24	S	97.6	Very high	97.1	Very high	62 Å²	62	61.9 Å²	61.9	43%	0.434	34%	0.344	S	S	.	.	H	α-helix	trans	-60.1	-32.4	179.4	55.4	0	0	0	0	113.4	R20 S21 L22 E27 E28	R20-S24 PolarHBondContact O-N 3.21Å; R20-S24 PolarHBondContact O-OG 2.98Å; S21-S24 PolarHBondContact O-N 3Å; S21-S24 PolarHBondContact O-OG 2.97Å; L22-S24 VanDerWaalsContact C-N 3.32Å; L22-S24 PolarHBondContact O-N 3.46Å; S24-E27 PolarHBondContact O-N 3.3Å; S24-E28 PolarHBondContact O-N 3.01Å
25	V	97.3	Very high	97.2	Very high	84 Å²	84	60 Å²	60	51%	0.509	34%	0.338	S	S	.	.	H	α-helix	trans	-66.2	-39.9	174	176.3	0	0	0	0	111.1	S21 L22 L23 E27 E28 D29	S21-V25 PolarHBondContact O-N 3.49Å; L22-V25 WeakPolarHBondContact O-CB 3.47Å; L22-V25 PolarHBondContact O-N 3.18Å; L22-V25 VanDerWaalsContact O-N 3.13Å; L23-V25 PolarHBondContact O-N 2.99Å; V25-E27 VanDerWaalsContact C-N 3.33Å; V25-E28 PolarHBondContact O-N 2.94Å; V25-D29 PolarHBondContact O-N 3.39Å
26	F	97.6	Very high	97.2	Very high	12 Å²	12	64.1 Å²	64.1	5%	0.053	35%	0.352	C	S	.	.	H	α-helix	trans	-66.3	-36.2	174	-82.5	-111.5	0	0	0	112.1	D5 L7 L22 L23 A30 L185 Q189	D5-F26 WeakPolarHBondContact O-CZ 3.39Å; L7-F26 HydrophobicContact CD1-CB 4.35Å; L7-F26 HydrophobicContact CD1-CD1 4Å; L7-F26 HydrophobicContact CD1-CD2 4.35Å; L7-F26 HydrophobicContact CD1-CE1 4.31Å; L7-F26 HydrophobicContact CD1-CG 3.99Å; L7-F26 HydrophobicContact CD2-CD2 3.98Å; L7-F26 HydrophobicContact CD2-CE2 4.02Å; L7-F26 HydrophobicContact CD2-CG 4.44Å; L7-F26 HydrophobicContact CG-CD1 4.17Å; L7-F26 HydrophobicContact CG-CD2 4Å; L7-F26 HydrophobicContact CG-CE1 4.06Å; L7-F26 HydrophobicContact CG-CE2 3.9Å; L7-F26 HydrophobicContact CG-CG 4.11Å; L7-F26 HydrophobicContact CG-CZ 3.89Å; L22-F26 HydrophobicContact CD1-CD2 4.32Å; L22-F26 HydrophobicContact CD1-CE2 3.93Å; L22-F26 HydrophobicContact CG-CD2 4.32Å; L22-F26 HydrophobicContact CG-CE2 4.03Å; L22-F26 WeakPolarHBondContact O-CD2 3.35Å; L22-F26 PolarHBondContact O-N 3.48Å; L23-F26 WeakPolarHBondContact O-CA 3.43Å; L23-F26 WeakPolarHBondContact O-CB 3.28Å; L23-F26 PolarHBondContact O-N 3.05Å; F26-A30 WeakPolarHBondContact O-CB 3.44Å; F26-A30 PolarHBondContact O-N 3.41Å; F26-L185 HydrophobicContact CB-CD1 4.03Å; F26-L185 HydrophobicContact CB-CD2 4.44Å; F26-L185 HydrophobicContact CD1-CB 4.09Å; F26-Q189 HydrophobicContact CE1-CG 4.05Å
27	E	97.9	Very high	97.2	Very high	50 Å²	50	63.2 Å²	63.2	23%	0.234	35%	0.345	C	S	.	.	H	α-helix	trans	-65.5	-39.7	175.3	-62	-167	167.9	0	0	112.1	L23 S24 V25 A30 G31 K130 Y181	L23-E27 HydrophobicContact CG-CG 4.41Å; L23-E27 WeakPolarHBondContact O-CG 3.47Å; L23-E27 PolarHBondContact O-N 2.91Å; S24-E27 PolarHBondContact O-N 3.3Å; V25-E27 VanDerWaalsContact C-N 3.33Å; E27-A30 PolarHBondContact O-N 3.46Å; E27-G31 PolarHBondContact O-N 2.86Å; E27-K130 IonicContact OE1-NZ 3.52Å; E27-K130 VanDerWaalsContact OE2-CE 3.22Å; E27-K130 WeakPolarHBondContact OE2-CE 3.44Å; E27-K130 IonicContact OE2-NZ 3.31Å; E27-K130 PolarHBondContact OE2-NZ 3.44Å; E27-Y181 HydrophobicContact CG-CE1 4.48Å; E27-Y181 WeakPolarHBondContact CG-OH 3.42Å; E27-Y181 WeakPolarHBondContact OE1-CE1 3.47Å; E27-Y181 PolarHBondContact OE1-OH 2.73Å
28	E	98	Very high	97.2	Very high	138 Å²	138	60.1 Å²	60.1	65%	0.645	32%	0.323	S	S	*	.	H	α-helix	trans	-65.8	-44.1	175.9	-172.3	-179.1	173.7	0	0	112	S24 V25 A30 G31 T32	S24-E28 PolarHBondContact O-N 3.01Å; V25-E28 PolarHBondContact O-N 2.94Å; E28-A30 VanDerWaalsContact C-N 3.34Å; E28-A30 PolarHBondContact O-N 3.38Å; E28-G31 PolarHBondContact O-N 3.34Å; E28-T32 PolarHBondContact O-N 3.01Å; E28-T32 PolarHBondContact O-OG1 3.15Å
29	D	95.9	Very high	97.4	Very high	56 Å²	56	58.4 Å²	58.4	30%	0.299	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-42.3	173.3	-178.4	56.8	0	0	0	111	V25 T32 L33 Q189 K192	V25-D29 PolarHBondContact O-N 3.39Å; D29-T32 PolarHBondContact O-N 3.37Å; D29-L33 WeakPolarHBondContact O-CB 3.43Å; D29-L33 PolarHBondContact O-N 2.75Å; D29-Q189 PolarHBondContact OD2-NE2 3.39Å; D29-K192 IonicContact OD1-NZ 3.15Å; D29-K192 PolarHBondContact OD1-NZ 2.92Å; D29-K192 IonicContact OD2-NZ 2.69Å; D29-K192 PolarHBondContact OD2-NZ 3.13Å
30	A	97.2	Very high	97.5	Very high	11 Å²	11	59.4 Å²	59.4	9%	0.091	32%	0.319	C	S	.	.	H	α-helix	trans	-65.1	-38.6	177	0	0	0	0	0	112.6	F26 E27 E28 T34 L185 L188	F26-A30 WeakPolarHBondContact O-CB 3.44Å; F26-A30 PolarHBondContact O-N 3.41Å; E27-A30 PolarHBondContact O-N 3.46Å; E28-A30 VanDerWaalsContact C-N 3.34Å; E28-A30 PolarHBondContact O-N 3.38Å; A30-T34 WeakPolarHBondContact O-CB 3.34Å; A30-T34 PolarHBondContact O-N 2.94Å; A30-T34 PolarHBondContact O-OG1 3.07Å; A30-L185 HydrophobicContact CB-CD2 4.27Å; A30-L188 HydrophobicContact CB-CD2 4.03Å
31	G	97.8	Very high	97.5	Very high	33 Å²	33	56.4 Å²	56.4	34%	0.34	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-51.7	173.2	0	0	0	0	0	111.7	E27 E28 L33 T34 D35	E27-G31 PolarHBondContact O-N 2.86Å; E28-G31 PolarHBondContact O-N 3.34Å; G31-L33 VanDerWaalsContact C-N 3.31Å; G31-L33 PolarHBondContact O-N 3.04Å; G31-T34 WeakPolarHBondContact O-CB 3.46Å; G31-T34 PolarHBondContact O-N 2.91Å; G31-T34 VanDerWaalsContact O-N 3.07Å; G31-D35 PolarHBondContact O-N 3.3Å
32	T	98.1	Very high	97.6	Very high	88 Å²	88	59.2 Å²	59.2	54%	0.54	31%	0.314	S	S	.	.	H	α-helix	trans	-58.8	-42.1	177.7	-55.5	0	0	0	0	111.9	E28 D29 T34 D35 Y36	E28-T32 PolarHBondContact O-N 3.01Å; E28-T32 PolarHBondContact O-OG1 3.15Å; D29-T32 PolarHBondContact O-N 3.37Å; T32-T34 VanDerWaalsContact C-N 3.34Å; T32-T34 PolarHBondContact O-N 3.38Å; T32-D35 PolarHBondContact O-N 3.03Å; T32-Y36 WeakPolarHBondContact O-CB 3.44Å; T32-Y36 PolarHBondContact O-N 3.21Å
33	L	97.5	Very high	97.7	Very high	17 Å²	17	58.4 Å²	58.4	9%	0.089	32%	0.318	C	S	.	.	H	α-helix	trans	-61.6	-42.5	175.6	176.3	62.3	0	0	0	111.7	D29 G31 Y36 T37 F118 L123 L188 K192 M196	D29-L33 WeakPolarHBondContact O-CB 3.43Å; D29-L33 PolarHBondContact O-N 2.75Å; G31-L33 VanDerWaalsContact C-N 3.31Å; G31-L33 PolarHBondContact O-N 3.04Å; L33-Y36 PolarHBondContact O-N 2.84Å; L33-T37 HydrophobicContact CD1-CG2 3.99Å; L33-T37 HydrophobicContact CG-CG2 4.3Å; L33-T37 WeakPolarHBondContact O-CG2 3.38Å; L33-T37 PolarHBondContact O-N 3.36Å; L33-T37 PolarHBondContact O-OG1 2.78Å; L33-F118 HydrophobicContact CD2-CE1 4.44Å; L33-F118 HydrophobicContact CD2-CZ 4.05Å; L33-L123 HydrophobicContact CD2-CD2 4.27Å; L33-L188 HydrophobicContact CD2-CD1 4.19Å; L33-L188 HydrophobicContact CD2-CD2 4.28Å; L33-L188 HydrophobicContact CD2-CG 4.17Å; L33-K192 HydrophobicContact CD1-CB 4.1Å; L33-K192 HydrophobicContact CD2-CB 3.6Å; L33-K192 HydrophobicContact CD2-CD 4.03Å; L33-K192 HydrophobicContact CD2-CG 4.48Å; L33-M196 HydrophobicContact CD1-CE 4.14Å
34	T	98	Very high	97.8	Very high	45 Å²	45	58.8 Å²	58.8	28%	0.276	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-48.4	178.1	-58.7	0	0	0	0	110.7	A30 G31 T32 Y36 T37 N38 L123	A30-T34 WeakPolarHBondContact O-CB 3.34Å; A30-T34 PolarHBondContact O-N 2.94Å; A30-T34 PolarHBondContact O-OG1 3.07Å; G31-T34 WeakPolarHBondContact O-CB 3.46Å; G31-T34 PolarHBondContact O-N 2.91Å; G31-T34 VanDerWaalsContact O-N 3.07Å; T32-T34 VanDerWaalsContact C-N 3.34Å; T32-T34 PolarHBondContact O-N 3.38Å; T34-Y36 PolarHBondContact O-N 2.84Å; T34-T37 PolarHBondContact O-N 3.37Å; T34-T37 PolarHBondContact O-OG1 3.24Å; T34-N38 VanDerWaalsContact O-CG 3.3Å; T34-N38 PolarHBondContact O-N 3.46Å; T34-N38 PolarHBondContact O-ND2 3Å; T34-L123 HydrophobicContact CG2-CD1 4.22Å
35	D	98.1	Very high	97.8	Very high	97 Å²	97	60.2 Å²	60.2	52%	0.519	32%	0.32	S	S	.	.	H	α-helix	trans	-62.1	-43.4	178.6	-69.9	-23.4	0	0	0	112.4	G31 T32 N38 Q39	G31-D35 PolarHBondContact O-N 3.3Å; T32-D35 PolarHBondContact O-N 3.03Å; D35-N38 WeakPolarHBondContact O-CB 3.47Å; D35-N38 PolarHBondContact O-N 3.31Å; D35-Q39 PolarHBondContact O-N 2.74Å
36	Y	98.1	Very high	97.9	Very high	128 Å²	128	66.1 Å²	66.1	50%	0.502	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-45.2	175.5	178.7	-98.4	0	0	0	111.9	T32 L33 T34 N38 Q39 L40 M196	T32-Y36 WeakPolarHBondContact O-CB 3.44Å; T32-Y36 PolarHBondContact O-N 3.21Å; L33-Y36 PolarHBondContact O-N 2.84Å; T34-Y36 PolarHBondContact O-N 2.84Å; Y36-N38 VanDerWaalsContact C-N 3.27Å; Y36-N38 PolarHBondContact O-N 3.45Å; Y36-Q39 PolarHBondContact O-N 3.13Å; Y36-L40 HydrophobicContact CE1-CB 4.45Å; Y36-L40 HydrophobicContact CE1-CD2 4.09Å; Y36-L40 WeakPolarHBondContact O-CB 3.42Å; Y36-L40 PolarHBondContact O-N 3.29Å; Y36-M196 HydrophobicContact CD1-CE 4.39Å; Y36-M196 HydrophobicContact CD1-SD 4.24Å; Y36-M196 HydrophobicContact CE1-CE 4.43Å; Y36-M196 HydrophobicContact CE1-SD 3.7Å
37	T	97.9	Very high	97.9	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-63.6	-33	179.4	63.8	0	0	0	0	112.5	L33 T34 L40 L41 F118 L123 M196	L33-T37 HydrophobicContact CD1-CG2 3.99Å; L33-T37 HydrophobicContact CG-CG2 4.3Å; L33-T37 WeakPolarHBondContact O-CG2 3.38Å; L33-T37 PolarHBondContact O-N 3.36Å; L33-T37 PolarHBondContact O-OG1 2.78Å; T34-T37 PolarHBondContact O-N 3.37Å; T34-T37 PolarHBondContact O-OG1 3.24Å; T37-L40 PolarHBondContact O-N 3.38Å; T37-L41 VanDerWaalsContact O-CB 3.27Å; T37-L41 WeakPolarHBondContact O-CB 3.49Å; T37-L41 PolarHBondContact O-N 2.84Å; T37-F118 HydrophobicContact CG2-CD1 4.1Å; T37-F118 HydrophobicContact CG2-CE1 3.77Å; T37-L123 HydrophobicContact CG2-CD1 4.41Å; T37-M196 HydrophobicContact CG2-CE 3.42Å; T37-M196 VanDerWaalsContact CG2-CE 3.42Å
38	N	96.9	Very high	98	Very high	41 Å²	41	70 Å²	70	22%	0.219	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-47.2	174.1	-69.4	-34.1	0	0	0	111.2	T34 D35 Y36 L41 Q42 R119	T34-N38 VanDerWaalsContact O-CG 3.3Å; T34-N38 PolarHBondContact O-N 3.46Å; T34-N38 PolarHBondContact O-ND2 3Å; D35-N38 WeakPolarHBondContact O-CB 3.47Å; D35-N38 PolarHBondContact O-N 3.31Å; Y36-N38 VanDerWaalsContact C-N 3.27Å; Y36-N38 PolarHBondContact O-N 3.45Å; N38-L41 PolarHBondContact O-N 2.69Å; N38-Q42 WeakPolarHBondContact O-CG 3.42Å; N38-Q42 PolarHBondContact O-N 2.93Å; N38-Q42 VanDerWaalsContact O-N 3.11Å; N38-R119 PolarHBondContact OD1-NE 2.83Å
39	Q	98.3	Very high	98	Very high	130 Å²	130	64.8 Å²	64.8	61%	0.607	34%	0.336	S	S	*	.	H	α-helix	trans	-66.7	-41.7	179.1	-65.2	177.9	32.5	0	0	111.6	D35 Y36 Q42 A43	D35-Q39 PolarHBondContact O-N 2.74Å; Y36-Q39 PolarHBondContact O-N 3.13Å; Q39-Q42 PolarHBondContact O-N 3.35Å; Q39-A43 PolarHBondContact O-N 3.18Å
40	L	97.9	Very high	98.1	Very high	35 Å²	35	65.2 Å²	65.2	18%	0.183	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-44.3	177	-175.9	62.7	0	0	0	111.5	Y36 T37 Q42 A43 M44 M196	Y36-L40 HydrophobicContact CE1-CB 4.45Å; Y36-L40 HydrophobicContact CE1-CD2 4.09Å; Y36-L40 WeakPolarHBondContact O-CB 3.42Å; Y36-L40 PolarHBondContact O-N 3.29Å; T37-L40 PolarHBondContact O-N 3.38Å; L40-Q42 VanDerWaalsContact C-N 3.35Å; L40-Q42 PolarHBondContact O-N 3Å; L40-A43 PolarHBondContact O-N 3.49Å; L40-M44 HydrophobicContact CD1-CE 3.91Å; L40-M44 HydrophobicContact CD2-CE 4.02Å; L40-M44 HydrophobicContact CG-CE 3.86Å; L40-M44 HydrophobicContact CG-SD 4.23Å; L40-M44 WeakPolarHBondContact O-CG 3.45Å; L40-M44 PolarHBondContact O-N 3.26Å; L40-M196 HydrophobicContact CD2-CE 4.46Å; L40-M196 HydrophobicContact CD2-SD 3.62Å
41	L	97.8	Very high	98.2	Very high	14 Å²	14	65.9 Å²	65.9	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-60.2	-44.6	177.4	178.6	59.4	0	0	0	111.3	T37 N38 A43 M44 Q45 L112 V115 I116	T37-L41 VanDerWaalsContact O-CB 3.27Å; T37-L41 WeakPolarHBondContact O-CB 3.49Å; T37-L41 PolarHBondContact O-N 2.84Å; N38-L41 PolarHBondContact O-N 2.69Å; L41-A43 VanDerWaalsContact C-N 3.34Å; L41-A43 PolarHBondContact O-N 3.47Å; L41-M44 PolarHBondContact O-N 2.75Å; L41-Q45 HydrophobicContact CD1-CG 4.13Å; L41-Q45 HydrophobicContact CG-CG 4.37Å; L41-Q45 WeakPolarHBondContact O-CB 3.44Å; L41-Q45 VanDerWaalsContact O-CG 3.26Å; L41-Q45 WeakPolarHBondContact O-CG 3.49Å; L41-Q45 PolarHBondContact O-N 3.43Å; L41-L112 HydrophobicContact CD1-CD2 4.18Å; L41-V115 HydrophobicContact CB-CG1 4.06Å; L41-V115 HydrophobicContact CD1-CB 4.4Å; L41-V115 HydrophobicContact CD1-CG1 4.2Å; L41-I116 HydrophobicContact CD1-CD1 4.32Å; L41-I116 HydrophobicContact CD1-CG1 3.65Å; L41-I116 HydrophobicContact CD2-CG1 4.13Å
42	Q	98.4	Very high	98.2	Very high	128 Å²	128	67.2 Å²	67.2	60%	0.598	35%	0.348	S	S	*	.	H	α-helix	trans	-60.2	-42.9	176.3	-72	173	7.8	0	0	112.1	N38 Q39 L40 Q45 R46	N38-Q42 WeakPolarHBondContact O-CG 3.42Å; N38-Q42 PolarHBondContact O-N 2.93Å; N38-Q42 VanDerWaalsContact O-N 3.11Å; Q39-Q42 PolarHBondContact O-N 3.35Å; L40-Q42 VanDerWaalsContact C-N 3.35Å; L40-Q42 PolarHBondContact O-N 3Å; Q42-Q45 PolarHBondContact O-N 3.44Å; Q42-R46 PolarHBondContact O-N 3.38Å
43	A	98.6	Very high	98.2	Very high	53 Å²	53	68.6 Å²	68.6	44%	0.438	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-45.8	176.6	0	0	0	0	0	111.6	Q39 L40 L41 Q45 R46 V47	Q39-A43 PolarHBondContact O-N 3.18Å; L40-A43 PolarHBondContact O-N 3.49Å; L41-A43 VanDerWaalsContact C-N 3.34Å; L41-A43 PolarHBondContact O-N 3.47Å; A43-Q45 PolarHBondContact O-N 3.4Å; A43-R46 WeakPolarHBondContact O-CB 3.47Å; A43-R46 PolarHBondContact O-N 2.88Å; A43-V47 WeakPolarHBondContact O-CG2 3.43Å; A43-V47 PolarHBondContact O-N 2.71Å; A43-V47 VanDerWaalsContact O-N 3.07Å
44	M	98.5	Very high	98.3	Very high	13 Å²	13	71.6 Å²	71.6	6%	0.064	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-39.2	177.1	-70.6	179.3	171.4	0	0	112.2	L40 L41 R46 V47 Y48 M111 L112 V115 P199 L200	L40-M44 HydrophobicContact CD1-CE 3.91Å; L40-M44 HydrophobicContact CD2-CE 4.02Å; L40-M44 HydrophobicContact CG-CE 3.86Å; L40-M44 HydrophobicContact CG-SD 4.23Å; L40-M44 WeakPolarHBondContact O-CG 3.45Å; L40-M44 PolarHBondContact O-N 3.26Å; L41-M44 PolarHBondContact O-N 2.75Å; M44-R46 VanDerWaalsContact C-N 3.3Å; M44-R46 PolarHBondContact O-N 3.02Å; M44-V47 PolarHBondContact O-N 2.98Å; M44-Y48 PolarHBondContact O-N 2.95Å; M44-M111 HydrophobicContact CB-CE 3.98Å; M44-M111 HydrophobicContact CB-CG 4.39Å; M44-M111 HydrophobicContact CB-SD 4.22Å; M44-M111 HydrophobicContact CE-CG 4.05Å; M44-M111 HydrophobicContact CG-CE 4.38Å; M44-M111 HydrophobicContact CG-CG 4.03Å; M44-M111 HydrophobicContact CG-SD 3.95Å; M44-M111 HydrophobicContact SD-CG 3.66Å; M44-M111 HydrophobicContact SD-SD 4.36Å; M44-L112 HydrophobicContact CB-CD2 3.55Å; M44-V115 HydrophobicContact CE-CG2 4.37Å; M44-V115 HydrophobicContact SD-CG2 3.77Å; M44-P199 HydrophobicContact CE-CB 3.67Å; M44-P199 HydrophobicContact CE-CG 4.48Å; M44-P199 HydrophobicContact SD-CB 4.26Å; M44-L200 HydrophobicContact CE-CD2 4.4Å
45	Q	98.5	Very high	98.3	Very high	92 Å²	92	69.9 Å²	69.9	43%	0.43	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-39.1	175.8	-77.9	174.7	-32.8	0	0	111.2	L41 Q42 A43 Y48 G49 L112	L41-Q45 HydrophobicContact CD1-CG 4.13Å; L41-Q45 HydrophobicContact CG-CG 4.37Å; L41-Q45 WeakPolarHBondContact O-CB 3.44Å; L41-Q45 VanDerWaalsContact O-CG 3.26Å; L41-Q45 WeakPolarHBondContact O-CG 3.49Å; L41-Q45 PolarHBondContact O-N 3.43Å; Q42-Q45 PolarHBondContact O-N 3.44Å; A43-Q45 PolarHBondContact O-N 3.4Å; Q45-Y48 PolarHBondContact O-N 3.5Å; Q45-G49 PolarHBondContact O-N 2.83Å; Q45-L112 HydrophobicContact CB-CD2 4.46Å; Q45-L112 HydrophobicContact CG-CD2 3.83Å
46	R	98.8	Very high	98.3	Very high	208 Å²	208	69 Å²	69	79%	0.785	35%	0.348	S	S	*	.	H	α-helix	trans	-64.7	-41.4	174.6	-172.8	177.5	-179.9	-178.1	0.3	112.2	Q42 A43 M44 G49 A50	Q42-R46 PolarHBondContact O-N 3.38Å; A43-R46 WeakPolarHBondContact O-CB 3.47Å; A43-R46 PolarHBondContact O-N 2.88Å; M44-R46 VanDerWaalsContact C-N 3.3Å; M44-R46 PolarHBondContact O-N 3.02Å; R46-G49 PolarHBondContact O-N 3.45Å; R46-A50 WeakPolarHBondContact O-CB 3.24Å; R46-A50 PolarHBondContact O-N 3.4Å
47	V	98.7	Very high	98.3	Very high	67 Å²	67	65.5 Å²	65.5	41%	0.406	35%	0.345	S	S	.	.	H	α-helix	trans	-61.4	-48.5	175.3	171.1	0	0	0	0	110.7	A43 M44 A50 Q51 L107 M111 F203	A43-V47 WeakPolarHBondContact O-CG2 3.43Å; A43-V47 PolarHBondContact O-N 2.71Å; A43-V47 VanDerWaalsContact O-N 3.07Å; M44-V47 PolarHBondContact O-N 2.98Å; V47-A50 PolarHBondContact O-N 2.93Å; V47-Q51 PolarHBondContact O-N 2.88Å; V47-L107 HydrophobicContact CG1-CD1 4.42Å; V47-M111 HydrophobicContact CG1-CE 4.37Å; V47-F203 HydrophobicContact CG1-CE2 4.21Å
48	Y	98.6	Very high	98.3	Very high	75 Å²	75	65.8 Å²	65.8	29%	0.294	35%	0.347	S	S	.	.	H	α-helix	trans	-60.4	-45.3	175.9	167.4	-101.6	0	0	0	112.2	M44 Q45 A50 Q51 N52 A104 L107 A108 L112	M44-Y48 PolarHBondContact O-N 2.95Å; Q45-Y48 PolarHBondContact O-N 3.5Å; Y48-A50 VanDerWaalsContact C-N 3.34Å; Y48-A50 PolarHBondContact O-N 3.39Å; Y48-Q51 WeakPolarHBondContact O-CB 3.48Å; Y48-Q51 PolarHBondContact O-N 2.82Å; Y48-Q51 VanDerWaalsContact O-N 3.16Å; Y48-N52 PolarHBondContact O-N 3.22Å; Y48-A104 HydrophobicContact CE2-CB 4.36Å; Y48-A104 WeakPolarHBondContact CE2-O 3.37Å; Y48-L107 HydrophobicContact CD2-CB 4.31Å; Y48-A108 HydrophobicContact CD2-CB 4.22Å; Y48-A108 HydrophobicContact CE2-CB 3.78Å; Y48-L112 HydrophobicContact CD1-CD1 3.7Å; Y48-L112 HydrophobicContact CD2-CD1 4.15Å; Y48-L112 HydrophobicContact CE1-CD1 4.45Å; Y48-L112 HydrophobicContact CG-CD1 3.51Å
49	G	98.4	Very high	98.4	Very high	29 Å²	29	69.3 Å²	69.3	30%	0.299	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-44.1	177.9	0	0	0	0	0	112.2	Q45 R46 Q51 N52 E53	Q45-G49 PolarHBondContact O-N 2.83Å; R46-G49 PolarHBondContact O-N 3.45Å; G49-Q51 VanDerWaalsContact C-N 3.35Å; G49-Q51 PolarHBondContact O-N 3.27Å; G49-N52 PolarHBondContact O-N 3.02Å; G49-E53 PolarHBondContact O-N 3.45Å
50	A	98.8	Very high	98.4	Very high	65 Å²	65	69.8 Å²	69.8	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-62.6	-40.3	175.4	0	0	0	0	0	112.6	R46 V47 Y48 N52 E53 M54	R46-A50 WeakPolarHBondContact O-CB 3.24Å; R46-A50 PolarHBondContact O-N 3.4Å; V47-A50 PolarHBondContact O-N 2.93Å; Y48-A50 VanDerWaalsContact C-N 3.34Å; Y48-A50 PolarHBondContact O-N 3.39Å; A50-N52 VanDerWaalsContact C-N 3.33Å; A50-E53 PolarHBondContact O-N 2.92Å; A50-M54 PolarHBondContact O-N 3.28Å
51	Q	98.6	Very high	98.4	Very high	26 Å²	26	72 Å²	72	12%	0.121	38%	0.375	C	S	.	.	H	α-helix	trans	-64.2	-39.1	175.3	-179.1	64.5	23.6	0	0	111.8	V47 Y48 G49 M54 C55 H100 L103 A104 L107	V47-Q51 PolarHBondContact O-N 2.88Å; Y48-Q51 WeakPolarHBondContact O-CB 3.48Å; Y48-Q51 PolarHBondContact O-N 2.82Å; Y48-Q51 VanDerWaalsContact O-N 3.16Å; G49-Q51 VanDerWaalsContact C-N 3.35Å; G49-Q51 PolarHBondContact O-N 3.27Å; Q51-M54 WeakPolarHBondContact O-CB 3.34Å; Q51-M54 PolarHBondContact O-N 2.95Å; Q51-C55 PolarHBondContact O-N 3.23Å; Q51-C55 PolarHBondContact O-SG 2.84Å; Q51-H100 VanDerWaalsContact NE2-CA 3.27Å; Q51-H100 PolarHBondContact NE2-ND1 2.78Å; Q51-H100 PolarHBondContact NE2-O 3.46Å; Q51-L103 HydrophobicContact CG-CD2 4.47Å; Q51-L103 HydrophobicContact CG-CG 4.29Å; Q51-A104 HydrophobicContact CG-CB 3.87Å; Q51-L107 HydrophobicContact CB-CD1 4.14Å; Q51-L107 HydrophobicContact CG-CD1 4.13Å
52	N	97.8	Very high	98.5	Very high	60 Å²	60	71.4 Å²	71.4	32%	0.321	37%	0.372	S	S	.	.	H	α-helix	trans	-68.2	-40.1	177.4	-168.9	72.7	0	0	0	112.1	Y48 G49 A50 M54 C55 L56	Y48-N52 PolarHBondContact O-N 3.22Å; G49-N52 PolarHBondContact O-N 3.02Å; A50-N52 VanDerWaalsContact C-N 3.33Å; N52-M54 VanDerWaalsContact C-N 3.28Å; N52-M54 PolarHBondContact O-N 3.04Å; N52-C55 VanDerWaalsContact O-CB 3.25Å; N52-C55 WeakPolarHBondContact O-CB 3.36Å; N52-C55 PolarHBondContact O-N 3.48Å; N52-C55 VanDerWaalsContact O-N 3.12Å; N52-L56 PolarHBondContact O-N 3.45Å
53	E	98.6	Very high	98.4	Very high	117 Å²	117	73 Å²	73	55%	0.547	38%	0.378	S	S	.	.	H	α-helix	trans	-61.9	-36.3	172.7	-75.1	-58.1	140.1	0	0	112.2	G49 A50 C55 L56 A57	G49-E53 PolarHBondContact O-N 3.45Å; A50-E53 PolarHBondContact O-N 2.92Å; E53-C55 VanDerWaalsContact C-N 3.28Å; E53-C55 PolarHBondContact O-N 3.46Å; E53-L56 PolarHBondContact O-N 2.88Å; E53-L56 VanDerWaalsContact O-N 3.14Å; E53-A57 WeakPolarHBondContact O-CB 3.42Å; E53-A57 PolarHBondContact O-N 3.37Å
54	M	98.6	Very high	98.4	Very high	80 Å²	80	76.5 Å²	76.5	39%	0.394	39%	0.385	S	S	.	.	H	α-helix	trans	-62.6	-35.1	173.6	-171.3	61.8	-179.3	0	0	112.3	A50 Q51 N52 T58 H100	A50-M54 PolarHBondContact O-N 3.28Å; Q51-M54 WeakPolarHBondContact O-CB 3.34Å; Q51-M54 PolarHBondContact O-N 2.95Å; N52-M54 VanDerWaalsContact C-N 3.28Å; N52-M54 PolarHBondContact O-N 3.04Å; M54-T58 HydrophobicContact CE-CG2 3.86Å; M54-T58 WeakPolarHBondContact O-CG2 3.47Å; M54-T58 PolarHBondContact O-N 3.36Å; M54-T58 PolarHBondContact O-OG1 3.18Å; M54-T58 HydrophobicContact SD-CG2 4.38Å; M54-H100 WeakPolarHBondContact CG-CE1 3.49Å
55	C	98.5	Very high	98.4	Very high	9 Å²	9	77.5 Å²	77.5	6%	0.061	39%	0.39	C	S	.	.	H	α-helix	trans	-60.3	-50.1	170.3	-60.4	0	0	0	0	110.8	Q51 N52 E53 A57 T58 Q59 N97 T101	Q51-C55 PolarHBondContact O-N 3.23Å; Q51-C55 PolarHBondContact O-SG 2.84Å; N52-C55 VanDerWaalsContact O-CB 3.25Å; N52-C55 WeakPolarHBondContact O-CB 3.36Å; N52-C55 PolarHBondContact O-N 3.48Å; N52-C55 VanDerWaalsContact O-N 3.12Å; E53-C55 VanDerWaalsContact C-N 3.28Å; E53-C55 PolarHBondContact O-N 3.46Å; C55-A57 PolarHBondContact O-N 2.85Å; C55-T58 PolarHBondContact O-N 2.94Å; C55-T58 PolarHBondContact O-OG1 3.45Å; C55-Q59 WeakPolarHBondContact O-CB 3.49Å; C55-Q59 PolarHBondContact O-N 3.34Å; C55-N97 PolarHBondContact O-ND2 2.81Å; C55-T101 PolarHBondContact SG-N 3.22Å; C55-T101 VanDerWaalsContact SG-N 3.42Å
56	L	98.3	Very high	98.3	Very high	80 Å²	80	76.1 Å²	76.1	42%	0.419	39%	0.386	S	S	.	.	H	α-helix	trans	-62.1	-43.3	-179.2	-62.3	178.3	0	0	0	112.1	N52 E53 Q59 Q60	N52-L56 PolarHBondContact O-N 3.45Å; E53-L56 PolarHBondContact O-N 2.88Å; E53-L56 VanDerWaalsContact O-N 3.14Å; L56-Q59 PolarHBondContact O-N 3.38Å; L56-Q60 WeakPolarHBondContact O-CB 3.43Å; L56-Q60 PolarHBondContact O-N 3.26Å
57	A	98.7	Very high	98.1	Very high	54 Å²	54	67.3 Å²	67.3	45%	0.446	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-44.8	179.7	0	0	0	0	0	112.4	E53 C55 Q60 L61	E53-A57 WeakPolarHBondContact O-CB 3.42Å; E53-A57 PolarHBondContact O-N 3.37Å; C55-A57 PolarHBondContact O-N 2.85Å; A57-Q60 PolarHBondContact O-N 3.01Å; A57-L61 WeakPolarHBondContact O-CB 3.39Å; A57-L61 PolarHBondContact O-N 3.23Å
58	T	98.1	Very high	98	Very high	6 Å²	6	67.9 Å²	67.9	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-68.2	-37.8	178.5	48.9	0	0	0	0	112.3	M54 C55 L61 S62 N97	M54-T58 HydrophobicContact CE-CG2 3.86Å; M54-T58 WeakPolarHBondContact O-CG2 3.47Å; M54-T58 PolarHBondContact O-N 3.36Å; M54-T58 PolarHBondContact O-OG1 3.18Å; M54-T58 HydrophobicContact SD-CG2 4.38Å; C55-T58 PolarHBondContact O-N 2.94Å; C55-T58 PolarHBondContact O-OG1 3.45Å; T58-L61 PolarHBondContact O-N 3.13Å; T58-S62 PolarHBondContact O-N 3.3Å; T58-N97 PolarHBondContact OG1-ND2 3.07Å
59	Q	97.9	Very high	97.6	Very high	115 Å²	115	69.3 Å²	69.3	54%	0.537	36%	0.362	S	S	.	.	H	α-helix	trans	-62.1	-45.1	173.7	-172.9	-179.3	17.4	0	0	111.3	C55 L56 S62 K63 N97	C55-Q59 WeakPolarHBondContact O-CB 3.49Å; C55-Q59 PolarHBondContact O-N 3.34Å; L56-Q59 PolarHBondContact O-N 3.38Å; Q59-S62 PolarHBondContact O-N 2.99Å; Q59-K63 PolarHBondContact O-N 3.11Å; Q59-N97 PolarHBondContact N-ND2 2.97Å
60	Q	98.3	Very high	97.2	Very high	139 Å²	139	75.7 Å²	75.7	65%	0.65	38%	0.382	S	S	*	.	H	α-helix	trans	-64.7	-41.7	178.2	-176.5	176.7	2.2	0	0	111.6	L56 A57 K63 Q64	L56-Q60 WeakPolarHBondContact O-CB 3.43Å; L56-Q60 PolarHBondContact O-N 3.26Å; A57-Q60 PolarHBondContact O-N 3.01Å; Q60-K63 PolarHBondContact O-N 3.37Å; Q60-Q64 WeakPolarHBondContact O-CB 3.35Å; Q60-Q64 PolarHBondContact O-N 2.95Å
61	L	98.6	Very high	96.7	Very high	81 Å²	81	78 Å²	78	42%	0.424	38%	0.381	S	S	.	.	H	α-helix	trans	-60.2	-48.6	176.8	178.7	58.5	0	0	0	111.3	A57 T58 K63 Q64 L65 M93	A57-L61 WeakPolarHBondContact O-CB 3.39Å; A57-L61 PolarHBondContact O-N 3.23Å; T58-L61 PolarHBondContact O-N 3.13Å; L61-K63 VanDerWaalsContact C-N 3.34Å; L61-K63 PolarHBondContact O-N 3.29Å; L61-Q64 PolarHBondContact O-N 3.03Å; L61-Q64 VanDerWaalsContact O-N 3.12Å; L61-L65 HydrophobicContact CD1-CG 4.46Å; L61-L65 HydrophobicContact CG-CD1 4.47Å; L61-L65 WeakPolarHBondContact O-CG 3.45Å; L61-L65 PolarHBondContact O-N 3.22Å; L61-M93 HydrophobicContact CD2-CE 4.39Å; L61-M93 HydrophobicContact CD2-CG 4.23Å; L61-M93 HydrophobicContact CD2-SD 3.8Å; L61-M93 HydrophobicContact CG-CG 4.43Å
62	S	98.5	Very high	96	Very high	2 Å²	2	82.6 Å²	82.6	1%	0.014	41%	0.407	C	S	.	.	H	α-helix	trans	-56	-48.4	175.9	-178.9	0	0	0	0	111.8	T58 Q59 Q64 L65 L66 S90 D94	T58-S62 PolarHBondContact O-N 3.3Å; Q59-S62 PolarHBondContact O-N 2.99Å; S62-Q64 VanDerWaalsContact C-N 3.28Å; S62-Q64 PolarHBondContact O-N 3.5Å; S62-L65 PolarHBondContact O-N 3.38Å; S62-L66 PolarHBondContact O-N 3.46Å; S62-S90 PolarHBondContact OG-O 3.38Å; S62-S90 PolarHBondContact OG-OG 2.95Å; S62-D94 WeakPolarHBondContact CB-OD1 3.43Å; S62-D94 PolarHBondContact OG-OD1 2.9Å; S62-D94 PolarHBondContact OG-OD2 3.41Å
63	K	97.9	Very high	95.3	Very high	162 Å²	162	84 Å²	84	70%	0.704	41%	0.41	S	S	*	.	H	α-helix	trans	-58.2	-39.4	176.5	-177.8	178.3	178.1	-177.7	0	112.5	Q59 Q60 L61 L66 A67	Q59-K63 PolarHBondContact O-N 3.11Å; Q60-K63 PolarHBondContact O-N 3.37Å; L61-K63 VanDerWaalsContact C-N 3.34Å; L61-K63 PolarHBondContact O-N 3.29Å; K63-L66 PolarHBondContact O-N 3.27Å; K63-A67 PolarHBondContact O-N 2.97Å; K63-A67 VanDerWaalsContact O-N 3.09Å
64	Q	98.1	Very high	94.3	Very high	126 Å²	126	83.8 Å²	83.8	59%	0.589	43%	0.428	S	S	*	.	H	α-helix	trans	-70.2	-35.6	-179.9	-170.2	61.1	32.5	0	0	112.2	Q60 L61 S62 A67	Q60-Q64 WeakPolarHBondContact O-CB 3.35Å; Q60-Q64 PolarHBondContact O-N 2.95Å; L61-Q64 PolarHBondContact O-N 3.03Å; L61-Q64 VanDerWaalsContact O-N 3.12Å; S62-Q64 VanDerWaalsContact C-N 3.28Å; S62-Q64 PolarHBondContact O-N 3.5Å; Q64-A67 WeakPolarHBondContact O-CB 3.38Å; Q64-A67 PolarHBondContact O-N 2.92Å
65	L	98	Very high	93	Very high	35 Å²	35	88.7 Å²	88.7	18%	0.183	46%	0.455	C	S	.	.	H	α-helix	trans	-62.8	-44.5	174.6	-66.1	171.2	0	0	0	111.1	L61 S62 A67 Y68 L86 F89 M93	L61-L65 HydrophobicContact CD1-CG 4.46Å; L61-L65 HydrophobicContact CG-CD1 4.47Å; L61-L65 WeakPolarHBondContact O-CG 3.45Å; L61-L65 PolarHBondContact O-N 3.22Å; S62-L65 PolarHBondContact O-N 3.38Å; L65-A67 PolarHBondContact O-N 3.3Å; L65-Y68 WeakPolarHBondContact O-CB 3.49Å; L65-Y68 PolarHBondContact O-N 3.45Å; L65-L86 HydrophobicContact CD2-CD2 3.73Å; L65-F89 HydrophobicContact CD1-CB 4.02Å; L65-M93 HydrophobicContact CD1-CG 4.23Å
66	L	96.7	Very high	91.5	Very high	63 Å²	63	90.3 Å²	90.3	33%	0.33	47%	0.473	S	S	.	.	H	α-helix	trans	-67.8	-23.5	175.5	-62.5	178.3	0	0	0	113.4	S62 K63 Y68 H87 S90	S62-L66 PolarHBondContact O-N 3.46Å; K63-L66 PolarHBondContact O-N 3.27Å; L66-Y68 PolarHBondContact O-N 3.5Å; L66-H87 VanDerWaalsContact CD2-CD2 3.47Å; L66-H87 WeakPolarHBondContact CD2-CD2 3.34Å; L66-S90 WeakPolarHBondContact CD2-OG 3.49Å; L66-S90 VanDerWaalsContact CG-OG 3.25Å; L66-S90 WeakPolarHBondContact CG-OG 3.22Å
67	A	95.6	Very high	90.3	Very high	23 Å²	23	96 Å²	96	19%	0.19	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.6	178.6	0	0	0	0	0	112.6	K63 Q64 L65 K70 Q71	K63-A67 PolarHBondContact O-N 2.97Å; K63-A67 VanDerWaalsContact O-N 3.09Å; Q64-A67 WeakPolarHBondContact O-CB 3.38Å; Q64-A67 PolarHBondContact O-N 2.92Å; L65-A67 PolarHBondContact O-N 3.3Å; A67-K70 PolarHBondContact O-N 3.47Å; A67-Q71 PolarHBondContact O-N 3.08Å
68	Y	94.8	Very high	89.1	Confident	79 Å²	79	94.2 Å²	94.2	31%	0.31	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-45.4	-179.9	-178.4	-95.2	0	0	0	112.8	L65 L66 K70 Q71 F73 V82 I83 L86	L65-Y68 WeakPolarHBondContact O-CB 3.49Å; L65-Y68 PolarHBondContact O-N 3.45Å; L66-Y68 PolarHBondContact O-N 3.5Å; Y68-K70 PolarHBondContact O-N 3.32Å; Y68-Q71 WeakPolarHBondContact O-CB 3.36Å; Y68-Q71 PolarHBondContact O-N 3.4Å; Y68-Q71 VanDerWaalsContact O-N 3.11Å; Y68-F73 HydrophobicContact CD2-CE2 4.45Å; Y68-F73 HydrophobicContact CD2-CZ 4.01Å; Y68-F73 HydrophobicContact CE1-CE2 4.32Å; Y68-F73 HydrophobicContact CE2-CE2 4.05Å; Y68-F73 AromaticContact CE2-CZ 3.56Å; Y68-F73 HydrophobicContact CE2-CZ 3.56Å; Y68-F73 AromaticContact CZ-CE2 3.98Å; Y68-F73 AromaticContact CZ-CZ 3.91Å; Y68-V82 HydrophobicContact CE1-CG1 4.02Å; Y68-I83 HydrophobicContact CD1-CG1 4Å; Y68-I83 HydrophobicContact CE1-CG1 3.98Å; Y68-L86 HydrophobicContact CD1-CD1 3.45Å; Y68-L86 VanDerWaalsContact CD1-CD1 3.45Å; Y68-L86 HydrophobicContact CD2-CD1 4.14Å; Y68-L86 HydrophobicContact CE1-CD1 4.04Å; Y68-L86 HydrophobicContact CG-CD1 3.5Å
69	E	91.5	Very high	88.5	Confident	105 Å²	105	98 Å²	98	49%	0.491	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-31.1	177.9	-177.5	-175.6	-148	0	0	112.1	Q71 I83 H87	E69-Q71 VanDerWaalsContact C-N 3.28Å; E69-Q71 PolarHBondContact O-N 2.93Å; E69-I83 HydrophobicContact CB-CG2 4.07Å; E69-I83 HydrophobicContact CG-CD1 4.44Å; E69-I83 HydrophobicContact CG-CG2 4.05Å; E69-H87 IonicContact OE1-CE1 2.79Å; E69-H87 IonicContact OE2-CE1 2.97Å; E69-H87 PolarHBondContact OE2-CE1 3.06Å; E69-H87 IonicContact OE2-NE2 3.63Å; E69-H87 PolarHBondContact OE2-NE2 2.92Å
70	K	88.9	Confident	88.1	Confident	163 Å²	163	98.3 Å²	98.3	71%	0.709	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.3	-178.7	-58.3	-178.8	-178.3	-179.5	0	113.3	A67 Y68	A67-K70 PolarHBondContact O-N 3.47Å; Y68-K70 PolarHBondContact O-N 3.32Å
71	Q	88.2	Confident	87.8	Confident	113 Å²	113	97.2 Å²	97.2	53%	0.528	50%	0.498	S	S	.	.	S	Bend	trans	-76.6	133.7	178.1	-70.5	-63.7	-32.9	0	0	110.8	A67 Y68 E69 F73	A67-Q71 PolarHBondContact O-N 3.08Å; Y68-Q71 WeakPolarHBondContact O-CB 3.36Å; Y68-Q71 PolarHBondContact O-N 3.4Å; Y68-Q71 VanDerWaalsContact O-N 3.11Å; E69-Q71 VanDerWaalsContact C-N 3.28Å; E69-Q71 PolarHBondContact O-N 2.93Å; Q71-F73 HydrophobicContact CB-CD2 4.3Å; Q71-F73 HydrophobicContact CB-CE1 4.31Å; Q71-F73 HydrophobicContact CB-CE2 3.67Å; Q71-F73 HydrophobicContact CB-CZ 3.68Å; Q71-F73 HydrophobicContact CG-CZ 4.43Å; Q71-F73 WeakPolarHBondContact O-CD2 3.42Å; Q71-F73 PolarHBondContact O-N 2.93Å
72	N	84.9	Confident	87.6	Confident	123 Å²	123	95.4 Å²	95.4	66%	0.658	49%	0.49	S	S	*	.			trans	-84.2	93.8	176.7	-70.8	-22	0	0	0	110.1	E569	N72-E569 PolarHBondContact ND2-OE1 3.17Å
73	F	83.7	Confident	87.5	Confident	90 Å²	90	95.8 Å²	95.8	40%	0.395	49%	0.492	S	S	.	.			trans	-82.5	121.2	173.8	-60.4	-74.3	0	0	0	110.8	Y68 Q71 L75 G76	Y68-F73 HydrophobicContact CD2-CE2 4.45Å; Y68-F73 HydrophobicContact CD2-CZ 4.01Å; Y68-F73 HydrophobicContact CE1-CE2 4.32Å; Y68-F73 HydrophobicContact CE2-CE2 4.05Å; Y68-F73 AromaticContact CE2-CZ 3.56Å; Y68-F73 HydrophobicContact CE2-CZ 3.56Å; Y68-F73 AromaticContact CZ-CE2 3.98Å; Y68-F73 AromaticContact CZ-CZ 3.91Å; Q71-F73 HydrophobicContact CB-CD2 4.3Å; Q71-F73 HydrophobicContact CB-CE1 4.31Å; Q71-F73 HydrophobicContact CB-CE2 3.67Å; Q71-F73 HydrophobicContact CB-CZ 3.68Å; Q71-F73 HydrophobicContact CG-CZ 4.43Å; Q71-F73 WeakPolarHBondContact O-CD2 3.42Å; Q71-F73 PolarHBondContact O-N 2.93Å; F73-L75 PolarHBondContact O-N 3.19Å; F73-L75 VanDerWaalsContact O-N 3.15Å; F73-G76 PolarHBondContact O-N 3.46Å; F73-G76 VanDerWaalsContact O-O 3.08Å
74	A	75.7	Confident	87.4	Confident	111 Å²	111	91.3 Å²	91.3	92%	0.917	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.9	-174.7	0	0	0	0	0	114.6
75	L	72.8	Confident	87.4	Confident	184 Å²	184	86.3 Å²	86.3	96%	0.963	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.2	-176.2	-64.8	175.3	0	0	0	113.5	F73	F73-L75 PolarHBondContact O-N 3.19Å; F73-L75 VanDerWaalsContact O-N 3.15Å
76	G	67.4	Low	87.4	Confident	43 Å²	43	86.4 Å²	86.4	44%	0.443	46%	0.459	S	S	.	.	S	Bend	trans	148.1	179.8	-177.8	0	0	0	0	0	112.4	F73	F73-G76 PolarHBondContact O-N 3.46Å; F73-G76 VanDerWaalsContact O-O 3.08Å
77	K	71.6	Confident	87.4	Confident	198 Å²	198	86.4 Å²	86.4	86%	0.861	46%	0.457	S	S	*	.	S	Bend	trans	-61.5	144.6	170.2	-66.5	-172.1	176.3	-170.8	0	109.4
78	G	73.9	Confident	87.5	Confident	17 Å²	17	89.8 Å²	89.8	18%	0.175	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-58.6	153.2	174.7	0	0	0	0	0	111.3	E80	G78-E80 PolarHBondContact O-N 3.42Å
79	D	86.1	Confident	87.7	Confident	85 Å²	85	88.4 Å²	88.4	46%	0.455	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-60.3	120.3	176.6	-173.5	-16.8	0	0	0	110.6	E81 V82 I83	D79-E81 PolarHBondContact O-N 2.83Å; D79-E81 PolarHBondContact OD1-N 2.96Å; D79-V82 HydrophobicContact CB-CB 4.15Å; D79-V82 HydrophobicContact CB-CG2 3.9Å; D79-V82 PolarHBondContact O-N 3Å; D79-V82 VanDerWaalsContact O-N 3.13Å; D79-I83 WeakPolarHBondContact O-CG1 3.48Å; D79-I83 PolarHBondContact O-N 3.24Å
80	E	89.9	Confident	88	Confident	123 Å²	123	83.6 Å²	83.6	58%	0.575	44%	0.439	S	S	*	.	H	α-helix	trans	-60.3	-32.1	-179.2	-66.8	-67.7	157.1	0	0	112.1	G78 S84	G78-E80 PolarHBondContact O-N 3.42Å; E80-S84 VanDerWaalsContact O-CB 3.29Å; E80-S84 WeakPolarHBondContact O-CB 3.42Å; E80-S84 PolarHBondContact O-N 2.95Å; E80-S84 PolarHBondContact O-OG 2.94Å
81	E	92.3	Very high	88.5	Confident	116 Å²	116	81.6 Å²	81.6	54%	0.542	43%	0.431	S	S	.	.	H	α-helix	trans	-68.3	-40	176.9	-64.9	-170.4	179.4	0	0	111	D79 S84 T85 M232	D79-E81 PolarHBondContact O-N 2.83Å; D79-E81 PolarHBondContact OD1-N 2.96Å; E81-S84 PolarHBondContact O-OG 2.89Å; E81-T85 VanDerWaalsContact O-CB 3.3Å; E81-T85 WeakPolarHBondContact O-CB 3.22Å; E81-T85 PolarHBondContact O-N 3.31Å; E81-T85 PolarHBondContact O-OG1 3.33Å; E81-M232 HydrophobicContact CB-CE 4.14Å
82	V	94.1	Very high	88.9	Confident	42 Å²	42	76.6 Å²	76.6	26%	0.255	41%	0.408	S	S	.	.	H	α-helix	trans	-69	-45.3	175.4	178.4	0	0	0	0	110.6	Y68 D79 T85 L86	Y68-V82 HydrophobicContact CE1-CG1 4.02Å; D79-V82 HydrophobicContact CB-CB 4.15Å; D79-V82 HydrophobicContact CB-CG2 3.9Å; D79-V82 PolarHBondContact O-N 3Å; D79-V82 VanDerWaalsContact O-N 3.13Å; V82-T85 PolarHBondContact O-N 2.92Å; V82-L86 HydrophobicContact CG1-CD1 3.9Å; V82-L86 HydrophobicContact CG1-CG 4.33Å; V82-L86 WeakPolarHBondContact O-CB 3.5Å; V82-L86 VanDerWaalsContact O-CG 3.27Å; V82-L86 WeakPolarHBondContact O-CG 3.4Å; V82-L86 PolarHBondContact O-N 3.31Å
83	I	94.9	Very high	89.6	Confident	10 Å²	10	72.7 Å²	72.7	5%	0.051	39%	0.387	C	S	.	.	H	α-helix	trans	-59.7	-49.8	178.7	-68.8	164.8	0	0	0	110.6	Y68 E69 D79 T85 L86 H87	Y68-I83 HydrophobicContact CD1-CG1 4Å; Y68-I83 HydrophobicContact CE1-CG1 3.98Å; E69-I83 HydrophobicContact CB-CG2 4.07Å; E69-I83 HydrophobicContact CG-CD1 4.44Å; E69-I83 HydrophobicContact CG-CG2 4.05Å; D79-I83 WeakPolarHBondContact O-CG1 3.48Å; D79-I83 PolarHBondContact O-N 3.24Å; I83-T85 VanDerWaalsContact C-N 3.32Å; I83-T85 PolarHBondContact O-N 3.3Å; I83-L86 PolarHBondContact O-N 2.85Å; I83-H87 PolarHBondContact O-N 3.48Å
84	S	96.4	Very high	90.2	Very high	68 Å²	68	72.2 Å²	72.2	48%	0.476	39%	0.388	S	S	.	.	H	α-helix	trans	-62.8	-37.8	179.2	59.6	0	0	0	0	112.7	E80 E81 H87 Y88	E80-S84 VanDerWaalsContact O-CB 3.29Å; E80-S84 WeakPolarHBondContact O-CB 3.42Å; E80-S84 PolarHBondContact O-N 2.95Å; E80-S84 PolarHBondContact O-OG 2.94Å; E81-S84 PolarHBondContact O-OG 2.89Å; S84-H87 PolarHBondContact O-N 2.78Å; S84-Y88 PolarHBondContact O-N 3.31Å
85	T	97.7	Very high	91.3	Very high	21 Å²	21	71.4 Å²	71.4	13%	0.129	37%	0.365	C	S	.	.	H	α-helix	trans	-63.9	-45.4	174	-61.4	0	0	0	0	111.6	E81 V82 I83 Y88 F89 F225 V229	E81-T85 VanDerWaalsContact O-CB 3.3Å; E81-T85 WeakPolarHBondContact O-CB 3.22Å; E81-T85 PolarHBondContact O-N 3.31Å; E81-T85 PolarHBondContact O-OG1 3.33Å; V82-T85 PolarHBondContact O-N 2.92Å; I83-T85 VanDerWaalsContact C-N 3.32Å; I83-T85 PolarHBondContact O-N 3.3Å; T85-Y88 PolarHBondContact O-N 3.39Å; T85-F89 HydrophobicContact CG2-CD2 3.87Å; T85-F89 HydrophobicContact CG2-CE2 3.65Å; T85-F89 VanDerWaalsContact O-CD2 3.26Å; T85-F89 WeakPolarHBondContact O-CD2 3.47Å; T85-F89 PolarHBondContact O-N 2.95Å; T85-F225 HydrophobicContact CG2-CZ 4.23Å; T85-V229 HydrophobicContact CG2-CG1 4.18Å; T85-V229 HydrophobicContact CG2-CG2 3.83Å
86	L	97.9	Very high	92.5	Very high	37 Å²	37	63.8 Å²	63.8	19%	0.194	33%	0.325	C	S	.	.	H	α-helix	trans	-64.9	-38.4	177	-69.6	171.9	0	0	0	112.3	L65 Y68 V82 I83 Y88 F89 S90	L65-L86 HydrophobicContact CD2-CD2 3.73Å; Y68-L86 HydrophobicContact CD1-CD1 3.45Å; Y68-L86 VanDerWaalsContact CD1-CD1 3.45Å; Y68-L86 HydrophobicContact CD2-CD1 4.14Å; Y68-L86 HydrophobicContact CE1-CD1 4.04Å; Y68-L86 HydrophobicContact CG-CD1 3.5Å; V82-L86 HydrophobicContact CG1-CD1 3.9Å; V82-L86 HydrophobicContact CG1-CG 4.33Å; V82-L86 WeakPolarHBondContact O-CB 3.5Å; V82-L86 VanDerWaalsContact O-CG 3.27Å; V82-L86 WeakPolarHBondContact O-CG 3.4Å; V82-L86 PolarHBondContact O-N 3.31Å; I83-L86 PolarHBondContact O-N 2.85Å; L86-Y88 VanDerWaalsContact C-N 3.34Å; L86-Y88 PolarHBondContact O-N 3.18Å; L86-F89 PolarHBondContact O-N 3.3Å; L86-S90 WeakPolarHBondContact O-CB 3.38Å; L86-S90 PolarHBondContact O-N 3.48Å
87	H	97.6	Very high	94	Very high	63 Å²	63	63 Å²	63	29%	0.292	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-42.6	172.7	-77.3	-177.2	0	0	0	111.9	L66 E69 I83 S84 S90 K91	L66-H87 VanDerWaalsContact CD2-CD2 3.47Å; L66-H87 WeakPolarHBondContact CD2-CD2 3.34Å; E69-H87 IonicContact OE1-CE1 2.79Å; E69-H87 IonicContact OE2-CE1 2.97Å; E69-H87 PolarHBondContact OE2-CE1 3.06Å; E69-H87 IonicContact OE2-NE2 3.63Å; E69-H87 PolarHBondContact OE2-NE2 2.92Å; I83-H87 PolarHBondContact O-N 3.48Å; S84-H87 PolarHBondContact O-N 2.78Å; H87-S90 PolarHBondContact O-N 3.43Å; H87-K91 PolarHBondContact O-N 2.96Å
88	Y	97.9	Very high	95.3	Very high	95 Å²	95	55.5 Å²	55.5	37%	0.373	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-45	176.2	-169.3	-94.6	0	0	0	111.6	S84 T85 L86 S90 K91 V92 M222 F225	S84-Y88 PolarHBondContact O-N 3.31Å; T85-Y88 PolarHBondContact O-N 3.39Å; L86-Y88 VanDerWaalsContact C-N 3.34Å; L86-Y88 PolarHBondContact O-N 3.18Å; Y88-S90 PolarHBondContact O-N 3.34Å; Y88-K91 WeakPolarHBondContact O-CB 3.45Å; Y88-K91 PolarHBondContact O-N 3.45Å; Y88-V92 HydrophobicContact CD1-CG2 4.18Å; Y88-V92 HydrophobicContact CE1-CG2 3.96Å; Y88-V92 WeakPolarHBondContact O-CG2 3.4Å; Y88-V92 PolarHBondContact O-N 3.25Å; Y88-V92 VanDerWaalsContact O-N 3.08Å; Y88-M222 HydrophobicContact CE1-CE 3.88Å; Y88-M222 HydrophobicContact CE1-SD 4.21Å; Y88-F225 AromaticContact CD1-CD1 3.81Å; Y88-F225 HydrophobicContact CD1-CD1 3.81Å; Y88-F225 HydrophobicContact CD1-CD2 4.06Å; Y88-F225 AromaticContact CD1-CE1 3.37Å; Y88-F225 HydrophobicContact CD1-CE1 3.37Å; Y88-F225 AromaticContact CD1-CE2 3.64Å; Y88-F225 HydrophobicContact CD1-CE2 3.64Å; Y88-F225 HydrophobicContact CD1-CG 4.13Å; Y88-F225 AromaticContact CD1-CZ 3.27Å; Y88-F225 HydrophobicContact CD1-CZ 3.27Å; Y88-F225 AromaticContact CE1-CD1 3.62Å; Y88-F225 HydrophobicContact CE1-CD1 3.62Å; Y88-F225 HydrophobicContact CE1-CD2 4.02Å; Y88-F225 AromaticContact CE1-CE1 3.7Å; Y88-F225 HydrophobicContact CE1-CE1 3.7Å; Y88-F225 HydrophobicContact CE1-CE2 4.09Å; Y88-F225 AromaticContact CE1-CG 3.78Å; Y88-F225 HydrophobicContact CE1-CG 3.78Å; Y88-F225 AromaticContact CE1-CZ 3.94Å; Y88-F225 HydrophobicContact CE1-CZ 3.94Å; Y88-F225 HydrophobicContact CG-CE1 4.45Å; Y88-F225 HydrophobicContact CG-CE2 4.08Å; Y88-F225 AromaticContact CG-CZ 3.95Å; Y88-F225 HydrophobicContact CG-CZ 3.95Å
89	F	98.4	Very high	96.5	Very high	50 Å²	50	55.7 Å²	55.7	22%	0.219	29%	0.286	C	S	.	.	H	α-helix	trans	-61.4	-40	174.5	-81.1	-64.1	0	0	0	113	L65 T85 L86 K91 V92 M93 F225 L226 V229	L65-F89 HydrophobicContact CD1-CB 4.02Å; T85-F89 HydrophobicContact CG2-CD2 3.87Å; T85-F89 HydrophobicContact CG2-CE2 3.65Å; T85-F89 VanDerWaalsContact O-CD2 3.26Å; T85-F89 WeakPolarHBondContact O-CD2 3.47Å; T85-F89 PolarHBondContact O-N 2.95Å; L86-F89 PolarHBondContact O-N 3.3Å; F89-K91 VanDerWaalsContact C-N 3.33Å; F89-K91 PolarHBondContact O-N 3.25Å; F89-V92 PolarHBondContact O-N 3.45Å; F89-M93 VanDerWaalsContact O-CG 3.32Å; F89-M93 WeakPolarHBondContact O-CG 3.43Å; F89-M93 PolarHBondContact O-N 2.77Å; F89-F225 HydrophobicContact CD1-CE1 4.46Å; F89-F225 HydrophobicContact CD2-CE1 4.48Å; F89-F225 AromaticContact CE1-CE1 3.95Å; F89-F225 HydrophobicContact CE1-CE1 3.95Å; F89-F225 AromaticContact CE2-CE1 3.97Å; F89-F225 HydrophobicContact CE2-CE1 3.97Å; F89-F225 HydrophobicContact CE2-CZ 4.15Å; F89-F225 AromaticContact CZ-CE1 3.69Å; F89-F225 HydrophobicContact CZ-CE1 3.69Å; F89-F225 HydrophobicContact CZ-CZ 4.33Å; F89-L226 HydrophobicContact CE1-CD2 3.71Å; F89-L226 HydrophobicContact CZ-CD2 3.76Å; F89-V229 HydrophobicContact CE2-CG1 4.38Å
90	S	98.4	Very high	97.1	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-45.8	174.3	165.4	0	0	0	0	111.3	S62 L66 L86 H87 Y88 V92 M93 D94	S62-S90 PolarHBondContact OG-O 3.38Å; S62-S90 PolarHBondContact OG-OG 2.95Å; L66-S90 WeakPolarHBondContact CD2-OG 3.49Å; L66-S90 VanDerWaalsContact CG-OG 3.25Å; L66-S90 WeakPolarHBondContact CG-OG 3.22Å; L86-S90 WeakPolarHBondContact O-CB 3.38Å; L86-S90 PolarHBondContact O-N 3.48Å; H87-S90 PolarHBondContact O-N 3.43Å; Y88-S90 PolarHBondContact O-N 3.34Å; S90-V92 VanDerWaalsContact C-N 3.33Å; S90-V92 PolarHBondContact O-N 3.13Å; S90-M93 WeakPolarHBondContact O-CB 3.35Å; S90-M93 PolarHBondContact O-N 2.97Å; S90-M93 VanDerWaalsContact O-N 3.09Å; S90-D94 PolarHBondContact O-N 2.83Å
91	K	97.9	Very high	97.5	Very high	121 Å²	121	49.7 Å²	49.7	53%	0.526	26%	0.26	S	S	.	.	H	α-helix	trans	-59.9	-42.8	176.4	-173.5	-178	175.5	-174.7	0	112.3	H87 Y88 F89 M93 D94 E95	H87-K91 PolarHBondContact O-N 2.96Å; Y88-K91 WeakPolarHBondContact O-CB 3.45Å; Y88-K91 PolarHBondContact O-N 3.45Å; F89-K91 VanDerWaalsContact C-N 3.33Å; F89-K91 PolarHBondContact O-N 3.25Å; K91-M93 VanDerWaalsContact C-N 3.31Å; K91-M93 PolarHBondContact O-N 3.04Å; K91-D94 PolarHBondContact O-N 3.26Å; K91-E95 WeakPolarHBondContact CE-OE1 3.49Å; K91-E95 WeakPolarHBondContact O-CG 3.32Å; K91-E95 PolarHBondContact O-N 2.76Å
92	V	98.1	Very high	97.8	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-40.9	175.1	175.7	0	0	0	0	111.1	Y88 F89 S90 E95 L96 F218 M222	Y88-V92 HydrophobicContact CD1-CG2 4.18Å; Y88-V92 HydrophobicContact CE1-CG2 3.96Å; Y88-V92 WeakPolarHBondContact O-CG2 3.4Å; Y88-V92 PolarHBondContact O-N 3.25Å; Y88-V92 VanDerWaalsContact O-N 3.08Å; F89-V92 PolarHBondContact O-N 3.45Å; S90-V92 VanDerWaalsContact C-N 3.33Å; S90-V92 PolarHBondContact O-N 3.13Å; V92-E95 PolarHBondContact O-N 3.2Å; V92-L96 WeakPolarHBondContact O-CB 3.31Å; V92-L96 PolarHBondContact O-N 3Å; V92-F218 HydrophobicContact CG1-CE1 3.93Å; V92-F218 HydrophobicContact CG1-CZ 4.27Å; V92-M222 HydrophobicContact CB-CE 4.44Å; V92-M222 HydrophobicContact CG1-CE 4.14Å; V92-M222 HydrophobicContact CG2-CE 3.38Å; V92-M222 HydrophobicContact CG2-SD 4.39Å
93	M	98.2	Very high	98	Very high	41 Å²	41	45.8 Å²	45.8	20%	0.202	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-37.4	176.4	-68.8	-62	150.5	0	0	112.5	L61 L65 F89 S90 K91 L96 N97	L61-M93 HydrophobicContact CD2-CE 4.39Å; L61-M93 HydrophobicContact CD2-CG 4.23Å; L61-M93 HydrophobicContact CD2-SD 3.8Å; L61-M93 HydrophobicContact CG-CG 4.43Å; L65-M93 HydrophobicContact CD1-CG 4.23Å; F89-M93 VanDerWaalsContact O-CG 3.32Å; F89-M93 WeakPolarHBondContact O-CG 3.43Å; F89-M93 PolarHBondContact O-N 2.77Å; S90-M93 WeakPolarHBondContact O-CB 3.35Å; S90-M93 PolarHBondContact O-N 2.97Å; S90-M93 VanDerWaalsContact O-N 3.09Å; K91-M93 VanDerWaalsContact C-N 3.31Å; K91-M93 PolarHBondContact O-N 3.04Å; M93-L96 PolarHBondContact O-N 2.98Å; M93-L96 HydrophobicContact SD-CD2 4.45Å; M93-N97 WeakPolarHBondContact O-CB 3.48Å; M93-N97 PolarHBondContact O-N 3.5Å
94	D	98.1	Very high	98.2	Very high	79 Å²	79	45.6 Å²	45.6	42%	0.422	24%	0.239	S	C	.	.	H	α-helix	trans	-66.3	-42.3	174.8	-74.1	-16.8	0	0	0	112	S62 S90 K91 N97 G98	S62-D94 WeakPolarHBondContact CB-OD1 3.43Å; S62-D94 PolarHBondContact OG-OD1 2.9Å; S62-D94 PolarHBondContact OG-OD2 3.41Å; S90-D94 PolarHBondContact O-N 2.83Å; K91-D94 PolarHBondContact O-N 3.26Å; D94-N97 WeakPolarHBondContact O-CB 3.49Å; D94-N97 PolarHBondContact O-N 3.41Å; D94-G98 PolarHBondContact O-N 2.9Å
95	E	97.9	Very high	98.3	Very high	95 Å²	95	48.3 Å²	48.3	44%	0.444	24%	0.242	S	C	.	.	H	α-helix	trans	-63.6	-43	175.4	-67.5	-179	-157.3	0	0	111	K91 V92 G98 L99 M217	K91-E95 WeakPolarHBondContact CE-OE1 3.49Å; K91-E95 WeakPolarHBondContact O-CG 3.32Å; K91-E95 PolarHBondContact O-N 2.76Å; V92-E95 PolarHBondContact O-N 3.2Å; E95-G98 PolarHBondContact O-N 3.35Å; E95-L99 PolarHBondContact O-N 2.93Å; E95-M217 VanDerWaalsContact C-CE 3.46Å; E95-M217 HydrophobicContact CB-CE 3.54Å; E95-M217 HydrophobicContact CB-SD 4.23Å
96	L	98.5	Very high	98.3	Very high	24 Å²	24	49.2 Å²	49.2	13%	0.126	25%	0.245	C	C	.	.	H	α-helix	trans	-63.1	-42	175.6	178.1	59.3	0	0	0	111.8	V92 M93 G98 L99 H100 M217 F218	V92-L96 WeakPolarHBondContact O-CB 3.31Å; V92-L96 PolarHBondContact O-N 3Å; M93-L96 PolarHBondContact O-N 2.98Å; M93-L96 HydrophobicContact SD-CD2 4.45Å; L96-G98 VanDerWaalsContact C-N 3.27Å; L96-G98 PolarHBondContact O-N 2.92Å; L96-L99 WeakPolarHBondContact O-CB 3.24Å; L96-L99 PolarHBondContact O-N 3.4Å; L96-L99 VanDerWaalsContact O-N 3.13Å; L96-H100 PolarHBondContact O-CD2 3.24Å; L96-H100 VanDerWaalsContact O-CD2 3.31Å; L96-H100 PolarHBondContact O-N 3.34Å; L96-M217 HydrophobicContact CB-SD 4.08Å; L96-F218 HydrophobicContact CD1-CE2 4.17Å; L96-F218 HydrophobicContact CD2-CZ 4.21Å
97	N	98.6	Very high	98.3	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.144	24%	0.236	C	C	.	.	H	α-helix	trans	-56.3	-43.7	172.6	179	-73.5	0	0	0	111.3	C55 T58 Q59 M93 D94 L99 H100 T101	C55-N97 PolarHBondContact O-ND2 2.81Å; T58-N97 PolarHBondContact OG1-ND2 3.07Å; Q59-N97 PolarHBondContact N-ND2 2.97Å; M93-N97 WeakPolarHBondContact O-CB 3.48Å; M93-N97 PolarHBondContact O-N 3.5Å; D94-N97 WeakPolarHBondContact O-CB 3.49Å; D94-N97 PolarHBondContact O-N 3.41Å; N97-L99 VanDerWaalsContact C-N 3.29Å; N97-L99 PolarHBondContact O-N 3.06Å; N97-H100 PolarHBondContact O-N 3.25Å; N97-H100 VanDerWaalsContact O-N 3.12Å; N97-T101 WeakPolarHBondContact O-CB 3.44Å; N97-T101 PolarHBondContact O-N 3.49Å; N97-T101 PolarHBondContact O-OG1 3.31Å; N97-T101 PolarHBondContact OD1-OG1 3.38Å
98	G	98.4	Very high	98.3	Very high	39 Å²	39	45.7 Å²	45.7	40%	0.402	23%	0.232	S	C	.	.	H	α-helix	trans	-56.2	-42.1	175.3	0	0	0	0	0	112.6	D94 E95 L96 T101 E102	D94-G98 PolarHBondContact O-N 2.9Å; E95-G98 PolarHBondContact O-N 3.35Å; L96-G98 VanDerWaalsContact C-N 3.27Å; L96-G98 PolarHBondContact O-N 2.92Å; G98-T101 PolarHBondContact O-N 3.4Å; G98-E102 PolarHBondContact O-N 2.74Å
99	L	98.6	Very high	98.4	Very high	22 Å²	22	45.1 Å²	45.1	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-43.4	174.1	-63	-172.7	0	0	0	112.5	E95 L96 N97 T101 E102 L103 F210 R213 M217	E95-L99 PolarHBondContact O-N 2.93Å; L96-L99 WeakPolarHBondContact O-CB 3.24Å; L96-L99 PolarHBondContact O-N 3.4Å; L96-L99 VanDerWaalsContact O-N 3.13Å; N97-L99 VanDerWaalsContact C-N 3.29Å; N97-L99 PolarHBondContact O-N 3.06Å; L99-T101 VanDerWaalsContact C-N 3.32Å; L99-T101 PolarHBondContact O-N 3.29Å; L99-E102 PolarHBondContact O-N 3.07Å; L99-L103 WeakPolarHBondContact O-CB 3.34Å; L99-L103 PolarHBondContact O-N 3.14Å; L99-F210 HydrophobicContact CB-CD2 3.96Å; L99-F210 HydrophobicContact CB-CE2 3.85Å; L99-R213 HydrophobicContact CD1-CB 4.03Å; L99-R213 HydrophobicContact CD2-CB 3.66Å; L99-R213 HydrophobicContact CD2-CG 4.4Å; L99-M217 HydrophobicContact CD1-CE 3.51Å; L99-M217 HydrophobicContact CD1-SD 4.46Å; L99-M217 HydrophobicContact CG-CE 3.85Å
100	H	98.8	Very high	98.4	Very high	16 Å²	16	45.4 Å²	45.4	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-40.3	177.6	-81.2	-73.7	0	0	0	112	Q51 M54 L96 N97 L103 A104 F210	Q51-H100 VanDerWaalsContact NE2-CA 3.27Å; Q51-H100 PolarHBondContact NE2-ND1 2.78Å; Q51-H100 PolarHBondContact NE2-O 3.46Å; M54-H100 WeakPolarHBondContact CG-CE1 3.49Å; L96-H100 PolarHBondContact O-CD2 3.24Å; L96-H100 VanDerWaalsContact O-CD2 3.31Å; L96-H100 PolarHBondContact O-N 3.34Å; N97-H100 PolarHBondContact O-N 3.25Å; N97-H100 VanDerWaalsContact O-N 3.12Å; H100-L103 PolarHBondContact O-N 3.45Å; H100-A104 WeakPolarHBondContact O-CB 3.16Å; H100-A104 PolarHBondContact O-N 3.47Å; H100-F210 AromaticContact CE1-CE2 3.8Å; H100-F210 AromaticContact CE1-CZ 3.42Å; H100-F210 VanDerWaalsContact CE1-CZ 3.42Å; H100-F210 WeakPolarHBondContact CE1-CZ 3.3Å; H100-F210 AromaticContact CG-CE2 3.95Å; H100-F210 AromaticContact ND1-CE2 3.75Å; H100-F210 AromaticContact ND1-CZ 3.83Å; H100-F210 AromaticContact NE2-CZ 3.73Å
101	T	98.6	Very high	98.4	Very high	66 Å²	66	45.5 Å²	45.5	41%	0.405	24%	0.241	S	C	.	.	H	α-helix	trans	-66.7	-43.6	179.5	-61.8	0	0	0	0	111.6	C55 N97 G98 L99 A104 K105	C55-T101 PolarHBondContact SG-N 3.22Å; C55-T101 VanDerWaalsContact SG-N 3.42Å; N97-T101 WeakPolarHBondContact O-CB 3.44Å; N97-T101 PolarHBondContact O-N 3.49Å; N97-T101 PolarHBondContact O-OG1 3.31Å; N97-T101 PolarHBondContact OD1-OG1 3.38Å; G98-T101 PolarHBondContact O-N 3.4Å; L99-T101 VanDerWaalsContact C-N 3.32Å; L99-T101 PolarHBondContact O-N 3.29Å; T101-A104 PolarHBondContact O-N 2.77Å; T101-K105 PolarHBondContact O-N 2.84Å
102	E	98.5	Very high	98.4	Very high	73 Å²	73	40.4 Å²	40.4	34%	0.341	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-42.5	174.1	-179.2	58.9	-154.1	0	0	111.3	G98 L99 K105 Q106	G98-E102 PolarHBondContact O-N 2.74Å; L99-E102 PolarHBondContact O-N 3.07Å; E102-K105 PolarHBondContact O-N 3.11Å; E102-Q106 WeakPolarHBondContact O-CG 3.36Å; E102-Q106 PolarHBondContact O-N 3.32Å; E102-Q106 PolarHBondContact OE1-NE2 3.33Å
103	L	98.7	Very high	98.3	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-45.7	174.7	176.1	58.9	0	0	0	111.4	Q51 L99 H100 K105 Q106 L107 G206 F210	Q51-L103 HydrophobicContact CG-CD2 4.47Å; Q51-L103 HydrophobicContact CG-CG 4.29Å; L99-L103 WeakPolarHBondContact O-CB 3.34Å; L99-L103 PolarHBondContact O-N 3.14Å; H100-L103 PolarHBondContact O-N 3.45Å; L103-K105 VanDerWaalsContact C-N 3.3Å; L103-K105 PolarHBondContact O-N 3.46Å; L103-Q106 PolarHBondContact O-N 3.33Å; L103-L107 HydrophobicContact CD1-CD1 4.39Å; L103-L107 HydrophobicContact CD1-CD2 4.29Å; L103-L107 HydrophobicContact CD1-CG 4.02Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 HydrophobicContact CG-CG 4.33Å; L103-L107 VanDerWaalsContact O-CG 3.31Å; L103-L107 WeakPolarHBondContact O-CG 3.27Å; L103-L107 PolarHBondContact O-N 2.89Å; L103-G206 VanDerWaalsContact CD1-C 3.48Å; L103-F210 HydrophobicContact CB-CB 4.34Å; L103-F210 HydrophobicContact CB-CD2 3.97Å; L103-F210 HydrophobicContact CB-CG 4.41Å; L103-F210 HydrophobicContact CD1-CB 4.36Å; L103-F210 HydrophobicContact CD2-CB 3.84Å; L103-F210 HydrophobicContact CD2-CD1 4.11Å; L103-F210 HydrophobicContact CD2-CD2 3.77Å; L103-F210 HydrophobicContact CD2-CE2 4.38Å; L103-F210 HydrophobicContact CD2-CG 3.62Å; L103-F210 HydrophobicContact CG-CB 4.41Å; L103-F210 HydrophobicContact CG-CD2 4.48Å
104	A	98.6	Very high	98.3	Very high	5 Å²	5	41.9 Å²	41.9	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-56.6	-45.7	178.1	0	0	0	0	0	111.4	Y48 Q51 H100 T101 L107 A108	Y48-A104 HydrophobicContact CE2-CB 4.36Å; Y48-A104 WeakPolarHBondContact CE2-O 3.37Å; Q51-A104 HydrophobicContact CG-CB 3.87Å; H100-A104 WeakPolarHBondContact O-CB 3.16Å; H100-A104 PolarHBondContact O-N 3.47Å; T101-A104 PolarHBondContact O-N 2.77Å; A104-L107 PolarHBondContact O-N 2.96Å; A104-A108 PolarHBondContact O-N 3.04Å
105	K	98.3	Very high	98.3	Very high	125 Å²	125	38.2 Å²	38.2	54%	0.543	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-47.6	175.6	-176.3	-179.7	176.9	-175.9	0	111.9	T101 E102 L103 L107 A108 D109	T101-K105 PolarHBondContact O-N 2.84Å; E102-K105 PolarHBondContact O-N 3.11Å; L103-K105 VanDerWaalsContact C-N 3.3Å; L103-K105 PolarHBondContact O-N 3.46Å; K105-L107 VanDerWaalsContact C-N 3.3Å; K105-L107 PolarHBondContact O-N 3.34Å; K105-A108 PolarHBondContact O-N 2.7Å; K105-D109 PolarHBondContact O-N 3.5Å
106	Q	98.1	Very high	98.3	Very high	41 Å²	41	35.6 Å²	35.6	19%	0.192	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-39	177.3	-72.5	-177.6	10.2	0	0	112.2	E102 L103 D109 T110 G206	E102-Q106 WeakPolarHBondContact O-CG 3.36Å; E102-Q106 PolarHBondContact O-N 3.32Å; E102-Q106 PolarHBondContact OE1-NE2 3.33Å; L103-Q106 PolarHBondContact O-N 3.33Å; Q106-D109 PolarHBondContact O-N 2.91Å; Q106-T110 WeakPolarHBondContact O-CB 3.29Å; Q106-T110 PolarHBondContact O-N 3.05Å; Q106-T110 PolarHBondContact O-OG1 3.19Å; Q106-G206 VanDerWaalsContact OE1-CA 3.31Å
107	L	98.5	Very high	98.3	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-64.4	-41.8	174.7	-69	-176	0	0	0	112.2	V47 Y48 Q51 L103 A104 K105 M111 L112 F203	V47-L107 HydrophobicContact CG1-CD1 4.42Å; Y48-L107 HydrophobicContact CD2-CB 4.31Å; Q51-L107 HydrophobicContact CB-CD1 4.14Å; Q51-L107 HydrophobicContact CG-CD1 4.13Å; L103-L107 HydrophobicContact CD1-CD1 4.39Å; L103-L107 HydrophobicContact CD1-CD2 4.29Å; L103-L107 HydrophobicContact CD1-CG 4.02Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 HydrophobicContact CG-CG 4.33Å; L103-L107 VanDerWaalsContact O-CG 3.31Å; L103-L107 WeakPolarHBondContact O-CG 3.27Å; L103-L107 PolarHBondContact O-N 2.89Å; A104-L107 PolarHBondContact O-N 2.96Å; K105-L107 VanDerWaalsContact C-N 3.3Å; K105-L107 PolarHBondContact O-N 3.34Å; L107-M111 HydrophobicContact CB-CE 4.11Å; L107-M111 HydrophobicContact CD2-CE 4.11Å; L107-M111 HydrophobicContact CD2-SD 4.27Å; L107-M111 HydrophobicContact CG-CE 4.49Å; L107-M111 WeakPolarHBondContact O-CA 3.42Å; L107-M111 VanDerWaalsContact O-CB 3.27Å; L107-M111 WeakPolarHBondContact O-CB 3.37Å; L107-M111 PolarHBondContact O-N 2.91Å; L107-M111 VanDerWaalsContact O-N 3.08Å; L107-L112 PolarHBondContact O-N 3.3Å; L107-F203 HydrophobicContact CD2-CB 4.45Å; L107-F203 HydrophobicContact CD2-CD2 3.5Å; L107-F203 HydrophobicContact CD2-CE2 4.17Å; L107-F203 HydrophobicContact CD2-CG 4.37Å
108	A	98.4	Very high	98.3	Very high	24 Å²	24	40.7 Å²	40.7	20%	0.198	21%	0.214	C	C	.	.	I	π-helix	trans	-61.1	-49.9	175.3	0	0	0	0	0	111.4	Y48 A104 K105 L113	Y48-A108 HydrophobicContact CD2-CB 4.22Å; Y48-A108 HydrophobicContact CE2-CB 3.78Å; A104-A108 PolarHBondContact O-N 3.04Å; K105-A108 PolarHBondContact O-N 2.7Å; A108-L113 WeakPolarHBondContact O-CB 3.22Å; A108-L113 PolarHBondContact O-N 3.29Å
109	D	98.3	Very high	98.3	Very high	84 Å²	84	43.5 Å²	43.5	45%	0.449	21%	0.212	S	C	.	.	I	π-helix	trans	-75.3	-38.6	-171.8	-70.2	-20	0	0	0	113.2	K105 Q106	K105-D109 PolarHBondContact O-N 3.5Å; Q106-D109 PolarHBondContact O-N 2.91Å
110	T	98.3	Very high	98.2	Very high	55 Å²	55	48.3 Å²	48.3	34%	0.337	23%	0.234	S	C	.	.	I	π-helix	trans	-109	-15.4	-168.7	71.6	0	0	0	0	114.4	Q106 P199 G202	Q106-T110 WeakPolarHBondContact O-CB 3.29Å; Q106-T110 PolarHBondContact O-N 3.05Å; Q106-T110 PolarHBondContact O-OG1 3.19Å; T110-P199 WeakPolarHBondContact O-CA 3.21Å; T110-G202 VanDerWaalsContact OG1-CA 3.26Å; T110-G202 WeakPolarHBondContact OG1-CA 3.43Å
111	M	98.3	Very high	98.1	Very high	6 Å²	6	54.7 Å²	54.7	3%	0.03	26%	0.262	C	S	.	.	I	π-helix	trans	-111.3	-54.8	176.2	177.2	-171.9	70.9	0	0	111.7	M44 V47 L107 P199 F203	M44-M111 HydrophobicContact CB-CE 3.98Å; M44-M111 HydrophobicContact CB-CG 4.39Å; M44-M111 HydrophobicContact CB-SD 4.22Å; M44-M111 HydrophobicContact CE-CG 4.05Å; M44-M111 HydrophobicContact CG-CE 4.38Å; M44-M111 HydrophobicContact CG-CG 4.03Å; M44-M111 HydrophobicContact CG-SD 3.95Å; M44-M111 HydrophobicContact SD-CG 3.66Å; M44-M111 HydrophobicContact SD-SD 4.36Å; V47-M111 HydrophobicContact CG1-CE 4.37Å; L107-M111 HydrophobicContact CB-CE 4.11Å; L107-M111 HydrophobicContact CD2-CE 4.11Å; L107-M111 HydrophobicContact CD2-SD 4.27Å; L107-M111 HydrophobicContact CG-CE 4.49Å; L107-M111 WeakPolarHBondContact O-CA 3.42Å; L107-M111 VanDerWaalsContact O-CB 3.27Å; L107-M111 WeakPolarHBondContact O-CB 3.37Å; L107-M111 PolarHBondContact O-N 2.91Å; L107-M111 VanDerWaalsContact O-N 3.08Å; M111-P199 HydrophobicContact CG-CB 4.15Å; M111-F203 HydrophobicContact CG-CB 4.47Å; M111-F203 HydrophobicContact SD-CB 4.07Å; M111-F203 HydrophobicContact SD-CD2 3.68Å; M111-F203 HydrophobicContact SD-CG 4.24Å
112	L	97.9	Very high	98	Very high	13 Å²	13	52.8 Å²	52.8	7%	0.068	25%	0.249	C	C	.	.	I	π-helix	trans	-72.8	-54	-176	-71.6	-179.1	0	0	0	113.2	L41 M44 Q45 Y48 L107 V115 I116	L41-L112 HydrophobicContact CD1-CD2 4.18Å; M44-L112 HydrophobicContact CB-CD2 3.55Å; Q45-L112 HydrophobicContact CB-CD2 4.46Å; Q45-L112 HydrophobicContact CG-CD2 3.83Å; Y48-L112 HydrophobicContact CD1-CD1 3.7Å; Y48-L112 HydrophobicContact CD2-CD1 4.15Å; Y48-L112 HydrophobicContact CE1-CD1 4.45Å; Y48-L112 HydrophobicContact CG-CD1 3.51Å; L107-L112 PolarHBondContact O-N 3.3Å; L112-V115 PolarHBondContact O-N 2.82Å; L112-V115 VanDerWaalsContact O-N 3.12Å; L112-I116 HydrophobicContact CB-CD1 4.39Å; L112-I116 WeakPolarHBondContact O-CG1 3.45Å; L112-I116 PolarHBondContact O-N 3.22Å
113	L	97.9	Very high	98	Very high	56 Å²	56	49.9 Å²	49.9	29%	0.293	24%	0.236	S	C	.	.	H	α-helix	trans	-58.4	-39.9	-171.8	-177.1	62.3	0	0	0	113.6	A108 V115 I116 R117	A108-L113 WeakPolarHBondContact O-CB 3.22Å; A108-L113 PolarHBondContact O-N 3.29Å; L113-V115 PolarHBondContact O-N 2.96Å; L113-I116 PolarHBondContact O-N 3.01Å; L113-R117 HydrophobicContact CD1-CG 4.23Å; L113-R117 HydrophobicContact CG-CG 4.48Å; L113-R117 WeakPolarHBondContact O-CB 3.49Å; L113-R117 VanDerWaalsContact O-CG 3.32Å; L113-R117 WeakPolarHBondContact O-CG 3.47Å; L113-R117 PolarHBondContact O-N 3.29Å
114	P	98	Very high	98	Very high	26 Å²	26	53.2 Å²	53.2	17%	0.169	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-41	175.3	-24.6	35.8	0	0	0	113.4	R117 F118 P199	P114-R117 PolarHBondContact O-N 2.86Å; P114-F118 WeakPolarHBondContact O-CB 3.37Å; P114-F118 PolarHBondContact O-N 3.42Å; P114-P199 HydrophobicContact CB-CG 4.35Å
115	V	97.8	Very high	98	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-68.4	-41.7	178.1	-178.7	0	0	0	0	111.1	L41 M44 L112 L113 F118 R119 P199	L41-V115 HydrophobicContact CB-CG1 4.06Å; L41-V115 HydrophobicContact CD1-CB 4.4Å; L41-V115 HydrophobicContact CD1-CG1 4.2Å; M44-V115 HydrophobicContact CE-CG2 4.37Å; M44-V115 HydrophobicContact SD-CG2 3.77Å; L112-V115 PolarHBondContact O-N 2.82Å; L112-V115 VanDerWaalsContact O-N 3.12Å; L113-V115 PolarHBondContact O-N 2.96Å; V115-F118 PolarHBondContact O-N 2.89Å; V115-R119 PolarHBondContact O-N 3.4Å; V115-P199 HydrophobicContact CG2-CB 4.01Å; V115-P199 HydrophobicContact CG2-CG 3.37Å
116	I	98.1	Very high	98	Very high	40 Å²	40	51.1 Å²	51.1	21%	0.205	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-49.5	175.3	-67	170.2	0	0	0	109.8	L41 L112 L113 F118 R119 E120	L41-I116 HydrophobicContact CD1-CD1 4.32Å; L41-I116 HydrophobicContact CD1-CG1 3.65Å; L41-I116 HydrophobicContact CD2-CG1 4.13Å; L112-I116 HydrophobicContact CB-CD1 4.39Å; L112-I116 WeakPolarHBondContact O-CG1 3.45Å; L112-I116 PolarHBondContact O-N 3.22Å; L113-I116 PolarHBondContact O-N 3.01Å; I116-F118 PolarHBondContact O-N 3.07Å; I116-R119 PolarHBondContact O-N 3.3Å; I116-E120 HydrophobicContact CG2-CG 4.17Å; I116-E120 WeakPolarHBondContact O-CB 3.38Å; I116-E120 WeakPolarHBondContact O-CG 3.28Å; I116-E120 PolarHBondContact O-N 3.28Å
117	R	97.7	Very high	98	Very high	153 Å²	153	52.1 Å²	52.1	58%	0.577	26%	0.26	S	S	*	.	H	α-helix	trans	-60.2	-43	177.7	-75.6	176.3	179.5	168.8	1.1	112.4	L113 P114 R119 K121	L113-R117 HydrophobicContact CD1-CG 4.23Å; L113-R117 HydrophobicContact CG-CG 4.48Å; L113-R117 WeakPolarHBondContact O-CB 3.49Å; L113-R117 VanDerWaalsContact O-CG 3.32Å; L113-R117 WeakPolarHBondContact O-CG 3.47Å; L113-R117 PolarHBondContact O-N 3.29Å; P114-R117 PolarHBondContact O-N 2.86Å; R117-R119 VanDerWaalsContact C-N 3.29Å; R117-R119 PolarHBondContact O-N 3.18Å; R117-K121 WeakPolarHBondContact O-CA 3.39Å; R117-K121 WeakPolarHBondContact O-CB 3.32Å; R117-K121 PolarHBondContact O-N 3.44Å
118	F	98.4	Very high	98	Very high	6 Å²	6	55.5 Å²	55.5	3%	0.026	28%	0.28	C	S	.	.	I	π-helix	trans	-58.4	-43.1	176.7	176.1	-107.2	0	0	0	111.5	L33 T37 P114 V115 I116 D122 L123 L188 R191 K192 A195	L33-F118 HydrophobicContact CD2-CE1 4.44Å; L33-F118 HydrophobicContact CD2-CZ 4.05Å; T37-F118 HydrophobicContact CG2-CD1 4.1Å; T37-F118 HydrophobicContact CG2-CE1 3.77Å; P114-F118 WeakPolarHBondContact O-CB 3.37Å; P114-F118 PolarHBondContact O-N 3.42Å; V115-F118 PolarHBondContact O-N 2.89Å; I116-F118 PolarHBondContact O-N 3.07Å; F118-D122 HydrophobicContact CD2-CB 3.83Å; F118-D122 VanDerWaalsContact CD2-OD2 3.3Å; F118-D122 WeakPolarHBondContact CD2-OD2 3.42Å; F118-D122 HydrophobicContact CE2-CB 4Å; F118-D122 WeakPolarHBondContact O-CA 3.08Å; F118-D122 VanDerWaalsContact O-CB 3.28Å; F118-D122 WeakPolarHBondContact O-CB 3.41Å; F118-D122 PolarHBondContact O-N 3.05Å; F118-L123 HydrophobicContact CD1-CD1 4.3Å; F118-L123 HydrophobicContact CD1-CG 4.31Å; F118-L123 HydrophobicContact CE1-CD1 3.95Å; F118-L123 HydrophobicContact CE1-CD2 3.96Å; F118-L123 HydrophobicContact CE1-CG 3.89Å; F118-L123 HydrophobicContact CZ-CD2 3.92Å; F118-L123 HydrophobicContact CZ-CG 4.22Å; F118-L123 PolarHBondContact O-N 3.34Å; F118-L188 HydrophobicContact CE2-CD1 3.81Å; F118-L188 HydrophobicContact CZ-CD1 3.69Å; F118-R191 HydrophobicContact CD2-CB 4.4Å; F118-R191 HydrophobicContact CE2-CB 3.83Å; F118-K192 HydrophobicContact CZ-CB 4.34Å; F118-A195 HydrophobicContact CB-CB 3.91Å; F118-A195 HydrophobicContact CD1-CB 3.81Å; F118-A195 HydrophobicContact CD2-CB 3.46Å; F118-A195 VanDerWaalsContact CD2-CB 3.46Å; F118-A195 HydrophobicContact CE1-CB 4.19Å; F118-A195 HydrophobicContact CE2-CB 3.89Å; F118-A195 HydrophobicContact CG-CB 3.42Å; F118-A195 VanDerWaalsContact CG-CB 3.42Å; F118-A195 HydrophobicContact CZ-CB 4.22Å
119	R	97.8	Very high	98	Very high	98 Å²	98	55.5 Å²	55.5	37%	0.37	28%	0.277	S	S	.	.	I	π-helix	trans	-70.1	-52.3	179	-176.1	-179.3	174.7	-94.2	-1.1	112.7	N38 V115 I116 R117 K121 L123 T124	N38-R119 PolarHBondContact OD1-NE 2.83Å; V115-R119 PolarHBondContact O-N 3.4Å; I116-R119 PolarHBondContact O-N 3.3Å; R117-R119 VanDerWaalsContact C-N 3.29Å; R117-R119 PolarHBondContact O-N 3.18Å; R119-K121 VanDerWaalsContact C-N 3.33Å; R119-K121 PolarHBondContact O-N 3.46Å; R119-L123 HydrophobicContact CB-CD1 4.48Å; R119-L123 HydrophobicContact CG-CD1 4.42Å; R119-T124 PolarHBondContact O-N 3.35Å; R119-T124 PolarHBondContact O-OG1 2.93Å; R119-T124 VanDerWaalsContact O-OG1 3.07Å
120	E	97.1	Very high	98	Very high	122 Å²	122	55.2 Å²	55.2	57%	0.57	27%	0.272	S	S	*	.	I	π-helix	trans	-72.2	-27.3	-174.2	-68.7	-178.2	170	0	0	113	I116 T124	I116-E120 HydrophobicContact CG2-CG 4.17Å; I116-E120 WeakPolarHBondContact O-CB 3.38Å; I116-E120 WeakPolarHBondContact O-CG 3.28Å; I116-E120 PolarHBondContact O-N 3.28Å; E120-T124 WeakPolarHBondContact O-CB 3.2Å; E120-T124 PolarHBondContact O-OG1 3.44Å; E120-T124 VanDerWaalsContact O-OG1 3.14Å
121	K	96.6	Very high	98	Very high	150 Å²	150	57.2 Å²	57.2	65%	0.652	28%	0.281	S	S	*	.	I	π-helix	trans	-102.4	-62.9	179.6	-168.2	-177.1	176.4	-177	0	111.9	R117 R119 E125	R117-K121 WeakPolarHBondContact O-CA 3.39Å; R117-K121 WeakPolarHBondContact O-CB 3.32Å; R117-K121 PolarHBondContact O-N 3.44Å; R119-K121 VanDerWaalsContact C-N 3.33Å; R119-K121 PolarHBondContact O-N 3.46Å; K121-E125 WeakPolarHBondContact O-CB 3.47Å; K121-E125 PolarHBondContact O-N 2.91Å
122	D	97.4	Very high	98	Very high	26 Å²	26	61.1 Å²	61.1	14%	0.139	30%	0.301	C	S	.	.	I	π-helix	trans	-75	-46.2	-167.3	-58.5	-48.1	0	0	0	112.3	F118 E125 V126 R191	F118-D122 HydrophobicContact CD2-CB 3.83Å; F118-D122 VanDerWaalsContact CD2-OD2 3.3Å; F118-D122 WeakPolarHBondContact CD2-OD2 3.42Å; F118-D122 HydrophobicContact CE2-CB 4Å; F118-D122 WeakPolarHBondContact O-CA 3.08Å; F118-D122 VanDerWaalsContact O-CB 3.28Å; F118-D122 WeakPolarHBondContact O-CB 3.41Å; F118-D122 PolarHBondContact O-N 3.05Å; D122-E125 PolarHBondContact O-N 3.42Å; D122-V126 VanDerWaalsContact O-CG2 3.28Å; D122-V126 WeakPolarHBondContact O-CG2 3.36Å; D122-V126 PolarHBondContact O-N 3Å; D122-V126 VanDerWaalsContact O-N 3.13Å; D122-R191 WeakPolarHBondContact OD1-CD 3.36Å; D122-R191 IonicContact OD1-CZ 2.71Å; D122-R191 IonicContact OD1-NE 3.99Å; D122-R191 IonicContact OD1-NH1 2.81Å; D122-R191 PolarHBondContact OD1-NH1 3.19Å
123	L	98.1	Very high	98.1	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.068	30%	0.298	C	S	.	.	I	π-helix	trans	-69.8	-36.7	177.4	-62.1	-178.6	0	0	0	111.9	L33 T34 T37 F118 R119 V126 S127 L188	L33-L123 HydrophobicContact CD2-CD2 4.27Å; T34-L123 HydrophobicContact CG2-CD1 4.22Å; T37-L123 HydrophobicContact CG2-CD1 4.41Å; F118-L123 HydrophobicContact CD1-CD1 4.3Å; F118-L123 HydrophobicContact CD1-CG 4.31Å; F118-L123 HydrophobicContact CE1-CD1 3.95Å; F118-L123 HydrophobicContact CE1-CD2 3.96Å; F118-L123 HydrophobicContact CE1-CG 3.89Å; F118-L123 HydrophobicContact CZ-CD2 3.92Å; F118-L123 HydrophobicContact CZ-CG 4.22Å; F118-L123 PolarHBondContact O-N 3.34Å; R119-L123 HydrophobicContact CB-CD1 4.48Å; R119-L123 HydrophobicContact CG-CD1 4.42Å; L123-V126 PolarHBondContact O-N 3.38Å; L123-S127 PolarHBondContact O-N 3.24Å; L123-L188 HydrophobicContact CD2-CD1 3.84Å; L123-L188 HydrophobicContact CD2-CD2 4.27Å
124	T	98	Very high	98.1	Very high	72 Å²	72	59.3 Å²	59.3	44%	0.442	30%	0.298	S	S	.	.	H	α-helix	trans	-68	-37.6	176.4	-56.6	0	0	0	0	111.7	R119 E120 S127 T128	R119-T124 PolarHBondContact O-N 3.35Å; R119-T124 PolarHBondContact O-OG1 2.93Å; R119-T124 VanDerWaalsContact O-OG1 3.07Å; E120-T124 WeakPolarHBondContact O-CB 3.2Å; E120-T124 PolarHBondContact O-OG1 3.44Å; E120-T124 VanDerWaalsContact O-OG1 3.14Å; T124-S127 PolarHBondContact O-N 2.84Å; T124-T128 WeakPolarHBondContact O-CB 3.46Å; T124-T128 PolarHBondContact O-N 3.24Å; T124-T128 PolarHBondContact O-OG1 3.42Å
125	E	98.3	Very high	98.1	Very high	77 Å²	77	63.3 Å²	63.3	36%	0.36	32%	0.317	S	S	.	.	H	α-helix	trans	-58.5	-48.4	171.3	177.1	-179.1	-156.7	0	0	110.9	K121 D122 S127 T128 L129 R191	K121-E125 WeakPolarHBondContact O-CB 3.47Å; K121-E125 PolarHBondContact O-N 2.91Å; D122-E125 PolarHBondContact O-N 3.42Å; E125-S127 PolarHBondContact O-N 3.23Å; E125-T128 PolarHBondContact O-N 3.13Å; E125-L129 HydrophobicContact CG-CD1 4.02Å; E125-L129 WeakPolarHBondContact O-CB 3.28Å; E125-L129 WeakPolarHBondContact O-CG 3.42Å; E125-L129 PolarHBondContact O-N 2.88Å; E125-R191 IonicContact OE2-CZ 2.62Å; E125-R191 IonicContact OE2-NH1 2.83Å; E125-R191 PolarHBondContact OE2-NH1 3.01Å; E125-R191 IonicContact OE2-NH2 2.99Å
126	V	98.4	Very high	98.1	Very high	9 Å²	9	63.3 Å²	63.3	6%	0.055	32%	0.317	C	S	.	.	H	α-helix	trans	-61.2	-44.5	178.1	173.4	0	0	0	0	111.4	D122 L123 L129 K130 Y181 A184 L185 L188	D122-V126 VanDerWaalsContact O-CG2 3.28Å; D122-V126 WeakPolarHBondContact O-CG2 3.36Å; D122-V126 PolarHBondContact O-N 3Å; D122-V126 VanDerWaalsContact O-N 3.13Å; L123-V126 PolarHBondContact O-N 3.38Å; V126-L129 PolarHBondContact O-N 2.94Å; V126-K130 WeakPolarHBondContact O-CB 3.41Å; V126-K130 PolarHBondContact O-N 2.82Å; V126-Y181 HydrophobicContact CG1-CE2 3.95Å; V126-Y181 WeakPolarHBondContact O-CE2 3.17Å; V126-A184 HydrophobicContact CG2-CB 4.29Å; V126-L185 HydrophobicContact CG1-CD2 3.67Å; V126-L185 HydrophobicContact CG1-CG 4.44Å; V126-L188 HydrophobicContact CG1-CD2 4.32Å; V126-L188 HydrophobicContact CG2-CB 4.41Å; V126-L188 HydrophobicContact CG2-CD2 3.95Å
127	S	98.3	Very high	98.2	Very high	62 Å²	62	61.7 Å²	61.7	43%	0.434	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-44.8	176.8	-168.9	0	0	0	0	111.9	L123 T124 E125 L129 K130 D131	L123-S127 PolarHBondContact O-N 3.24Å; T124-S127 PolarHBondContact O-N 2.84Å; E125-S127 PolarHBondContact O-N 3.23Å; S127-L129 PolarHBondContact O-N 3.29Å; S127-K130 WeakPolarHBondContact O-CB 3.48Å; S127-K130 PolarHBondContact O-N 3.04Å; S127-D131 PolarHBondContact O-N 2.96Å; S127-D131 VanDerWaalsContact O-N 3.11Å
128	T	98.5	Very high	98.2	Very high	72 Å²	72	59 Å²	59	44%	0.442	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-42.2	-179.5	-54.3	0	0	0	0	111.3	T124 E125 K130 D131 L132	T124-T128 WeakPolarHBondContact O-CB 3.46Å; T124-T128 PolarHBondContact O-N 3.24Å; T124-T128 PolarHBondContact O-OG1 3.42Å; E125-T128 PolarHBondContact O-N 3.13Å; T128-K130 VanDerWaalsContact C-N 3.34Å; T128-D131 PolarHBondContact O-N 3.12Å; T128-L132 HydrophobicContact CG2-CD1 4.22Å; T128-L132 VanDerWaalsContact O-CG 3.32Å; T128-L132 WeakPolarHBondContact O-CG 3.5Å; T128-L132 PolarHBondContact O-N 3.25Å
129	L	98.7	Very high	98.2	Very high	24 Å²	24	62.7 Å²	62.7	13%	0.126	32%	0.324	C	S	.	.	H	α-helix	trans	-67.6	-34.4	177.5	-71.6	172.3	0	0	0	112.4	E125 V126 S127 L132 F133 Q180 Y181 A184	E125-L129 HydrophobicContact CG-CD1 4.02Å; E125-L129 WeakPolarHBondContact O-CB 3.28Å; E125-L129 WeakPolarHBondContact O-CG 3.42Å; E125-L129 PolarHBondContact O-N 2.88Å; V126-L129 PolarHBondContact O-N 2.94Å; S127-L129 PolarHBondContact O-N 3.29Å; L129-L132 HydrophobicContact CD2-CD1 4.49Å; L129-F133 WeakPolarHBondContact O-CB 3.26Å; L129-F133 PolarHBondContact O-N 2.97Å; L129-Q180 HydrophobicContact CD2-CB 3.95Å; L129-Y181 HydrophobicContact CB-CD2 3.81Å; L129-Y181 HydrophobicContact CB-CG 4.4Å; L129-A184 HydrophobicContact CD1-CB 3.51Å
130	K	98.6	Very high	98.2	Very high	79 Å²	79	59.1 Å²	59.1	34%	0.343	31%	0.312	S	S	.	.	H	α-helix	trans	-58	-51.1	171.8	-177.3	178.6	176.1	160.5	0	111	E27 V126 S127 T128 L132 F133 G134 Y181	E27-K130 IonicContact OE1-NZ 3.52Å; E27-K130 VanDerWaalsContact OE2-CE 3.22Å; E27-K130 WeakPolarHBondContact OE2-CE 3.44Å; E27-K130 IonicContact OE2-NZ 3.31Å; E27-K130 PolarHBondContact OE2-NZ 3.44Å; V126-K130 WeakPolarHBondContact O-CB 3.41Å; V126-K130 PolarHBondContact O-N 2.82Å; S127-K130 WeakPolarHBondContact O-CB 3.48Å; S127-K130 PolarHBondContact O-N 3.04Å; T128-K130 VanDerWaalsContact C-N 3.34Å; K130-L132 PolarHBondContact O-N 3.07Å; K130-F133 PolarHBondContact O-N 3.46Å; K130-G134 PolarHBondContact O-N 3.5Å; K130-Y181 HydrophobicContact CB-CD2 4.46Å; K130-Y181 HydrophobicContact CB-CE1 4.13Å; K130-Y181 HydrophobicContact CB-CE2 3.7Å; K130-Y181 WeakPolarHBondContact CB-OH 3.35Å; K130-Y181 WeakPolarHBondContact CD-OH 3.43Å; K130-Y181 HydrophobicContact CG-CE1 4.15Å; K130-Y181 HydrophobicContact CG-CE2 4.47Å; K130-Y181 WeakPolarHBondContact CG-OH 3.2Å
131	D	98.5	Very high	98.3	Very high	97 Å²	97	57.5 Å²	57.5	52%	0.519	31%	0.307	S	S	.	.	H	α-helix	trans	-64.5	-42.9	-178	-66.5	-25.4	0	0	0	111.6	S127 T128 F133 G134 L135	S127-D131 PolarHBondContact O-N 2.96Å; S127-D131 VanDerWaalsContact O-N 3.11Å; T128-D131 PolarHBondContact O-N 3.12Å; D131-F133 VanDerWaalsContact C-N 3.35Å; D131-F133 PolarHBondContact O-N 3.48Å; D131-G134 PolarHBondContact O-N 2.94Å; D131-L135 WeakPolarHBondContact O-CG 3.39Å; D131-L135 PolarHBondContact O-N 3.31Å
132	L	98.5	Very high	98.4	Very high	87 Å²	87	56.4 Å²	56.4	46%	0.455	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-42.5	175.8	-72.8	173	0	0	0	112.2	T128 L129 K130 A136	T128-L132 HydrophobicContact CG2-CD1 4.22Å; T128-L132 VanDerWaalsContact O-CG 3.32Å; T128-L132 WeakPolarHBondContact O-CG 3.5Å; T128-L132 PolarHBondContact O-N 3.25Å; L129-L132 HydrophobicContact CD2-CD1 4.49Å; K130-L132 PolarHBondContact O-N 3.07Å; L132-A136 WeakPolarHBondContact O-CB 3.12Å; L132-A136 PolarHBondContact O-N 2.89Å
133	F	98.7	Very high	98.4	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.018	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-44.3	174.9	170	-117.3	0	0	0	111.8	R20 L23 L129 K130 D131 L135 A136 S137 Q174 Y181	R20-F133 VanDerWaalsContact CZ-CZ 3.42Å; L23-F133 HydrophobicContact CD2-CD1 4.4Å; L23-F133 HydrophobicContact CD2-CE1 3.65Å; L23-F133 HydrophobicContact CD2-CZ 4.34Å; L129-F133 WeakPolarHBondContact O-CB 3.26Å; L129-F133 PolarHBondContact O-N 2.97Å; K130-F133 PolarHBondContact O-N 3.46Å; D131-F133 VanDerWaalsContact C-N 3.35Å; D131-F133 PolarHBondContact O-N 3.48Å; F133-L135 PolarHBondContact O-N 3.16Å; F133-A136 PolarHBondContact O-N 2.98Å; F133-S137 WeakPolarHBondContact O-CB 3.27Å; F133-S137 PolarHBondContact O-N 3.26Å; F133-Q174 HydrophobicContact CE2-CG 4.05Å; F133-Y181 HydrophobicContact CB-CD1 4.25Å; F133-Y181 AromaticContact CD1-CD1 3.85Å; F133-Y181 HydrophobicContact CD1-CD1 3.85Å; F133-Y181 HydrophobicContact CD1-CE1 4.3Å; F133-Y181 HydrophobicContact CG-CD1 4.25Å
134	G	98.4	Very high	98.4	Very high	27 Å²	27	57.9 Å²	57.9	28%	0.278	32%	0.315	S	S	.	.	H	α-helix	trans	-58.6	-45.6	176.6	0	0	0	0	0	112.6	K130 D131 S137 N138	K130-G134 PolarHBondContact O-N 3.5Å; D131-G134 PolarHBondContact O-N 2.94Å; G134-S137 PolarHBondContact O-N 3Å; G134-N138 VanDerWaalsContact O-CG 3.29Å; G134-N138 PolarHBondContact O-N 3.04Å; G134-N138 PolarHBondContact O-ND2 3.09Å
135	L	98.6	Very high	98.4	Very high	110 Å²	110	56.3 Å²	56.3	58%	0.576	31%	0.309	S	S	*	.	H	α-helix	trans	-62.2	-45.5	175.5	-70.8	171.8	0	0	0	112.2	D131 F133 S137 N138 E139	D131-L135 WeakPolarHBondContact O-CG 3.39Å; D131-L135 PolarHBondContact O-N 3.31Å; F133-L135 PolarHBondContact O-N 3.16Å; L135-S137 VanDerWaalsContact C-N 3.34Å; L135-N138 PolarHBondContact O-N 3.44Å; L135-E139 WeakPolarHBondContact O-CB 3.44Å; L135-E139 PolarHBondContact O-N 3.22Å
136	A	98.5	Very high	98.4	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-66.7	-35.2	178.8	0	0	0	0	0	112.6	L132 F133 H140 K173 Q174 S177	L132-A136 WeakPolarHBondContact O-CB 3.12Å; L132-A136 PolarHBondContact O-N 2.89Å; F133-A136 PolarHBondContact O-N 2.98Å; A136-H140 PolarHBondContact O-N 2.94Å; A136-K173 HydrophobicContact CB-CD 4.36Å; A136-K173 HydrophobicContact CB-CG 4Å; A136-Q174 HydrophobicContact CB-CB 4.39Å; A136-S177 WeakPolarHBondContact CB-OG 3.39Å
137	S	98.4	Very high	98.3	Very high	6 Å²	6	61.4 Å²	61.4	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-61.3	-51.8	172.9	-172	0	0	0	0	110.8	R20 F133 G134 L135 E139 H140 D141	R20-S137 PolarHBondContact NH2-OG 3.26Å; F133-S137 WeakPolarHBondContact O-CB 3.27Å; F133-S137 PolarHBondContact O-N 3.26Å; G134-S137 PolarHBondContact O-N 3Å; L135-S137 VanDerWaalsContact C-N 3.34Å; S137-E139 VanDerWaalsContact C-N 3.32Å; S137-E139 PolarHBondContact O-N 3.46Å; S137-H140 PolarHBondContact O-N 3.41Å; S137-H140 VanDerWaalsContact O-N 3.15Å; S137-D141 PolarHBondContact O-N 2.97Å
138	N	98.4	Very high	98.2	Very high	96 Å²	96	62.9 Å²	62.9	51%	0.513	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-39.8	179.4	-69.2	-25.1	0	0	0	112.3	G134 L135 D141 L142	G134-N138 VanDerWaalsContact O-CG 3.29Å; G134-N138 PolarHBondContact O-N 3.04Å; G134-N138 PolarHBondContact O-ND2 3.09Å; L135-N138 PolarHBondContact O-N 3.44Å; N138-D141 PolarHBondContact O-N 2.96Å; N138-L142 WeakPolarHBondContact O-CG 3.21Å; N138-L142 PolarHBondContact O-N 3.16Å
139	E	98.5	Very high	98.1	Very high	85 Å²	85	69.3 Å²	69.3	40%	0.397	35%	0.354	S	S	.	.	H	α-helix	trans	-62.5	-42.7	175.7	-172.3	-179.8	171.7	0	0	111.6	L135 S137 L142 S143 A170 K173	L135-E139 WeakPolarHBondContact O-CB 3.44Å; L135-E139 PolarHBondContact O-N 3.22Å; S137-E139 VanDerWaalsContact C-N 3.32Å; S137-E139 PolarHBondContact O-N 3.46Å; E139-L142 PolarHBondContact O-N 3.07Å; E139-S143 WeakPolarHBondContact O-CB 3.15Å; E139-S143 PolarHBondContact O-N 3.39Å; E139-A170 HydrophobicContact CG-CB 4.28Å; E139-K173 WeakPolarHBondContact OE2-CD 3.48Å; E139-K173 IonicContact OE2-NZ 2.78Å; E139-K173 PolarHBondContact OE2-NZ 3.42Å
140	H	98.6	Very high	97.9	Very high	23 Å²	23	70.6 Å²	70.6	11%	0.106	36%	0.361	C	S	.	.	H	α-helix	trans	-64.8	-43.5	175.5	178.8	-122.1	0	0	0	111.8	A136 S137 L142 S143 M144 A170 R171 Q174	A136-H140 PolarHBondContact O-N 2.94Å; S137-H140 PolarHBondContact O-N 3.41Å; S137-H140 VanDerWaalsContact O-N 3.15Å; H140-L142 VanDerWaalsContact C-N 3.34Å; H140-L142 PolarHBondContact O-N 3.42Å; H140-S143 WeakPolarHBondContact CA-OG 3.26Å; H140-S143 PolarHBondContact O-N 2.91Å; H140-S143 PolarHBondContact O-OG 2.97Å; H140-M144 WeakPolarHBondContact NE2-CG 3.46Å; H140-M144 WeakPolarHBondContact O-CB 3.3Å; H140-M144 WeakPolarHBondContact O-CG 3.39Å; H140-M144 PolarHBondContact O-N 3.47Å; H140-A170 HydrophobicContact CB-CB 4.17Å; H140-R171 PolarHBondContact NE2-NE 3.18Å; H140-Q174 HydrophobicContact CB-CB 4.36Å; H140-Q174 VanDerWaalsContact CG-OE1 3.23Å; H140-Q174 PolarHBondContact ND1-OE1 3.35Å
141	D	98.4	Very high	97.5	Very high	87 Å²	87	70.7 Å²	70.7	47%	0.465	37%	0.369	S	S	.	.	H	α-helix	trans	-58.4	-44.1	177.2	-69	-31.4	0	0	0	112.1	S137 N138 M144 A145	S137-D141 PolarHBondContact O-N 2.97Å; N138-D141 PolarHBondContact O-N 2.96Å; D141-M144 PolarHBondContact O-N 3.07Å; D141-A145 WeakPolarHBondContact O-CB 3.49Å; D141-A145 PolarHBondContact O-N 2.89Å
142	L	98.4	Very high	97.2	Very high	128 Å²	128	75.6 Å²	75.6	67%	0.67	39%	0.386	S	S	*	.	H	α-helix	trans	-64.7	-43.2	175.6	-69.8	173.1	0	0	0	112.3	N138 E139 H140 M144 A145 K146	N138-L142 WeakPolarHBondContact O-CG 3.21Å; N138-L142 PolarHBondContact O-N 3.16Å; E139-L142 PolarHBondContact O-N 3.07Å; H140-L142 VanDerWaalsContact C-N 3.34Å; H140-L142 PolarHBondContact O-N 3.42Å; L142-M144 VanDerWaalsContact C-N 3.35Å; L142-A145 PolarHBondContact O-N 2.96Å; L142-K146 PolarHBondContact O-N 3.21Å
143	S	98.1	Very high	96.6	Very high	11 Å²	11	81.5 Å²	81.5	8%	0.077	41%	0.408	C	S	.	.	H	α-helix	trans	-63.4	-41.2	177.9	76.3	0	0	0	0	111.8	E139 H140 K146 Y147 V167	E139-S143 WeakPolarHBondContact O-CB 3.15Å; E139-S143 PolarHBondContact O-N 3.39Å; H140-S143 WeakPolarHBondContact CA-OG 3.26Å; H140-S143 PolarHBondContact O-N 2.91Å; H140-S143 PolarHBondContact O-OG 2.97Å; S143-K146 PolarHBondContact O-N 3.46Å; S143-Y147 WeakPolarHBondContact O-CB 3.44Å; S143-Y147 PolarHBondContact O-N 3.33Å; S143-V167 WeakPolarHBondContact O-CG2 3.31Å
144	M	98.2	Very high	95.9	Very high	59 Å²	59	89.8 Å²	89.8	29%	0.291	44%	0.444	S	S	.	.	H	α-helix	trans	-65.9	-42.9	176	-78.6	-62.5	-58.3	0	0	111.1	H140 D141 L142 K146 Y147 S148 V167 R171	H140-M144 WeakPolarHBondContact NE2-CG 3.46Å; H140-M144 WeakPolarHBondContact O-CB 3.3Å; H140-M144 WeakPolarHBondContact O-CG 3.39Å; H140-M144 PolarHBondContact O-N 3.47Å; D141-M144 PolarHBondContact O-N 3.07Å; L142-M144 VanDerWaalsContact C-N 3.35Å; M144-K146 VanDerWaalsContact C-N 3.32Å; M144-K146 PolarHBondContact O-N 2.99Å; M144-Y147 PolarHBondContact O-N 3Å; M144-S148 WeakPolarHBondContact O-CB 3.47Å; M144-S148 PolarHBondContact O-N 3.31Å; M144-S148 PolarHBondContact O-OG 3.08Å; M144-S148 VanDerWaalsContact O-OG 3.09Å; M144-V167 HydrophobicContact CG-CG1 4.41Å; M144-V167 HydrophobicContact SD-CG1 3.49Å; M144-V167 WeakPolarHBondContact SD-CG1 3.37Å; M144-V167 HydrophobicContact SD-CG2 4.27Å; M144-R171 PolarHBondContact SD-NH2 2.64Å; M144-R171 VanDerWaalsContact SD-NH2 3.38Å
145	A	98.1	Very high	95	Very high	38 Å²	38	94 Å²	94	31%	0.314	46%	0.457	S	S	.	.	H	α-helix	trans	-60.7	-39.7	175	0	0	0	0	0	112.4	D141 L142 R149	D141-A145 WeakPolarHBondContact O-CB 3.49Å; D141-A145 PolarHBondContact O-N 2.89Å; L142-A145 PolarHBondContact O-N 2.96Å; A145-R149 VanDerWaalsContact O-CG 3.31Å; A145-R149 WeakPolarHBondContact O-CG 3.35Å; A145-R149 PolarHBondContact O-N 2.94Å
146	K	97.3	Very high	94.6	Very high	100 Å²	100	93.1 Å²	93.1	44%	0.435	45%	0.452	S	S	.	.	H	α-helix	trans	-64	-45.7	173.9	-174.4	-177	176.9	-169.2	0	111.1	L142 S143 M144 R149 V163 E166	L142-K146 PolarHBondContact O-N 3.21Å; S143-K146 PolarHBondContact O-N 3.46Å; M144-K146 VanDerWaalsContact C-N 3.32Å; M144-K146 PolarHBondContact O-N 2.99Å; K146-R149 PolarHBondContact O-N 3.42Å; K146-V163 HydrophobicContact CB-CG1 4.46Å; K146-V163 HydrophobicContact CD-CG1 4.23Å; K146-V163 HydrophobicContact CD-CG2 4.36Å; K146-V163 HydrophobicContact CG-CG1 4.07Å; K146-E166 VanDerWaalsContact NZ-CD 3.26Å; K146-E166 IonicContact NZ-OE1 3.18Å; K146-E166 PolarHBondContact NZ-OE1 2.93Å; K146-E166 IonicContact NZ-OE2 2.68Å; K146-E166 PolarHBondContact NZ-OE2 3.36Å
147	Y	97	Very high	94.3	Very high	94 Å²	94	98.1 Å²	98.1	37%	0.369	48%	0.475	S	S	.	.	H	α-helix	trans	-62.7	-43.6	178.3	-175.1	-92.6	0	0	0	112.7	S143 M144 R149 L150 V163 V167	S143-Y147 WeakPolarHBondContact O-CB 3.44Å; S143-Y147 PolarHBondContact O-N 3.33Å; M144-Y147 PolarHBondContact O-N 3Å; Y147-R149 PolarHBondContact O-N 2.89Å; Y147-R149 VanDerWaalsContact O-N 3.16Å; Y147-L150 HydrophobicContact CD2-CD1 3.85Å; Y147-L150 HydrophobicContact CE2-CD1 4.06Å; Y147-L150 HydrophobicContact CG-CD1 4.38Å; Y147-L150 WeakPolarHBondContact O-CB 3.32Å; Y147-L150 VanDerWaalsContact O-CG 3.28Å; Y147-L150 WeakPolarHBondContact O-CG 3.41Å; Y147-L150 PolarHBondContact O-N 3.14Å; Y147-L150 VanDerWaalsContact O-N 3.15Å; Y147-V163 HydrophobicContact CD2-CG1 4.01Å; Y147-V163 HydrophobicContact CG-CG1 4.44Å; Y147-V167 HydrophobicContact CD2-CG2 4.26Å; Y147-V167 HydrophobicContact CG-CG2 4.12Å
148	S	96.5	Very high	94	Very high	93 Å²	93	107.6 Å²	107.6	65%	0.65	51%	0.51	S	S	*	.	H	α-helix	trans	-63.6	-20.2	179.1	-65.6	0	0	0	0	114.1	M144	M144-S148 WeakPolarHBondContact O-CB 3.47Å; M144-S148 PolarHBondContact O-N 3.31Å; M144-S148 PolarHBondContact O-OG 3.08Å; M144-S148 VanDerWaalsContact O-OG 3.09Å
149	R	95.2	Very high	93.7	Very high	206 Å²	206	105.9 Å²	105.9	78%	0.777	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	1.6	179	-67.8	172.7	-168.6	175.4	4.9	113.7	A145 K146 Y147	A145-R149 VanDerWaalsContact O-CG 3.31Å; A145-R149 WeakPolarHBondContact O-CG 3.35Å; A145-R149 PolarHBondContact O-N 2.94Å; K146-R149 PolarHBondContact O-N 3.42Å; Y147-R149 PolarHBondContact O-N 2.89Å; Y147-R149 VanDerWaalsContact O-N 3.16Å
150	L	94.9	Very high	93.5	Very high	52 Å²	52	105.1 Å²	105.1	27%	0.272	50%	0.499	S	S	.	.			trans	-61.5	137.3	178.8	-71.7	173.3	0	0	0	111.6	Y147 K152 V159 K160 V163	Y147-L150 HydrophobicContact CD2-CD1 3.85Å; Y147-L150 HydrophobicContact CE2-CD1 4.06Å; Y147-L150 HydrophobicContact CG-CD1 4.38Å; Y147-L150 WeakPolarHBondContact O-CB 3.32Å; Y147-L150 VanDerWaalsContact O-CG 3.28Å; Y147-L150 WeakPolarHBondContact O-CG 3.41Å; Y147-L150 PolarHBondContact O-N 3.14Å; Y147-L150 VanDerWaalsContact O-N 3.15Å; L150-K152 PolarHBondContact O-N 3.39Å; L150-V159 HydrophobicContact CD2-CG1 4.03Å; L150-K160 HydrophobicContact CD1-CB 4.45Å; L150-K160 HydrophobicContact CD1-CG 4.38Å; L150-V163 HydrophobicContact CD1-CB 4.42Å; L150-V163 HydrophobicContact CD2-CG2 4.44Å
151	P	91.3	Very high	93.3	Very high	80 Å²	80	107.3 Å²	107.3	52%	0.519	51%	0.514	S	S	.	.			trans	-73.9	124.1	-173.5	28.1	-34.4	0	0	0	112.5
152	K	91.4	Very high	93.1	Very high	200 Å²	200	108.2 Å²	108.2	87%	0.87	52%	0.515	S	S	*	.	S	Bend	trans	-72.3	-28.6	179.1	-173.2	174.7	179.9	177.7	0	114.8	L150	L150-K152 PolarHBondContact O-N 3.39Å
153	K	85.6	Confident	93	Very high	211 Å²	211	102.4 Å²	102.4	92%	0.917	49%	0.485	S	S	*	.	S	Bend	trans	-90.8	-24	-172.5	-67.5	-175.3	-179.9	180	0	114.5
154	K	83.7	Confident	93	Very high	179 Å²	179	103 Å²	103	78%	0.778	49%	0.493	S	S	*	.	S	Bend	trans	-133.3	81.8	-179.8	-72.8	-172.2	178.9	-177.5	0	108
155	E	80.6	Confident	93	Very high	116 Å²	116	107.3 Å²	107.3	54%	0.542	51%	0.51	S	S	.	.			trans	-79.5	123.3	-173.3	-148.8	166	-163.6	0	0	110.2	K160	E155-K160 HydrophobicContact CG-CD 4.17Å; E155-K160 WeakPolarHBondContact OE1-CD 3.42Å; E155-K160 WeakPolarHBondContact OE1-CE 3.48Å; E155-K160 IonicContact OE1-NZ 3.48Å; E155-K160 PolarHBondContact OE1-NZ 3.43Å
156	N	90.3	Very high	92.9	Very high	90 Å²	90	108.9 Å²	108.9	48%	0.481	51%	0.511	S	S	.	.			trans	-104.6	103.3	172.2	-178.2	-29.7	0	0	0	108.1	R158 V159 K160	N156-R158 PolarHBondContact O-N 3.01Å; N156-R158 WeakPolarHBondContact OD1-CB 3.35Å; N156-R158 PolarHBondContact OD1-N 3.36Å; N156-R158 VanDerWaalsContact OD1-N 3.12Å; N156-V159 HydrophobicContact CB-CB 4.15Å; N156-V159 HydrophobicContact CB-CG2 4.18Å; N156-V159 PolarHBondContact O-N 3.37Å; N156-V159 PolarHBondContact OD1-N 3.25Å; N156-K160 WeakPolarHBondContact O-CB 3.48Å; N156-K160 PolarHBondContact O-N 3.19Å
157	E	91.7	Very high	93	Very high	106 Å²	106	104.6 Å²	104.6	50%	0.495	49%	0.494	S	S	.	.	H	α-helix	trans	-58.5	-34	-175.5	-76.1	-57.6	132.9	0	0	113.3	K160 T161	E157-K160 IonicContact OE1-NZ 3.33Å; E157-T161 VanDerWaalsContact O-CB 3.3Å; E157-T161 WeakPolarHBondContact O-CB 3.47Å; E157-T161 PolarHBondContact O-N 3.12Å; E157-T161 PolarHBondContact O-OG1 3.42Å
158	R	92.1	Very high	93.1	Very high	205 Å²	205	102.9 Å²	102.9	77%	0.774	50%	0.498	S	S	*	.	H	α-helix	trans	-66.1	-49.7	177.4	-172.5	178.3	177.9	174.9	0.7	110.9	N156 T161 E162	N156-R158 PolarHBondContact O-N 3.01Å; N156-R158 WeakPolarHBondContact OD1-CB 3.35Å; N156-R158 PolarHBondContact OD1-N 3.36Å; N156-R158 VanDerWaalsContact OD1-N 3.12Å; R158-T161 PolarHBondContact O-N 3.39Å; R158-E162 WeakPolarHBondContact O-CB 3.34Å; R158-E162 PolarHBondContact O-N 3.31Å
159	V	92.9	Very high	93.1	Very high	61 Å²	61	102.1 Å²	102.1	37%	0.37	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-42.3	179.9	175.3	0	0	0	0	111	L150 N156 T161 E162 V163	L150-V159 HydrophobicContact CD2-CG1 4.03Å; N156-V159 HydrophobicContact CB-CB 4.15Å; N156-V159 HydrophobicContact CB-CG2 4.18Å; N156-V159 PolarHBondContact O-N 3.37Å; N156-V159 PolarHBondContact OD1-N 3.25Å; V159-T161 PolarHBondContact O-N 3.34Å; V159-E162 PolarHBondContact O-N 2.94Å; V159-V163 HydrophobicContact CG1-CG2 4.29Å; V159-V163 WeakPolarHBondContact O-CG2 3.41Å; V159-V163 PolarHBondContact O-N 2.95Å
160	K	93.3	Very high	93.3	Very high	68 Å²	68	92.5 Å²	92.5	30%	0.296	46%	0.458	S	S	.	.	H	α-helix	trans	-59.3	-45.8	176.4	178.8	-178.3	173.3	-175.6	0	111.8	L150 E155 N156 E157 G164	L150-K160 HydrophobicContact CD1-CB 4.45Å; L150-K160 HydrophobicContact CD1-CG 4.38Å; E155-K160 HydrophobicContact CG-CD 4.17Å; E155-K160 WeakPolarHBondContact OE1-CD 3.42Å; E155-K160 WeakPolarHBondContact OE1-CE 3.48Å; E155-K160 IonicContact OE1-NZ 3.48Å; E155-K160 PolarHBondContact OE1-NZ 3.43Å; N156-K160 WeakPolarHBondContact O-CB 3.48Å; N156-K160 PolarHBondContact O-N 3.19Å; E157-K160 IonicContact OE1-NZ 3.33Å; K160-G164 PolarHBondContact O-N 2.96Å
161	T	94.4	Very high	93.5	Very high	70 Å²	70	95 Å²	95	43%	0.429	46%	0.464	S	S	.	.	H	α-helix	trans	-65.6	-40.7	178.6	-57.4	0	0	0	0	111.7	E157 R158 V159 G164 K165	E157-T161 VanDerWaalsContact O-CB 3.3Å; E157-T161 WeakPolarHBondContact O-CB 3.47Å; E157-T161 PolarHBondContact O-N 3.12Å; E157-T161 PolarHBondContact O-OG1 3.42Å; R158-T161 PolarHBondContact O-N 3.39Å; V159-T161 PolarHBondContact O-N 3.34Å; T161-G164 PolarHBondContact O-N 3.49Å; T161-K165 WeakPolarHBondContact O-CG 3.33Å; T161-K165 PolarHBondContact O-N 3.36Å
162	E	95	Very high	93.8	Very high	106 Å²	106	100.6 Å²	100.6	50%	0.495	47%	0.474	S	S	.	.	H	α-helix	trans	-65.2	-51.1	179.1	-172.2	171.8	-174.3	0	0	111.8	R158 V159 G164 K165 E166	R158-E162 WeakPolarHBondContact O-CB 3.34Å; R158-E162 PolarHBondContact O-N 3.31Å; V159-E162 PolarHBondContact O-N 2.94Å; E162-G164 VanDerWaalsContact C-N 3.28Å; E162-G164 PolarHBondContact O-N 3.36Å; E162-K165 WeakPolarHBondContact O-CB 3.47Å; E162-K165 PolarHBondContact O-N 3.5Å; E162-K165 VanDerWaalsContact O-N 3.1Å; E162-E166 PolarHBondContact O-N 2.84Å
163	V	96.2	Very high	94.1	Very high	5 Å²	5	96.1 Å²	96.1	3%	0.03	46%	0.455	C	S	.	.	H	α-helix	trans	-64.5	-34.7	176.5	-177.3	0	0	0	0	111.2	K146 Y147 L150 V159 K165 E166 V167	K146-V163 HydrophobicContact CB-CG1 4.46Å; K146-V163 HydrophobicContact CD-CG1 4.23Å; K146-V163 HydrophobicContact CD-CG2 4.36Å; K146-V163 HydrophobicContact CG-CG1 4.07Å; Y147-V163 HydrophobicContact CD2-CG1 4.01Å; Y147-V163 HydrophobicContact CG-CG1 4.44Å; L150-V163 HydrophobicContact CD1-CB 4.42Å; L150-V163 HydrophobicContact CD2-CG2 4.44Å; V159-V163 HydrophobicContact CG1-CG2 4.29Å; V159-V163 WeakPolarHBondContact O-CG2 3.41Å; V159-V163 PolarHBondContact O-N 2.95Å; V163-K165 VanDerWaalsContact C-N 3.35Å; V163-K165 PolarHBondContact O-N 2.99Å; V163-E166 WeakPolarHBondContact O-CB 3.31Å; V163-E166 PolarHBondContact O-N 2.87Å; V163-V167 WeakPolarHBondContact O-CG2 3.27Å; V163-V167 PolarHBondContact O-N 3.17Å
164	G	97.3	Very high	94.8	Very high	25 Å²	25	86.6 Å²	86.6	26%	0.258	41%	0.413	S	S	.	.	H	α-helix	trans	-62.3	-38.7	172.5	0	0	0	0	0	113.2	K160 T161 E162 A168	K160-G164 PolarHBondContact O-N 2.96Å; T161-G164 PolarHBondContact O-N 3.49Å; E162-G164 VanDerWaalsContact C-N 3.28Å; E162-G164 PolarHBondContact O-N 3.36Å; G164-A168 WeakPolarHBondContact O-CB 3.45Å; G164-A168 PolarHBondContact O-N 2.95Å
165	K	97.7	Very high	95.5	Very high	149 Å²	149	80.7 Å²	80.7	65%	0.648	39%	0.389	S	S	*	.	H	α-helix	trans	-67.7	-40.3	173.2	-75.1	177	179.7	-178.5	0	112	T161 E162 V163 A168 S169	T161-K165 WeakPolarHBondContact O-CG 3.33Å; T161-K165 PolarHBondContact O-N 3.36Å; E162-K165 WeakPolarHBondContact O-CB 3.47Å; E162-K165 PolarHBondContact O-N 3.5Å; E162-K165 VanDerWaalsContact O-N 3.1Å; V163-K165 VanDerWaalsContact C-N 3.35Å; V163-K165 PolarHBondContact O-N 2.99Å; K165-A168 PolarHBondContact O-N 3.37Å; K165-S169 WeakPolarHBondContact O-CB 3.26Å; K165-S169 PolarHBondContact O-N 3.27Å
166	E	97.4	Very high	96.3	Very high	70 Å²	70	79.9 Å²	79.9	33%	0.327	39%	0.387	S	S	.	.	H	α-helix	trans	-57.9	-49.4	174.1	-69.5	174.4	-173.9	0	0	111	K146 E162 V163 A168 S169 A170	K146-E166 VanDerWaalsContact NZ-CD 3.26Å; K146-E166 IonicContact NZ-OE1 3.18Å; K146-E166 PolarHBondContact NZ-OE1 2.93Å; K146-E166 IonicContact NZ-OE2 2.68Å; K146-E166 PolarHBondContact NZ-OE2 3.36Å; E162-E166 PolarHBondContact O-N 2.84Å; V163-E166 WeakPolarHBondContact O-CB 3.31Å; V163-E166 PolarHBondContact O-N 2.87Å; E166-A168 PolarHBondContact O-N 2.91Å; E166-S169 WeakPolarHBondContact O-CB 3.47Å; E166-S169 PolarHBondContact O-N 3.36Å; E166-A170 PolarHBondContact O-N 2.98Å
167	V	98.4	Very high	96.7	Very high	11 Å²	11	76 Å²	76	7%	0.067	37%	0.368	C	S	.	.	H	α-helix	trans	-59	-46.8	176	170	0	0	0	0	111.6	S143 M144 Y147 V163 S169 A170 R171	S143-V167 WeakPolarHBondContact O-CG2 3.31Å; M144-V167 HydrophobicContact CG-CG1 4.41Å; M144-V167 HydrophobicContact SD-CG1 3.49Å; M144-V167 WeakPolarHBondContact SD-CG1 3.37Å; M144-V167 HydrophobicContact SD-CG2 4.27Å; Y147-V167 HydrophobicContact CD2-CG2 4.26Å; Y147-V167 HydrophobicContact CG-CG2 4.12Å; V163-V167 WeakPolarHBondContact O-CG2 3.27Å; V163-V167 PolarHBondContact O-N 3.17Å; V167-S169 VanDerWaalsContact C-N 3.27Å; V167-S169 PolarHBondContact O-N 3.38Å; V167-A170 PolarHBondContact O-N 3.41Å; V167-R171 VanDerWaalsContact O-CB 3.24Å; V167-R171 WeakPolarHBondContact O-CB 3.36Å; V167-R171 PolarHBondContact O-N 2.94Å
168	A	98.3	Very high	97	Very high	57 Å²	57	71 Å²	71	47%	0.471	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-37.9	179.8	0	0	0	0	0	112.1	G164 K165 E166 R172	G164-A168 WeakPolarHBondContact O-CB 3.45Å; G164-A168 PolarHBondContact O-N 2.95Å; K165-A168 PolarHBondContact O-N 3.37Å; E166-A168 PolarHBondContact O-N 2.91Å; A168-R172 WeakPolarHBondContact O-CB 3.45Å; A168-R172 PolarHBondContact O-N 3.38Å
169	S	98.4	Very high	97.3	Very high	78 Å²	78	63.7 Å²	63.7	55%	0.545	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-51.1	175.4	-173.1	0	0	0	0	111.7	K165 E166 V167 R171 R172 K173	K165-S169 WeakPolarHBondContact O-CB 3.26Å; K165-S169 PolarHBondContact O-N 3.27Å; E166-S169 WeakPolarHBondContact O-CB 3.47Å; E166-S169 PolarHBondContact O-N 3.36Å; V167-S169 VanDerWaalsContact C-N 3.27Å; V167-S169 PolarHBondContact O-N 3.38Å; S169-R171 PolarHBondContact O-N 3.03Å; S169-R172 PolarHBondContact O-N 3.35Å; S169-K173 PolarHBondContact O-N 3.41Å
170	A	98.4	Very high	97.6	Very high	3 Å²	3	65.3 Å²	65.3	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-61.9	-42.6	179.5	0	0	0	0	0	111.7	E139 H140 E166 V167 R172 K173 Q174	E139-A170 HydrophobicContact CG-CB 4.28Å; H140-A170 HydrophobicContact CB-CB 4.17Å; E166-A170 PolarHBondContact O-N 2.98Å; V167-A170 PolarHBondContact O-N 3.41Å; A170-R172 PolarHBondContact O-N 2.71Å; A170-K173 WeakPolarHBondContact O-CB 3.36Å; A170-K173 PolarHBondContact O-N 2.98Å; A170-Q174 PolarHBondContact O-N 3.32Å
171	R	98.6	Very high	97.9	Very high	106 Å²	106	62.1 Å²	62.1	40%	0.4	31%	0.31	S	S	.	.	H	α-helix	trans	-61.5	-42.2	175	-172.5	175.9	-62.2	174.2	1.6	112.4	L13 H140 M144 V167 S169 K173 Q174 H175	L13-R171 HydrophobicContact CD1-CG 4.17Å; H140-R171 PolarHBondContact NE2-NE 3.18Å; M144-R171 PolarHBondContact SD-NH2 2.64Å; M144-R171 VanDerWaalsContact SD-NH2 3.38Å; V167-R171 VanDerWaalsContact O-CB 3.24Å; V167-R171 WeakPolarHBondContact O-CB 3.36Å; V167-R171 PolarHBondContact O-N 2.94Å; S169-R171 PolarHBondContact O-N 3.03Å; R171-K173 VanDerWaalsContact C-N 3.33Å; R171-Q174 PolarHBondContact O-N 2.81Å; R171-H175 WeakPolarHBondContact O-CB 3.25Å; R171-H175 PolarHBondContact O-N 2.85Å
172	R	98.4	Very high	98.1	Very high	197 Å²	197	58.8 Å²	58.8	74%	0.743	29%	0.29	S	S	*	.	H	α-helix	trans	-62.9	-42.7	176.4	-177.2	-176.5	-66.6	-160.4	-1.8	110.9	A168 S169 A170 H175 L176	A168-R172 WeakPolarHBondContact O-CB 3.45Å; A168-R172 PolarHBondContact O-N 3.38Å; S169-R172 PolarHBondContact O-N 3.35Å; A170-R172 PolarHBondContact O-N 2.71Å; R172-H175 PolarHBondContact O-N 3.36Å; R172-L176 WeakPolarHBondContact O-CB 3.43Å; R172-L176 PolarHBondContact O-N 3.28Å
173	K	98.4	Very high	98.2	Very high	106 Å²	106	56.6 Å²	56.6	46%	0.461	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-47.8	177.4	-170.9	-178.2	174.4	-172.8	0	111.2	A136 E139 S169 A170 R171 H175 L176 S177	A136-K173 HydrophobicContact CB-CD 4.36Å; A136-K173 HydrophobicContact CB-CG 4Å; E139-K173 WeakPolarHBondContact OE2-CD 3.48Å; E139-K173 IonicContact OE2-NZ 2.78Å; E139-K173 PolarHBondContact OE2-NZ 3.42Å; S169-K173 PolarHBondContact O-N 3.41Å; A170-K173 WeakPolarHBondContact O-CB 3.36Å; A170-K173 PolarHBondContact O-N 2.98Å; R171-K173 VanDerWaalsContact C-N 3.33Å; K173-H175 PolarHBondContact O-N 2.99Å; K173-L176 PolarHBondContact O-N 3.01Å; K173-S177 WeakPolarHBondContact O-CB 3.44Å; K173-S177 PolarHBondContact O-N 3.45Å; K173-S177 PolarHBondContact O-OG 3.46Å
174	Q	98.6	Very high	98.3	Very high	10 Å²	10	56.8 Å²	56.8	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-56.2	-52.4	174.8	-173.1	-170.5	-0.2	0	0	110.8	D15 F133 A136 H140 A170 R171 L176 S177 S178	D15-Q174 PolarHBondContact OD2-NE2 2.98Å; F133-Q174 HydrophobicContact CE2-CG 4.05Å; A136-Q174 HydrophobicContact CB-CB 4.39Å; H140-Q174 HydrophobicContact CB-CB 4.36Å; H140-Q174 VanDerWaalsContact CG-OE1 3.23Å; H140-Q174 PolarHBondContact ND1-OE1 3.35Å; A170-Q174 PolarHBondContact O-N 3.32Å; R171-Q174 PolarHBondContact O-N 2.81Å; Q174-L176 PolarHBondContact O-N 3.47Å; Q174-S177 WeakPolarHBondContact CA-OG 3.46Å; Q174-S177 PolarHBondContact O-N 3.05Å; Q174-S177 PolarHBondContact O-OG 3.48Å; Q174-S178 WeakPolarHBondContact O-CB 3.21Å; Q174-S178 PolarHBondContact O-N 3.07Å; Q174-S178 PolarHBondContact O-OG 3.12Å
175	H	98.6	Very high	98.3	Very high	55 Å²	55	55.6 Å²	55.6	26%	0.255	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-41.3	-178.8	-176.2	-151.7	0	0	0	112.9	L13 R171 R172 K173 S178 L179	L13-H175 HydrophobicContact CD1-CB 3.96Å; R171-H175 WeakPolarHBondContact O-CB 3.25Å; R171-H175 PolarHBondContact O-N 2.85Å; R172-H175 PolarHBondContact O-N 3.36Å; K173-H175 PolarHBondContact O-N 2.99Å; H175-S178 WeakPolarHBondContact CA-OG 3.25Å; H175-S178 PolarHBondContact O-OG 3.25Å; H175-L179 WeakPolarHBondContact O-CB 3.5Å; H175-L179 VanDerWaalsContact O-CG 3.24Å; H175-L179 WeakPolarHBondContact O-CG 3.43Å; H175-L179 PolarHBondContact O-N 3.45Å; H175-L179 VanDerWaalsContact O-N 3.08Å
176	L	98.5	Very high	98.3	Very high	99 Å²	99	49.2 Å²	49.2	52%	0.518	25%	0.248	S	C	.	.	H	α-helix	trans	-63.7	-48.5	175.7	177.9	61.8	0	0	0	111.3	R172 K173 Q174 S178 L179 Q180	R172-L176 WeakPolarHBondContact O-CB 3.43Å; R172-L176 PolarHBondContact O-N 3.28Å; K173-L176 PolarHBondContact O-N 3.01Å; Q174-L176 PolarHBondContact O-N 3.47Å; L176-S178 PolarHBondContact O-N 2.84Å; L176-L179 PolarHBondContact O-N 2.96Å; L176-Q180 WeakPolarHBondContact O-CG 3.38Å; L176-Q180 PolarHBondContact O-N 2.83Å
177	S	98.5	Very high	98.2	Very high	10 Å²	10	47.4 Å²	47.4	7%	0.07	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-37.3	-179.9	62	0	0	0	0	112.8	A136 K173 Q174 Q180 Y181	A136-S177 WeakPolarHBondContact CB-OG 3.39Å; K173-S177 WeakPolarHBondContact O-CB 3.44Å; K173-S177 PolarHBondContact O-N 3.45Å; K173-S177 PolarHBondContact O-OG 3.46Å; Q174-S177 WeakPolarHBondContact CA-OG 3.46Å; Q174-S177 PolarHBondContact O-N 3.05Å; Q174-S177 PolarHBondContact O-OG 3.48Å; S177-Q180 PolarHBondContact O-N 3.44Å; S177-Y181 VanDerWaalsContact O-CB 3.31Å; S177-Y181 WeakPolarHBondContact O-CB 3.43Å; S177-Y181 PolarHBondContact O-N 3Å
178	S	98.5	Very high	98.1	Very high	1 Å²	1	47 Å²	47	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-42.1	175.4	60.7	0	0	0	0	111.7	Q174 H175 L176 Q180 Y181 Y182	Q174-S178 WeakPolarHBondContact O-CB 3.21Å; Q174-S178 PolarHBondContact O-N 3.07Å; Q174-S178 PolarHBondContact O-OG 3.12Å; H175-S178 WeakPolarHBondContact CA-OG 3.25Å; H175-S178 PolarHBondContact O-OG 3.25Å; L176-S178 PolarHBondContact O-N 2.84Å; S178-Q180 PolarHBondContact O-N 3.05Å; S178-Y181 PolarHBondContact O-N 2.84Å; S178-Y182 WeakPolarHBondContact O-CB 3.39Å; S178-Y182 WeakPolarHBondContact O-CD1 3.33Å; S178-Y182 PolarHBondContact O-N 2.82Å
179	L	98.6	Very high	98	Very high	50 Å²	50	45.1 Å²	45.1	26%	0.262	22%	0.224	S	C	.	.	H	α-helix	trans	-62	-44.9	176.8	-73.6	172.9	0	0	0	111.4	L9 A12 H175 L176 Y181 C183	L9-L179 HydrophobicContact CB-CD2 3.85Å; L9-L179 HydrophobicContact CD2-CD2 4.16Å; L9-L179 HydrophobicContact CG-CD2 4.49Å; L9-L179 WeakPolarHBondContact O-CD2 3.41Å; A12-L179 HydrophobicContact CB-CD2 3.86Å; A12-L179 HydrophobicContact CB-CG 4.33Å; H175-L179 WeakPolarHBondContact O-CB 3.5Å; H175-L179 VanDerWaalsContact O-CG 3.24Å; H175-L179 WeakPolarHBondContact O-CG 3.43Å; H175-L179 PolarHBondContact O-N 3.45Å; H175-L179 VanDerWaalsContact O-N 3.08Å; L176-L179 PolarHBondContact O-N 2.96Å; L179-Y181 VanDerWaalsContact C-N 3.35Å; L179-C183 VanDerWaalsContact O-CB 3.27Å; L179-C183 WeakPolarHBondContact O-CB 3.42Å; L179-C183 PolarHBondContact O-N 2.88Å; L179-C183 PolarHBondContact O-SG 3.46Å
180	Q	98.6	Very high	97.8	Very high	95 Å²	95	48 Å²	48	44%	0.444	22%	0.224	S	C	.	.	H	α-helix	trans	-61.8	-45	176.1	-70.9	177.3	-35.3	0	0	111.1	L129 L176 S177 S178 C183 A184	L129-Q180 HydrophobicContact CD2-CB 3.95Å; L176-Q180 WeakPolarHBondContact O-CG 3.38Å; L176-Q180 PolarHBondContact O-N 2.83Å; S177-Q180 PolarHBondContact O-N 3.44Å; S178-Q180 PolarHBondContact O-N 3.05Å; Q180-C183 PolarHBondContact O-N 2.92Å; Q180-A184 WeakPolarHBondContact O-CB 3.42Å; Q180-A184 PolarHBondContact O-N 3.47Å
181	Y	98.7	Very high	97.7	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-44.6	-179.4	-173.4	-142.8	0	0	0	112.7	L23 E27 V126 L129 K130 F133 S177 S178 L179 C183 A184 L185	L23-Y181 HydrophobicContact CD1-CD1 4.13Å; L23-Y181 HydrophobicContact CD1-CE1 3.84Å; L23-Y181 HydrophobicContact CD2-CE1 4.37Å; L23-Y181 HydrophobicContact CG-CE1 4.44Å; E27-Y181 HydrophobicContact CG-CE1 4.48Å; E27-Y181 WeakPolarHBondContact CG-OH 3.42Å; E27-Y181 WeakPolarHBondContact OE1-CE1 3.47Å; E27-Y181 PolarHBondContact OE1-OH 2.73Å; V126-Y181 HydrophobicContact CG1-CE2 3.95Å; V126-Y181 WeakPolarHBondContact O-CE2 3.17Å; L129-Y181 HydrophobicContact CB-CD2 3.81Å; L129-Y181 HydrophobicContact CB-CG 4.4Å; K130-Y181 HydrophobicContact CB-CD2 4.46Å; K130-Y181 HydrophobicContact CB-CE1 4.13Å; K130-Y181 HydrophobicContact CB-CE2 3.7Å; K130-Y181 WeakPolarHBondContact CB-OH 3.35Å; K130-Y181 WeakPolarHBondContact CD-OH 3.43Å; K130-Y181 HydrophobicContact CG-CE1 4.15Å; K130-Y181 HydrophobicContact CG-CE2 4.47Å; K130-Y181 WeakPolarHBondContact CG-OH 3.2Å; F133-Y181 HydrophobicContact CB-CD1 4.25Å; F133-Y181 AromaticContact CD1-CD1 3.85Å; F133-Y181 HydrophobicContact CD1-CD1 3.85Å; F133-Y181 HydrophobicContact CD1-CE1 4.3Å; F133-Y181 HydrophobicContact CG-CD1 4.25Å; S177-Y181 VanDerWaalsContact O-CB 3.31Å; S177-Y181 WeakPolarHBondContact O-CB 3.43Å; S177-Y181 PolarHBondContact O-N 3Å; S178-Y181 PolarHBondContact O-N 2.84Å; L179-Y181 VanDerWaalsContact C-N 3.35Å; Y181-C183 VanDerWaalsContact C-N 3.34Å; Y181-C183 PolarHBondContact O-N 3.29Å; Y181-A184 PolarHBondContact O-N 3.04Å; Y181-L185 HydrophobicContact CD1-CD1 4.28Å; Y181-L185 HydrophobicContact CD2-CD1 4.18Å; Y181-L185 HydrophobicContact CD2-CG 4.18Å; Y181-L185 HydrophobicContact CE1-CD1 3.88Å; Y181-L185 HydrophobicContact CE2-CD1 3.77Å; Y181-L185 HydrophobicContact CE2-CD2 4.18Å; Y181-L185 HydrophobicContact CE2-CG 3.8Å; Y181-L185 HydrophobicContact CG-CD1 4.41Å; Y181-L185 PolarHBondContact O-N 2.82Å
182	Y	98.3	Very high	97.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-39.5	178.6	-69.7	12.9	0	0	0	111.1	L7 A12 T19 L23 S178 L185 N186	L7-Y182 HydrophobicContact CB-CD2 4.1Å; L7-Y182 HydrophobicContact CB-CG 4.1Å; L7-Y182 HydrophobicContact CD1-CD1 4.06Å; L7-Y182 HydrophobicContact CD1-CG 4.05Å; A12-Y182 HydrophobicContact CB-CD2 4.09Å; A12-Y182 HydrophobicContact CB-CE2 3.87Å; T19-Y182 HydrophobicContact CG2-CE2 3.88Å; L23-Y182 HydrophobicContact CD1-CD1 3.85Å; L23-Y182 HydrophobicContact CD1-CE1 3.58Å; L23-Y182 HydrophobicContact CD2-CE1 3.69Å; L23-Y182 HydrophobicContact CG-CE1 4.13Å; S178-Y182 WeakPolarHBondContact O-CB 3.39Å; S178-Y182 WeakPolarHBondContact O-CD1 3.33Å; S178-Y182 PolarHBondContact O-N 2.82Å; Y182-L185 PolarHBondContact O-N 2.82Å; Y182-N186 VanDerWaalsContact O-CB 3.32Å; Y182-N186 WeakPolarHBondContact O-CB 3.42Å; Y182-N186 PolarHBondContact O-N 3.19Å; Y182-N186 PolarHBondContact O-ND2 3.49Å
183	C	97.9	Very high	97.3	Very high	59 Å²	59	43.7 Å²	43.7	40%	0.399	21%	0.208	S	C	.	.	H	α-helix	trans	-60	-45.4	172.3	-78.6	0	0	0	0	111.8	L179 Q180 Y181 N186 A187	L179-C183 VanDerWaalsContact O-CB 3.27Å; L179-C183 WeakPolarHBondContact O-CB 3.42Å; L179-C183 PolarHBondContact O-N 2.88Å; L179-C183 PolarHBondContact O-SG 3.46Å; Q180-C183 PolarHBondContact O-N 2.92Å; Y181-C183 VanDerWaalsContact C-N 3.34Å; Y181-C183 PolarHBondContact O-N 3.29Å; C183-N186 PolarHBondContact O-N 2.85Å; C183-A187 WeakPolarHBondContact O-CB 3.18Å; C183-A187 PolarHBondContact O-N 3.29Å
184	A	98.2	Very high	97.1	Very high	9 Å²	9	43.2 Å²	43.2	7%	0.074	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-45.4	178.8	0	0	0	0	0	111.9	V126 L129 Q180 Y181 A187 L188	V126-A184 HydrophobicContact CG2-CB 4.29Å; L129-A184 HydrophobicContact CD1-CB 3.51Å; Q180-A184 WeakPolarHBondContact O-CB 3.42Å; Q180-A184 PolarHBondContact O-N 3.47Å; Y181-A184 PolarHBondContact O-N 3.04Å; A184-A187 PolarHBondContact O-N 3.33Å; A184-L188 WeakPolarHBondContact O-CB 3.46Å; A184-L188 PolarHBondContact O-N 2.93Å
185	L	97.9	Very high	96.9	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-41.3	176.3	-74.8	172.7	0	0	0	112.6	L7 L23 F26 A30 V126 Y181 Y182 L188 Q189	L7-L185 HydrophobicContact CD1-CB 3.91Å; L7-L185 HydrophobicContact CD1-CD1 3.74Å; L23-L185 HydrophobicContact CD1-CD1 3.46Å; L23-L185 VanDerWaalsContact CD1-CD1 3.46Å; F26-L185 HydrophobicContact CB-CD1 4.03Å; F26-L185 HydrophobicContact CB-CD2 4.44Å; F26-L185 HydrophobicContact CD1-CB 4.09Å; A30-L185 HydrophobicContact CB-CD2 4.27Å; V126-L185 HydrophobicContact CG1-CD2 3.67Å; V126-L185 HydrophobicContact CG1-CG 4.44Å; Y181-L185 HydrophobicContact CD1-CD1 4.28Å; Y181-L185 HydrophobicContact CD2-CD1 4.18Å; Y181-L185 HydrophobicContact CD2-CG 4.18Å; Y181-L185 HydrophobicContact CE1-CD1 3.88Å; Y181-L185 HydrophobicContact CE2-CD1 3.77Å; Y181-L185 HydrophobicContact CE2-CD2 4.18Å; Y181-L185 HydrophobicContact CE2-CG 3.8Å; Y181-L185 HydrophobicContact CG-CD1 4.41Å; Y181-L185 PolarHBondContact O-N 2.82Å; Y182-L185 PolarHBondContact O-N 2.82Å; L185-L188 HydrophobicContact CD2-CD2 4.48Å; L185-L188 WeakPolarHBondContact O-CB 3.45Å; L185-L188 PolarHBondContact O-N 2.93Å; L185-Q189 PolarHBondContact O-N 3.06Å
186	N	96.6	Very high	96.7	Very high	15 Å²	15	42.5 Å²	42.5	8%	0.08	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-42.6	173.9	-76.3	-29.2	0	0	0	111.7	R6 L7 Y182 C183 L188 Q189 Y190	R6-N186 HydrophobicContact CG-CB 4.5Å; R6-N186 VanDerWaalsContact CG-OD1 3.29Å; R6-N186 WeakPolarHBondContact CG-OD1 3.41Å; L7-N186 PolarHBondContact N-OD1 3.3Å; L7-N186 PolarHBondContact O-ND2 3.16Å; Y182-N186 VanDerWaalsContact O-CB 3.32Å; Y182-N186 WeakPolarHBondContact O-CB 3.42Å; Y182-N186 PolarHBondContact O-N 3.19Å; Y182-N186 PolarHBondContact O-ND2 3.49Å; C183-N186 PolarHBondContact O-N 2.85Å; N186-L188 VanDerWaalsContact C-N 3.33Å; N186-Q189 PolarHBondContact O-N 3.41Å; N186-Y190 WeakPolarHBondContact O-CD2 3.34Å
187	A	96.5	Very high	96.6	Very high	32 Å²	32	43.5 Å²	43.5	26%	0.264	21%	0.211	S	C	.	.	H	α-helix	trans	-65.2	-37.6	175.8	0	0	0	0	0	111.8	C183 A184 Q189 Y190 R191	C183-A187 WeakPolarHBondContact O-CB 3.18Å; C183-A187 PolarHBondContact O-N 3.29Å; A184-A187 PolarHBondContact O-N 3.33Å; A187-Q189 PolarHBondContact O-N 2.92Å; A187-Y190 PolarHBondContact O-N 3.12Å; A187-R191 PolarHBondContact O-N 3.02Å
188	L	96.9	Very high	96.5	Very high	2 Å²	2	48 Å²	48	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-58.3	-33.7	178.4	-174.7	62.9	0	0	0	112	A30 L33 F118 L123 V126 A184 L185 N186 Y190 R191 K192	A30-L188 HydrophobicContact CB-CD2 4.03Å; L33-L188 HydrophobicContact CD2-CD1 4.19Å; L33-L188 HydrophobicContact CD2-CD2 4.28Å; L33-L188 HydrophobicContact CD2-CG 4.17Å; F118-L188 HydrophobicContact CE2-CD1 3.81Å; F118-L188 HydrophobicContact CZ-CD1 3.69Å; L123-L188 HydrophobicContact CD2-CD1 3.84Å; L123-L188 HydrophobicContact CD2-CD2 4.27Å; V126-L188 HydrophobicContact CG1-CD2 4.32Å; V126-L188 HydrophobicContact CG2-CB 4.41Å; V126-L188 HydrophobicContact CG2-CD2 3.95Å; A184-L188 WeakPolarHBondContact O-CB 3.46Å; A184-L188 PolarHBondContact O-N 2.93Å; L185-L188 HydrophobicContact CD2-CD2 4.48Å; L185-L188 WeakPolarHBondContact O-CB 3.45Å; L185-L188 PolarHBondContact O-N 2.93Å; N186-L188 VanDerWaalsContact C-N 3.33Å; L188-Y190 PolarHBondContact O-N 3.34Å; L188-R191 PolarHBondContact O-N 3.44Å; L188-K192 WeakPolarHBondContact O-CB 3.34Å; L188-K192 PolarHBondContact O-N 2.98Å
189	Q	94.5	Very high	96.5	Very high	18 Å²	18	48 Å²	48	8%	0.084	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-26.6	176.3	-63.4	-57.3	-37.9	0	0	113.7	V4 F26 D29 L185 N186 A187	V4-Q189 HydrophobicContact CG1-CB 3.53Å; V4-Q189 HydrophobicContact CG1-CG 3.8Å; F26-Q189 HydrophobicContact CE1-CG 4.05Å; D29-Q189 PolarHBondContact OD2-NE2 3.39Å; L185-Q189 PolarHBondContact O-N 3.06Å; N186-Q189 PolarHBondContact O-N 3.41Å; A187-Q189 PolarHBondContact O-N 2.92Å
190	Y	94.6	Very high	96.5	Very high	137 Å²	137	50.5 Å²	50.5	54%	0.537	24%	0.243	S	C	.	.	H	α-helix	trans	-90	-44.9	172.7	-62.6	-84.4	0	0	0	111.4	N186 A187 L188 K192 R193 M194	N186-Y190 WeakPolarHBondContact O-CD2 3.34Å; A187-Y190 PolarHBondContact O-N 3.12Å; L188-Y190 PolarHBondContact O-N 3.34Å; Y190-K192 VanDerWaalsContact C-N 3.26Å; Y190-K192 PolarHBondContact O-N 3.36Å; Y190-R193 PolarHBondContact O-N 3.18Å; Y190-M194 PolarHBondContact O-N 3.46Å
191	R	95.9	Very high	96.5	Very high	74 Å²	74	50.1 Å²	50.1	28%	0.279	24%	0.244	S	C	.	.	H	α-helix	trans	-57.7	-38.9	178.7	-64.8	-172.1	-169.6	160.5	7.5	111.5	F118 D122 E125 A187 L188 R193 M194 A195	F118-R191 HydrophobicContact CD2-CB 4.4Å; F118-R191 HydrophobicContact CE2-CB 3.83Å; D122-R191 WeakPolarHBondContact OD1-CD 3.36Å; D122-R191 IonicContact OD1-CZ 2.71Å; D122-R191 IonicContact OD1-NE 3.99Å; D122-R191 IonicContact OD1-NH1 2.81Å; D122-R191 PolarHBondContact OD1-NH1 3.19Å; E125-R191 IonicContact OE2-CZ 2.62Å; E125-R191 IonicContact OE2-NH1 2.83Å; E125-R191 PolarHBondContact OE2-NH1 3.01Å; E125-R191 IonicContact OE2-NH2 2.99Å; A187-R191 PolarHBondContact O-N 3.02Å; L188-R191 PolarHBondContact O-N 3.44Å; R191-R193 VanDerWaalsContact C-N 3.28Å; R191-R193 PolarHBondContact O-N 2.84Å; R191-M194 HydrophobicContact CG-CE 4.39Å; R191-M194 PolarHBondContact O-N 3.4Å; R191-A195 VanDerWaalsContact O-CB 3.26Å; R191-A195 WeakPolarHBondContact O-CB 3.47Å; R191-A195 PolarHBondContact O-N 2.94Å
192	K	94.8	Very high	96.4	Very high	43 Å²	43	50.5 Å²	50.5	19%	0.187	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-37.1	176.8	80.3	-179	-175.2	-178.9	0	112.9	D29 L33 F118 L188 Y190 M196	D29-K192 IonicContact OD1-NZ 3.15Å; D29-K192 PolarHBondContact OD1-NZ 2.92Å; D29-K192 IonicContact OD2-NZ 2.69Å; D29-K192 PolarHBondContact OD2-NZ 3.13Å; L33-K192 HydrophobicContact CD1-CB 4.1Å; L33-K192 HydrophobicContact CD2-CB 3.6Å; L33-K192 HydrophobicContact CD2-CD 4.03Å; L33-K192 HydrophobicContact CD2-CG 4.48Å; F118-K192 HydrophobicContact CZ-CB 4.34Å; L188-K192 WeakPolarHBondContact O-CB 3.34Å; L188-K192 PolarHBondContact O-N 2.98Å; Y190-K192 VanDerWaalsContact C-N 3.26Å; Y190-K192 PolarHBondContact O-N 3.36Å; K192-M196 WeakPolarHBondContact O-CG 3.45Å; K192-M196 PolarHBondContact O-N 3.31Å
193	R	94.1	Very high	96.5	Very high	100 Å²	100	53.9 Å²	53.9	38%	0.377	26%	0.263	S	S	.	.	H	α-helix	trans	-69.1	-46.1	178.5	-63.3	179.8	-179	-172.9	-0.4	111.1	Y190 R191 M196 M197	Y190-R193 PolarHBondContact O-N 3.18Å; R191-R193 VanDerWaalsContact C-N 3.28Å; R191-R193 PolarHBondContact O-N 2.84Å; R193-M196 PolarHBondContact O-N 3.22Å; R193-M197 WeakPolarHBondContact O-CG 3.47Å; R193-M197 PolarHBondContact O-N 3.25Å
194	M	94.6	Very high	96.5	Very high	96 Å²	96	53 Å²	53	47%	0.473	26%	0.26	S	S	.	.	H	α-helix	trans	-64	-47	178.4	-65.3	-176.8	-64.2	0	0	111.2	Y190 R191 M196 M197 E198	Y190-M194 PolarHBondContact O-N 3.46Å; R191-M194 HydrophobicContact CG-CE 4.39Å; R191-M194 PolarHBondContact O-N 3.4Å; M194-M196 PolarHBondContact O-N 3.44Å; M194-M196 VanDerWaalsContact O-N 3.13Å; M194-M197 PolarHBondContact O-N 3.1Å; M194-E198 WeakPolarHBondContact O-CB 3.25Å; M194-E198 WeakPolarHBondContact O-CG 3.4Å; M194-E198 PolarHBondContact O-N 2.96Å
195	A	95.3	Very high	96.5	Very high	7 Å²	7	58 Å²	58	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-22.6	-179.4	0	0	0	0	0	114.2	F118 R191 P199	F118-A195 HydrophobicContact CB-CB 3.91Å; F118-A195 HydrophobicContact CD1-CB 3.81Å; F118-A195 HydrophobicContact CD2-CB 3.46Å; F118-A195 VanDerWaalsContact CD2-CB 3.46Å; F118-A195 HydrophobicContact CE1-CB 4.19Å; F118-A195 HydrophobicContact CE2-CB 3.89Å; F118-A195 HydrophobicContact CG-CB 3.42Å; F118-A195 VanDerWaalsContact CG-CB 3.42Å; F118-A195 HydrophobicContact CZ-CB 4.22Å; R191-A195 VanDerWaalsContact O-CB 3.26Å; R191-A195 WeakPolarHBondContact O-CB 3.47Å; R191-A195 PolarHBondContact O-N 2.94Å; A195-P199 WeakPolarHBondContact O-CD 3.32Å; A195-P199 WeakPolarHBondContact O-CG 3.09Å
196	M	93.8	Very high	96.5	Very high	42 Å²	42	58 Å²	58	21%	0.207	28%	0.282	C	S	.	.	H	α-helix	trans	-88	-30.7	174	-64	-57.3	136.7	0	0	112.9	L33 Y36 T37 L40 K192 R193 M194 L200	L33-M196 HydrophobicContact CD1-CE 4.14Å; Y36-M196 HydrophobicContact CD1-CE 4.39Å; Y36-M196 HydrophobicContact CD1-SD 4.24Å; Y36-M196 HydrophobicContact CE1-CE 4.43Å; Y36-M196 HydrophobicContact CE1-SD 3.7Å; T37-M196 HydrophobicContact CG2-CE 3.42Å; T37-M196 VanDerWaalsContact CG2-CE 3.42Å; L40-M196 HydrophobicContact CD2-CE 4.46Å; L40-M196 HydrophobicContact CD2-SD 3.62Å; K192-M196 WeakPolarHBondContact O-CG 3.45Å; K192-M196 PolarHBondContact O-N 3.31Å; R193-M196 PolarHBondContact O-N 3.22Å; M194-M196 PolarHBondContact O-N 3.44Å; M194-M196 VanDerWaalsContact O-N 3.13Å; M196-L200 WeakPolarHBondContact O-CD1 3.33Å; M196-L200 WeakPolarHBondContact O-CG 3.38Å
197	M	96.9	Very high	96.6	Very high	121 Å²	121	59.2 Å²	59.2	60%	0.596	29%	0.287	S	S	*	.	H	α-helix	trans	-88.6	-42.4	-175.2	-67.5	-177	73.3	0	0	112.7	R193 M194 L200 I201	R193-M197 WeakPolarHBondContact O-CG 3.47Å; R193-M197 PolarHBondContact O-N 3.25Å; M194-M197 PolarHBondContact O-N 3.1Å; M197-L200 PolarHBondContact O-N 3.44Å; M197-L200 VanDerWaalsContact O-N 3.16Å; M197-I201 WeakPolarHBondContact O-CG1 3.42Å; M197-I201 PolarHBondContact O-N 3.35Å
198	E	96.5	Very high	96.7	Very high	104 Å²	104	62.5 Å²	62.5	49%	0.486	30%	0.299	S	S	.	.	H	α-helix	trans	-56	-47	-177.7	-72.9	175.2	-175.1	0	0	113	M194 L200 I201 G202	M194-E198 WeakPolarHBondContact O-CB 3.25Å; M194-E198 WeakPolarHBondContact O-CG 3.4Å; M194-E198 PolarHBondContact O-N 2.96Å; E198-L200 VanDerWaalsContact C-N 3.29Å; E198-L200 PolarHBondContact O-N 2.98Å; E198-I201 PolarHBondContact O-N 2.99Å; E198-G202 PolarHBondContact O-N 3.11Å
199	P	98.1	Very high	96.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-37.1	177.4	-25.7	35.7	0	0	0	114	M44 T110 M111 P114 V115 A195 G202 F203	M44-P199 HydrophobicContact CE-CB 3.67Å; M44-P199 HydrophobicContact CE-CG 4.48Å; M44-P199 HydrophobicContact SD-CB 4.26Å; T110-P199 WeakPolarHBondContact O-CA 3.21Å; M111-P199 HydrophobicContact CG-CB 4.15Å; P114-P199 HydrophobicContact CB-CG 4.35Å; V115-P199 HydrophobicContact CG2-CB 4.01Å; V115-P199 HydrophobicContact CG2-CG 3.37Å; A195-P199 WeakPolarHBondContact O-CD 3.32Å; A195-P199 WeakPolarHBondContact O-CG 3.09Å; P199-G202 PolarHBondContact O-N 3.37Å; P199-F203 WeakPolarHBondContact O-CB 3.45Å; P199-F203 PolarHBondContact O-N 3.32Å
200	L	98	Very high	97	Very high	103 Å²	103	66.4 Å²	66.4	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-73.4	-34.5	-178.6	-63.4	179.8	0	0	0	111.6	M44 M196 M197 E198 A204	M44-L200 HydrophobicContact CE-CD2 4.4Å; M196-L200 WeakPolarHBondContact O-CD1 3.33Å; M196-L200 WeakPolarHBondContact O-CG 3.38Å; M197-L200 PolarHBondContact O-N 3.44Å; M197-L200 VanDerWaalsContact O-N 3.16Å; E198-L200 VanDerWaalsContact C-N 3.29Å; E198-L200 PolarHBondContact O-N 2.98Å; L200-A204 VanDerWaalsContact O-CB 3.31Å; L200-A204 WeakPolarHBondContact O-CB 3.45Å; L200-A204 PolarHBondContact O-N 3.48Å
201	I	98.2	Very high	97.1	Very high	88 Å²	88	66.3 Å²	66.3	45%	0.451	32%	0.322	S	S	.	.	H	α-helix	trans	-65.8	-45.5	172.1	-66.6	166.6	0	0	0	109.9	M197 E198 A204 H205	M197-I201 WeakPolarHBondContact O-CG1 3.42Å; M197-I201 PolarHBondContact O-N 3.35Å; E198-I201 PolarHBondContact O-N 2.99Å; I201-A204 PolarHBondContact O-N 3.37Å; I201-H205 PolarHBondContact O-N 3.13Å; I201-H205 PolarHBondContact O-ND1 3.35Å
202	G	97.9	Very high	97.3	Very high	10 Å²	10	69 Å²	69	10%	0.103	34%	0.336	C	S	.	.	H	α-helix	trans	-57.7	-50.8	175.6	0	0	0	0	0	112.2	T110 E198 P199 A204 H205 G206	T110-G202 VanDerWaalsContact OG1-CA 3.26Å; T110-G202 WeakPolarHBondContact OG1-CA 3.43Å; E198-G202 PolarHBondContact O-N 3.11Å; P199-G202 PolarHBondContact O-N 3.37Å; G202-A204 PolarHBondContact O-N 3.38Å; G202-H205 PolarHBondContact O-N 3.22Å; G202-G206 PolarHBondContact O-N 2.95Å
203	F	98.6	Very high	97.4	Very high	70 Å²	70	73.5 Å²	73.5	31%	0.307	35%	0.351	S	S	.	.	H	α-helix	trans	-54.2	-50.1	173.9	175.5	-93.8	0	0	0	112.1	V47 L107 M111 P199 H205 G206 Q207	V47-F203 HydrophobicContact CG1-CE2 4.21Å; L107-F203 HydrophobicContact CD2-CB 4.45Å; L107-F203 HydrophobicContact CD2-CD2 3.5Å; L107-F203 HydrophobicContact CD2-CE2 4.17Å; L107-F203 HydrophobicContact CD2-CG 4.37Å; M111-F203 HydrophobicContact CG-CB 4.47Å; M111-F203 HydrophobicContact SD-CB 4.07Å; M111-F203 HydrophobicContact SD-CD2 3.68Å; M111-F203 HydrophobicContact SD-CG 4.24Å; P199-F203 WeakPolarHBondContact O-CB 3.45Å; P199-F203 PolarHBondContact O-N 3.32Å; F203-H205 PolarHBondContact O-N 3.02Å; F203-G206 PolarHBondContact O-N 3.44Å; F203-Q207 HydrophobicContact CD1-CG 4.17Å; F203-Q207 HydrophobicContact CD2-CG 4.48Å; F203-Q207 HydrophobicContact CE1-CG 3.71Å; F203-Q207 HydrophobicContact CE2-CG 4.05Å; F203-Q207 HydrophobicContact CZ-CG 3.64Å; F203-Q207 WeakPolarHBondContact O-CG 3.41Å; F203-Q207 PolarHBondContact O-N 2.6Å
204	A	98.7	Very high	97.5	Very high	42 Å²	42	69.2 Å²	69.2	35%	0.347	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-43.8	-178	0	0	0	0	0	112.4	L200 I201 G202 G206 Q207 I208	L200-A204 VanDerWaalsContact O-CB 3.31Å; L200-A204 WeakPolarHBondContact O-CB 3.45Å; L200-A204 PolarHBondContact O-N 3.48Å; I201-A204 PolarHBondContact O-N 3.37Å; G202-A204 PolarHBondContact O-N 3.38Å; A204-G206 VanDerWaalsContact C-N 3.34Å; A204-G206 PolarHBondContact O-N 2.81Å; A204-Q207 PolarHBondContact O-N 3.33Å; A204-I208 WeakPolarHBondContact O-CD1 3.27Å; A204-I208 VanDerWaalsContact O-CG1 3.25Å; A204-I208 WeakPolarHBondContact O-CG1 3.4Å; A204-I208 PolarHBondContact O-N 3.01Å
205	H	98.4	Very high	97.7	Very high	112 Å²	112	68 Å²	68	52%	0.519	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-41.2	175.1	-72.1	140.8	0	0	0	112.2	I201 G202 F203 Q207 I208 N209	I201-H205 PolarHBondContact O-N 3.13Å; I201-H205 PolarHBondContact O-ND1 3.35Å; G202-H205 PolarHBondContact O-N 3.22Å; F203-H205 PolarHBondContact O-N 3.02Å; H205-Q207 PolarHBondContact O-N 3.36Å; H205-I208 PolarHBondContact O-N 3.07Å; H205-N209 WeakPolarHBondContact O-CB 3.47Å; H205-N209 VanDerWaalsContact O-CG 3.28Å; H205-N209 PolarHBondContact O-N 2.72Å; H205-N209 PolarHBondContact O-ND2 3.4Å
206	G	98.4	Very high	97.7	Very high	1 Å²	1	73.4 Å²	73.4	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-57.2	-49.5	174.7	0	0	0	0	0	112.1	L103 Q106 G202 F203 A204 N209 F210	L103-G206 VanDerWaalsContact CD1-C 3.48Å; Q106-G206 VanDerWaalsContact OE1-CA 3.31Å; G202-G206 PolarHBondContact O-N 2.95Å; F203-G206 PolarHBondContact O-N 3.44Å; A204-G206 VanDerWaalsContact C-N 3.34Å; A204-G206 PolarHBondContact O-N 2.81Å; G206-N209 PolarHBondContact O-N 3.14Å; G206-F210 WeakPolarHBondContact O-CB 3.4Å; G206-F210 PolarHBondContact O-N 3.31Å
207	Q	98.5	Very high	97.8	Very high	41 Å²	41	72.9 Å²	72.9	19%	0.192	37%	0.365	C	S	.	.	H	α-helix	trans	-61.8	-46.6	177.6	-65.9	-61	-27.6	0	0	112.2	F203 A204 H205 N209 F210 F211	F203-Q207 HydrophobicContact CD1-CG 4.17Å; F203-Q207 HydrophobicContact CD2-CG 4.48Å; F203-Q207 HydrophobicContact CE1-CG 3.71Å; F203-Q207 HydrophobicContact CE2-CG 4.05Å; F203-Q207 HydrophobicContact CZ-CG 3.64Å; F203-Q207 WeakPolarHBondContact O-CG 3.41Å; F203-Q207 PolarHBondContact O-N 2.6Å; A204-Q207 PolarHBondContact O-N 3.33Å; H205-Q207 PolarHBondContact O-N 3.36Å; Q207-N209 VanDerWaalsContact C-N 3.31Å; Q207-N209 PolarHBondContact O-N 3.23Å; Q207-F210 PolarHBondContact O-N 3.49Å; Q207-F211 HydrophobicContact CB-CD2 4.4Å; Q207-F211 HydrophobicContact CB-CE2 4.49Å; Q207-F211 WeakPolarHBondContact O-CD2 3.48Å; Q207-F211 PolarHBondContact O-N 3.09Å
208	I	98.6	Very high	97.8	Very high	102 Å²	102	71.7 Å²	71.7	52%	0.523	36%	0.357	S	S	.	.	H	α-helix	trans	-57	-46.5	178.3	-71.1	164.2	0	0	0	110.8	A204 H205 K212	A204-I208 WeakPolarHBondContact O-CD1 3.27Å; A204-I208 VanDerWaalsContact O-CG1 3.25Å; A204-I208 WeakPolarHBondContact O-CG1 3.4Å; A204-I208 PolarHBondContact O-N 3.01Å; H205-I208 PolarHBondContact O-N 3.07Å; I208-K212 WeakPolarHBondContact O-CB 3.29Å; I208-K212 PolarHBondContact O-N 2.79Å
209	N	97.9	Very high	97.7	Very high	72 Å²	72	68.6 Å²	68.6	39%	0.385	35%	0.347	S	S	.	.	H	α-helix	trans	-64.7	-44.2	179.6	-72	-26	0	0	0	111.9	H205 G206 Q207 R213	H205-N209 WeakPolarHBondContact O-CB 3.47Å; H205-N209 VanDerWaalsContact O-CG 3.28Å; H205-N209 PolarHBondContact O-N 2.72Å; H205-N209 PolarHBondContact O-ND2 3.4Å; G206-N209 PolarHBondContact O-N 3.14Å; Q207-N209 VanDerWaalsContact C-N 3.31Å; Q207-N209 PolarHBondContact O-N 3.23Å; N209-R213 WeakPolarHBondContact O-CB 3.37Å; N209-R213 WeakPolarHBondContact O-CG 3.34Å; N209-R213 PolarHBondContact O-N 3.19Å
210	F	98.6	Very high	97.5	Very high	30 Å²	30	77.2 Å²	77.2	13%	0.132	38%	0.384	C	S	.	.	H	α-helix	trans	-59.7	-53.6	178	176.8	-97.3	0	0	0	111.4	L99 H100 L103 G206 Q207 K212 R213 G214	L99-F210 HydrophobicContact CB-CD2 3.96Å; L99-F210 HydrophobicContact CB-CE2 3.85Å; H100-F210 AromaticContact CE1-CE2 3.8Å; H100-F210 AromaticContact CE1-CZ 3.42Å; H100-F210 VanDerWaalsContact CE1-CZ 3.42Å; H100-F210 WeakPolarHBondContact CE1-CZ 3.3Å; H100-F210 AromaticContact CG-CE2 3.95Å; H100-F210 AromaticContact ND1-CE2 3.75Å; H100-F210 AromaticContact ND1-CZ 3.83Å; H100-F210 AromaticContact NE2-CZ 3.73Å; L103-F210 HydrophobicContact CB-CB 4.34Å; L103-F210 HydrophobicContact CB-CD2 3.97Å; L103-F210 HydrophobicContact CB-CG 4.41Å; L103-F210 HydrophobicContact CD1-CB 4.36Å; L103-F210 HydrophobicContact CD2-CB 3.84Å; L103-F210 HydrophobicContact CD2-CD1 4.11Å; L103-F210 HydrophobicContact CD2-CD2 3.77Å; L103-F210 HydrophobicContact CD2-CE2 4.38Å; L103-F210 HydrophobicContact CD2-CG 3.62Å; L103-F210 HydrophobicContact CG-CB 4.41Å; L103-F210 HydrophobicContact CG-CD2 4.48Å; G206-F210 WeakPolarHBondContact O-CB 3.4Å; G206-F210 PolarHBondContact O-N 3.31Å; Q207-F210 PolarHBondContact O-N 3.49Å; F210-K212 PolarHBondContact O-N 3.35Å; F210-R213 PolarHBondContact O-N 3.18Å; F210-G214 PolarHBondContact O-N 3.44Å
211	F	98.6	Very high	97.3	Very high	134 Å²	134	75.8 Å²	75.8	59%	0.588	38%	0.383	S	S	*	.	H	α-helix	trans	-66.1	-37.9	-178.9	-78.9	-68.3	0	0	0	112.8	Q207 G214 A215	Q207-F211 HydrophobicContact CB-CD2 4.4Å; Q207-F211 HydrophobicContact CB-CE2 4.49Å; Q207-F211 WeakPolarHBondContact O-CD2 3.48Å; Q207-F211 PolarHBondContact O-N 3.09Å; F211-G214 PolarHBondContact O-N 2.62Å; F211-A215 WeakPolarHBondContact O-CB 3.3Å; F211-A215 PolarHBondContact O-N 3.19Å
212	K	98.1	Very high	97.2	Very high	132 Å²	132	72.2 Å²	72.2	57%	0.574	36%	0.364	S	S	*	.	H	α-helix	trans	-62.6	-50.1	177.6	-175.9	-178.5	175.7	-173.6	0	111.3	I208 F210 A215 E216	I208-K212 WeakPolarHBondContact O-CB 3.29Å; I208-K212 PolarHBondContact O-N 2.79Å; F210-K212 PolarHBondContact O-N 3.35Å; K212-A215 PolarHBondContact O-N 3.46Å; K212-E216 WeakPolarHBondContact CE-OE1 3.27Å; K212-E216 WeakPolarHBondContact O-CG 3.27Å; K212-E216 PolarHBondContact O-N 3Å; K212-E216 VanDerWaalsContact O-N 3.1Å
213	R	97.4	Very high	97.1	Very high	136 Å²	136	76 Å²	76	51%	0.513	38%	0.382	S	S	.	.	H	α-helix	trans	-67.7	-36.5	178.1	-71	-178.1	173.9	-175.8	-0.8	112.2	L99 N209 F210 E216 M217	L99-R213 HydrophobicContact CD1-CB 4.03Å; L99-R213 HydrophobicContact CD2-CB 3.66Å; L99-R213 HydrophobicContact CD2-CG 4.4Å; N209-R213 WeakPolarHBondContact O-CB 3.37Å; N209-R213 WeakPolarHBondContact O-CG 3.34Å; N209-R213 PolarHBondContact O-N 3.19Å; F210-R213 PolarHBondContact O-N 3.18Å; R213-E216 PolarHBondContact O-N 3.24Å; R213-M217 PolarHBondContact O-N 2.87Å
214	G	97.4	Very high	97	Very high	11 Å²	11	76.2 Å²	76.2	11%	0.113	39%	0.393	C	S	.	.	H	α-helix	trans	-60.8	-43.7	173.5	0	0	0	0	0	112	F210 F211 E216 M217 F218	F210-G214 PolarHBondContact O-N 3.44Å; F211-G214 PolarHBondContact O-N 2.62Å; G214-E216 VanDerWaalsContact C-N 3.32Å; G214-E216 PolarHBondContact O-N 3.45Å; G214-M217 WeakPolarHBondContact O-CB 3.35Å; G214-M217 PolarHBondContact O-N 3.27Å; G214-F218 VanDerWaalsContact O-CD2 3.27Å; G214-F218 WeakPolarHBondContact O-CD2 3.38Å; G214-F218 PolarHBondContact O-N 2.88Å
215	A	97.1	Very high	97	Very high	69 Å²	69	76 Å²	76	57%	0.57	38%	0.384	S	S	*	.	H	α-helix	trans	-66.2	-32.3	175.8	0	0	0	0	0	113	F211 K212	F211-A215 WeakPolarHBondContact O-CB 3.3Å; F211-A215 PolarHBondContact O-N 3.19Å; K212-A215 PolarHBondContact O-N 3.46Å
216	E	96.1	Very high	97	Very high	121 Å²	121	74 Å²	74	57%	0.565	38%	0.376	S	S	*	.	H	α-helix	trans	-68.4	-37	173.1	-71.1	167.1	-171.4	0	0	111.8	K212 R213 G214 S219	K212-E216 WeakPolarHBondContact CE-OE1 3.27Å; K212-E216 WeakPolarHBondContact O-CG 3.27Å; K212-E216 PolarHBondContact O-N 3Å; K212-E216 VanDerWaalsContact O-N 3.1Å; R213-E216 PolarHBondContact O-N 3.24Å; G214-E216 VanDerWaalsContact C-N 3.32Å; G214-E216 PolarHBondContact O-N 3.45Å; E216-S219 WeakPolarHBondContact O-CB 3.38Å
217	M	95.8	Very high	97	Very high	31 Å²	31	77.1 Å²	77.1	15%	0.153	40%	0.398	C	S	.	.	H	α-helix	trans	-68.8	-52.3	176.2	178	-173.8	-61.3	0	0	112.2	E95 L96 L99 R213 G214 S219	E95-M217 VanDerWaalsContact C-CE 3.46Å; E95-M217 HydrophobicContact CB-CE 3.54Å; E95-M217 HydrophobicContact CB-SD 4.23Å; L96-M217 HydrophobicContact CB-SD 4.08Å; L99-M217 HydrophobicContact CD1-CE 3.51Å; L99-M217 HydrophobicContact CD1-SD 4.46Å; L99-M217 HydrophobicContact CG-CE 3.85Å; R213-M217 PolarHBondContact O-N 2.87Å; G214-M217 WeakPolarHBondContact O-CB 3.35Å; G214-M217 PolarHBondContact O-N 3.27Å; M217-S219 PolarHBondContact O-N 3.46Å
218	F	96	Very high	96.9	Very high	96 Å²	96	78.1 Å²	78.1	42%	0.421	41%	0.41	S	S	.	.	S	Bend	trans	-84.8	62.4	178.1	-62.1	-72.6	0	0	0	110.7	V92 L96 G214 M222	V92-F218 HydrophobicContact CG1-CE1 3.93Å; V92-F218 HydrophobicContact CG1-CZ 4.27Å; L96-F218 HydrophobicContact CD1-CE2 4.17Å; L96-F218 HydrophobicContact CD2-CZ 4.21Å; G214-F218 VanDerWaalsContact O-CD2 3.27Å; G214-F218 WeakPolarHBondContact O-CD2 3.38Å; G214-F218 PolarHBondContact O-N 2.88Å; F218-M222 HydrophobicContact CD1-CG 4.19Å
219	S	94.8	Very high	96.9	Very high	40 Å²	40	74.3 Å²	74.3	28%	0.28	39%	0.391	S	S	.	.			trans	-91.3	-179.2	-177.4	72.1	0	0	0	0	112.8	E216 M217 S221 M222 D223	E216-S219 WeakPolarHBondContact O-CB 3.38Å; M217-S219 PolarHBondContact O-N 3.46Å; S219-S221 PolarHBondContact O-N 3.05Å; S219-S221 VanDerWaalsContact O-N 3.14Å; S219-S221 PolarHBondContact OG-N 3.39Å; S219-S221 PolarHBondContact OG-OG 3.39Å; S219-M222 WeakPolarHBondContact O-CA 3.4Å; S219-M222 VanDerWaalsContact O-CB 3.28Å; S219-M222 WeakPolarHBondContact O-CB 3.42Å; S219-M222 PolarHBondContact O-N 3.09Å; S219-D223 PolarHBondContact O-N 2.92Å; S219-D223 VanDerWaalsContact O-N 3.11Å
220	K	93.8	Very high	96.9	Very high	181 Å²	181	75.2 Å²	75.2	79%	0.787	40%	0.399	S	S	*	.	H	α-helix	trans	-57.3	-27.7	176	-66.1	-173.5	177.8	-175.8	0	114.1	M222 D223 S224	K220-M222 VanDerWaalsContact C-N 3.34Å; K220-D223 PolarHBondContact O-N 3.23Å; K220-S224 PolarHBondContact O-N 2.97Å
221	S	93.7	Very high	96.9	Very high	73 Å²	73	79.2 Å²	79.2	51%	0.51	42%	0.422	S	S	.	.	H	α-helix	trans	-69.5	-36.5	175	60.6	0	0	0	0	111.3	S219 S224 F225	S219-S221 PolarHBondContact O-N 3.05Å; S219-S221 VanDerWaalsContact O-N 3.14Å; S219-S221 PolarHBondContact OG-N 3.39Å; S219-S221 PolarHBondContact OG-OG 3.39Å; S221-S224 WeakPolarHBondContact CA-OG 3.49Å; S221-S224 PolarHBondContact O-N 2.85Å; S221-S224 PolarHBondContact O-OG 3.45Å; S221-F225 PolarHBondContact O-N 3.11Å; S221-F225 VanDerWaalsContact O-N 3.08Å
222	M	96.4	Very high	96.8	Very high	12 Å²	12	75.3 Å²	75.3	6%	0.059	41%	0.406	C	S	.	.	H	α-helix	trans	-63.9	-45.3	172.2	-173.3	55.4	62.8	0	0	110.5	Y88 V92 F218 S219 K220 S224 F225 L226	Y88-M222 HydrophobicContact CE1-CE 3.88Å; Y88-M222 HydrophobicContact CE1-SD 4.21Å; V92-M222 HydrophobicContact CB-CE 4.44Å; V92-M222 HydrophobicContact CG1-CE 4.14Å; V92-M222 HydrophobicContact CG2-CE 3.38Å; V92-M222 HydrophobicContact CG2-SD 4.39Å; F218-M222 HydrophobicContact CD1-CG 4.19Å; S219-M222 WeakPolarHBondContact O-CA 3.4Å; S219-M222 VanDerWaalsContact O-CB 3.28Å; S219-M222 WeakPolarHBondContact O-CB 3.42Å; S219-M222 PolarHBondContact O-N 3.09Å; K220-M222 VanDerWaalsContact C-N 3.34Å; M222-S224 VanDerWaalsContact C-N 3.27Å; M222-S224 PolarHBondContact O-N 2.76Å; M222-F225 WeakPolarHBondContact O-CB 3.45Å; M222-F225 PolarHBondContact O-N 2.98Å; M222-F225 VanDerWaalsContact O-N 3.09Å; M222-F225 HydrophobicContact SD-CD1 3.87Å; M222-L226 HydrophobicContact CG-CD1 4.27Å; M222-L226 HydrophobicContact CG-CG 4.37Å; M222-L226 WeakPolarHBondContact O-CG 3.26Å; M222-L226 PolarHBondContact O-N 3.14Å; M222-L226 HydrophobicContact SD-CG 4.43Å
223	D	96.3	Very high	96.8	Very high	90 Å²	90	73.1 Å²	73.1	48%	0.481	40%	0.404	S	S	.	.	H	α-helix	trans	-57.6	-40.4	176.1	-66.9	-25.4	0	0	0	112.2	S219 K220 L226 S227	S219-D223 PolarHBondContact O-N 2.92Å; S219-D223 VanDerWaalsContact O-N 3.11Å; K220-D223 PolarHBondContact O-N 3.23Å; D223-L226 PolarHBondContact O-N 2.94Å; D223-S227 WeakPolarHBondContact O-CB 3.25Å; D223-S227 PolarHBondContact O-N 3.05Å; D223-S227 PolarHBondContact O-OG 3.08Å
224	S	97.5	Very high	96.8	Very high	75 Å²	75	72 Å²	72	52%	0.524	40%	0.404	S	S	.	.	H	α-helix	trans	-65.4	-39.1	176.5	67.8	0	0	0	0	112.7	K220 S221 M222 S227 S228	K220-S224 PolarHBondContact O-N 2.97Å; S221-S224 WeakPolarHBondContact CA-OG 3.49Å; S221-S224 PolarHBondContact O-N 2.85Å; S221-S224 PolarHBondContact O-OG 3.45Å; M222-S224 VanDerWaalsContact C-N 3.27Å; M222-S224 PolarHBondContact O-N 2.76Å; S224-S227 PolarHBondContact O-N 2.93Å; S224-S228 PolarHBondContact O-N 3.42Å
225	F	97.3	Very high	96.9	Very high	38 Å²	38	74.4 Å²	74.4	17%	0.167	42%	0.42	C	S	.	.	H	α-helix	trans	-64.3	-47.7	173.9	166.9	-99.2	0	0	0	111.2	T85 Y88 F89 S221 M222 S227 S228 V229	T85-F225 HydrophobicContact CG2-CZ 4.23Å; Y88-F225 AromaticContact CD1-CD1 3.81Å; Y88-F225 HydrophobicContact CD1-CD1 3.81Å; Y88-F225 HydrophobicContact CD1-CD2 4.06Å; Y88-F225 AromaticContact CD1-CE1 3.37Å; Y88-F225 HydrophobicContact CD1-CE1 3.37Å; Y88-F225 AromaticContact CD1-CE2 3.64Å; Y88-F225 HydrophobicContact CD1-CE2 3.64Å; Y88-F225 HydrophobicContact CD1-CG 4.13Å; Y88-F225 AromaticContact CD1-CZ 3.27Å; Y88-F225 HydrophobicContact CD1-CZ 3.27Å; Y88-F225 AromaticContact CE1-CD1 3.62Å; Y88-F225 HydrophobicContact CE1-CD1 3.62Å; Y88-F225 HydrophobicContact CE1-CD2 4.02Å; Y88-F225 AromaticContact CE1-CE1 3.7Å; Y88-F225 HydrophobicContact CE1-CE1 3.7Å; Y88-F225 HydrophobicContact CE1-CE2 4.09Å; Y88-F225 AromaticContact CE1-CG 3.78Å; Y88-F225 HydrophobicContact CE1-CG 3.78Å; Y88-F225 AromaticContact CE1-CZ 3.94Å; Y88-F225 HydrophobicContact CE1-CZ 3.94Å; Y88-F225 HydrophobicContact CG-CE1 4.45Å; Y88-F225 HydrophobicContact CG-CE2 4.08Å; Y88-F225 AromaticContact CG-CZ 3.95Å; Y88-F225 HydrophobicContact CG-CZ 3.95Å; F89-F225 HydrophobicContact CD1-CE1 4.46Å; F89-F225 HydrophobicContact CD2-CE1 4.48Å; F89-F225 AromaticContact CE1-CE1 3.95Å; F89-F225 HydrophobicContact CE1-CE1 3.95Å; F89-F225 AromaticContact CE2-CE1 3.97Å; F89-F225 HydrophobicContact CE2-CE1 3.97Å; F89-F225 HydrophobicContact CE2-CZ 4.15Å; F89-F225 AromaticContact CZ-CE1 3.69Å; F89-F225 HydrophobicContact CZ-CE1 3.69Å; F89-F225 HydrophobicContact CZ-CZ 4.33Å; S221-F225 PolarHBondContact O-N 3.11Å; S221-F225 VanDerWaalsContact O-N 3.08Å; M222-F225 WeakPolarHBondContact O-CB 3.45Å; M222-F225 PolarHBondContact O-N 2.98Å; M222-F225 VanDerWaalsContact O-N 3.09Å; M222-F225 HydrophobicContact SD-CD1 3.87Å; F225-S227 PolarHBondContact O-N 2.99Å; F225-S228 PolarHBondContact O-N 3.46Å; F225-S228 VanDerWaalsContact O-N 3.09Å; F225-S228 PolarHBondContact O-OG 3.49Å; F225-V229 HydrophobicContact CD1-CG2 4.42Å; F225-V229 HydrophobicContact CD2-CG2 4.3Å; F225-V229 HydrophobicContact CE1-CG2 3.91Å; F225-V229 HydrophobicContact CE2-CG2 3.78Å; F225-V229 HydrophobicContact CZ-CG2 3.56Å; F225-V229 WeakPolarHBondContact O-CG2 3.42Å; F225-V229 PolarHBondContact O-N 3.33Å
226	L	98.1	Very high	96.9	Very high	68 Å²	68	75.2 Å²	75.2	36%	0.356	41%	0.414	S	S	.	.	H	α-helix	trans	-59.9	-36.2	177.2	-66.5	177.9	0	0	0	112	F89 M222 D223 V229 T230	F89-L226 HydrophobicContact CE1-CD2 3.71Å; F89-L226 HydrophobicContact CZ-CD2 3.76Å; M222-L226 HydrophobicContact CG-CD1 4.27Å; M222-L226 HydrophobicContact CG-CG 4.37Å; M222-L226 WeakPolarHBondContact O-CG 3.26Å; M222-L226 PolarHBondContact O-N 3.14Å; M222-L226 HydrophobicContact SD-CG 4.43Å; D223-L226 PolarHBondContact O-N 2.94Å; L226-V229 PolarHBondContact O-N 3.06Å; L226-T230 WeakPolarHBondContact O-CB 3.28Å; L226-T230 PolarHBondContact O-N 2.98Å; L226-T230 PolarHBondContact O-OG1 3.44Å
227	S	98.1	Very high	96.9	Very high	67 Å²	67	73.2 Å²	73.2	47%	0.469	40%	0.404	S	S	.	.	H	α-helix	trans	-64.3	-46.3	174.2	-56	0	0	0	0	111.1	D223 S224 F225 V229 T230 D231	D223-S227 WeakPolarHBondContact O-CB 3.25Å; D223-S227 PolarHBondContact O-N 3.05Å; D223-S227 PolarHBondContact O-OG 3.08Å; S224-S227 PolarHBondContact O-N 2.93Å; F225-S227 PolarHBondContact O-N 2.99Å; S227-V229 VanDerWaalsContact C-N 3.32Å; S227-V229 PolarHBondContact O-N 2.87Å; S227-T230 WeakPolarHBondContact O-CB 3.46Å; S227-T230 PolarHBondContact O-N 2.93Å; S227-T230 VanDerWaalsContact O-N 3.1Å; S227-D231 PolarHBondContact O-N 3.38Å
228	S	97.6	Very high	97.1	Very high	63 Å²	63	75.5 Å²	75.5	44%	0.441	42%	0.42	S	S	.	.	H	α-helix	trans	-62.9	-36.4	176.2	59.9	0	0	0	0	113.5	S224 F225 T230 D231 M232	S224-S228 PolarHBondContact O-N 3.42Å; F225-S228 PolarHBondContact O-N 3.46Å; F225-S228 VanDerWaalsContact O-N 3.09Å; F225-S228 PolarHBondContact O-OG 3.49Å; S228-T230 VanDerWaalsContact C-N 3.33Å; S228-D231 PolarHBondContact O-N 2.83Å; S228-M232 PolarHBondContact O-N 3.07Å
229	V	97.9	Very high	97.2	Very high	22 Å²	22	76.7 Å²	76.7	13%	0.133	43%	0.427	C	S	.	.	H	α-helix	trans	-67.8	-37.3	174.2	174.2	0	0	0	0	110.6	T85 F89 F225 L226 S227 M232 V233	T85-V229 HydrophobicContact CG2-CG1 4.18Å; T85-V229 HydrophobicContact CG2-CG2 3.83Å; F89-V229 HydrophobicContact CE2-CG1 4.38Å; F225-V229 HydrophobicContact CD1-CG2 4.42Å; F225-V229 HydrophobicContact CD2-CG2 4.3Å; F225-V229 HydrophobicContact CE1-CG2 3.91Å; F225-V229 HydrophobicContact CE2-CG2 3.78Å; F225-V229 HydrophobicContact CZ-CG2 3.56Å; F225-V229 WeakPolarHBondContact O-CG2 3.42Å; F225-V229 PolarHBondContact O-N 3.33Å; L226-V229 PolarHBondContact O-N 3.06Å; S227-V229 VanDerWaalsContact C-N 3.32Å; S227-V229 PolarHBondContact O-N 2.87Å; V229-M232 WeakPolarHBondContact O-CB 3.44Å; V229-M232 PolarHBondContact O-N 3.13Å; V229-V233 WeakPolarHBondContact O-CG2 3.45Å; V229-V233 PolarHBondContact O-N 3.03Å
230	T	98.3	Very high	97.3	Very high	90 Å²	90	79.8 Å²	79.8	55%	0.552	44%	0.44	S	S	*	.	H	α-helix	trans	-63.3	-43.3	175.6	-57.4	0	0	0	0	111.2	L226 S227 S228 V233 Q234	L226-T230 WeakPolarHBondContact O-CB 3.28Å; L226-T230 PolarHBondContact O-N 2.98Å; L226-T230 PolarHBondContact O-OG1 3.44Å; S227-T230 WeakPolarHBondContact O-CB 3.46Å; S227-T230 PolarHBondContact O-N 2.93Å; S227-T230 VanDerWaalsContact O-N 3.1Å; S228-T230 VanDerWaalsContact C-N 3.33Å; T230-V233 PolarHBondContact O-N 3.04Å; T230-Q234 WeakPolarHBondContact O-CB 3.37Å; T230-Q234 PolarHBondContact O-N 3.32Å
231	D	98	Very high	97.5	Very high	114 Å²	114	76.2 Å²	76.2	61%	0.61	43%	0.426	S	S	*	.	H	α-helix	trans	-63.5	-40.9	176.1	-67.5	-24.5	0	0	0	111.6	S227 S228 Q234 S235	S227-D231 PolarHBondContact O-N 3.38Å; S228-D231 PolarHBondContact O-N 2.83Å; D231-Q234 PolarHBondContact O-N 2.96Å; D231-S235 PolarHBondContact O-N 3.42Å
232	M	97.6	Very high	97.7	Very high	52 Å²	52	75.6 Å²	75.6	26%	0.256	43%	0.425	S	S	.	.	H	α-helix	trans	-59.1	-49.8	173.6	178.8	-168.4	-73	0	0	111.4	E81 S228 V229 Q234 S235 I236	E81-M232 HydrophobicContact CB-CE 4.14Å; S228-M232 PolarHBondContact O-N 3.07Å; V229-M232 WeakPolarHBondContact O-CB 3.44Å; V229-M232 PolarHBondContact O-N 3.13Å; M232-Q234 VanDerWaalsContact C-N 3.29Å; M232-Q234 PolarHBondContact O-N 3.19Å; M232-S235 WeakPolarHBondContact O-CB 3.37Å; M232-S235 PolarHBondContact O-N 3.46Å; M232-S235 VanDerWaalsContact O-N 3.15Å; M232-I236 HydrophobicContact CG-CD1 4.21Å; M232-I236 WeakPolarHBondContact O-CG1 3.41Å; M232-I236 PolarHBondContact O-N 3.03Å
233	V	98.1	Very high	97.8	Very high	87 Å²	87	80.1 Å²	80.1	53%	0.527	45%	0.446	S	S	.	.	H	α-helix	trans	-60.2	-40.4	177.1	170.9	0	0	0	0	111.2	V229 T230 I236 Q237	V229-V233 WeakPolarHBondContact O-CG2 3.45Å; V229-V233 PolarHBondContact O-N 3.03Å; T230-V233 PolarHBondContact O-N 3.04Å; V233-I236 PolarHBondContact O-N 3.06Å; V233-Q237 WeakPolarHBondContact O-CB 3.49Å; V233-Q237 PolarHBondContact O-N 3.44Å
234	Q	98	Very high	97.9	Very high	111 Å²	111	78 Å²	78	52%	0.519	44%	0.441	S	S	.	.	H	α-helix	trans	-65.5	-38.6	176.8	-174.1	61.2	48.4	0	0	112	T230 D231 M232 Q237 V238	T230-Q234 WeakPolarHBondContact O-CB 3.37Å; T230-Q234 PolarHBondContact O-N 3.32Å; D231-Q234 PolarHBondContact O-N 2.96Å; M232-Q234 VanDerWaalsContact C-N 3.29Å; M232-Q234 PolarHBondContact O-N 3.19Å; Q234-Q237 PolarHBondContact O-N 2.87Å; Q234-V238 WeakPolarHBondContact O-CG2 3.46Å; Q234-V238 PolarHBondContact O-N 3.35Å
235	S	97.6	Very high	97.9	Very high	62 Å²	62	78.5 Å²	78.5	43%	0.434	44%	0.438	S	S	.	.	H	α-helix	trans	-61.3	-48	174.9	-164.3	0	0	0	0	111.2	D231 M232 Q237 V238 E239	D231-S235 PolarHBondContact O-N 3.42Å; M232-S235 WeakPolarHBondContact O-CB 3.37Å; M232-S235 PolarHBondContact O-N 3.46Å; M232-S235 VanDerWaalsContact O-N 3.15Å; S235-Q237 VanDerWaalsContact C-N 3.28Å; S235-Q237 PolarHBondContact O-N 2.86Å; S235-V238 PolarHBondContact O-N 2.8Å; S235-E239 PolarHBondContact O-N 3.14Å
236	I	97.2	Very high	97.9	Very high	86 Å²	86	82.4 Å²	82.4	44%	0.441	46%	0.457	S	S	.	.	H	α-helix	trans	-58.8	-41.6	176.6	-65.5	166.4	0	0	0	110.8	M232 V233 E239 L240	M232-I236 HydrophobicContact CG-CD1 4.21Å; M232-I236 WeakPolarHBondContact O-CG1 3.41Å; M232-I236 PolarHBondContact O-N 3.03Å; V233-I236 PolarHBondContact O-N 3.06Å; I236-E239 PolarHBondContact O-N 3.28Å; I236-L240 VanDerWaalsContact O-CB 3.31Å; I236-L240 WeakPolarHBondContact O-CB 3.42Å; I236-L240 PolarHBondContact O-N 3.45Å
237	Q	98.1	Very high	97.8	Very high	79 Å²	79	84.7 Å²	84.7	37%	0.369	47%	0.467	S	S	.	.	H	α-helix	trans	-64.5	-40.9	178.6	-176.6	60.3	41.4	0	0	112.5	V233 Q234 S235 L240 E241	V233-Q237 WeakPolarHBondContact O-CB 3.49Å; V233-Q237 PolarHBondContact O-N 3.44Å; Q234-Q237 PolarHBondContact O-N 2.87Å; S235-Q237 VanDerWaalsContact C-N 3.28Å; S235-Q237 PolarHBondContact O-N 2.86Å; Q237-L240 WeakPolarHBondContact O-CB 3.4Å; Q237-L240 PolarHBondContact O-N 3.18Å; Q237-E241 PolarHBondContact NE2-OE1 2.91Å; Q237-E241 WeakPolarHBondContact O-CG 3.25Å; Q237-E241 PolarHBondContact O-N 3.19Å
238	V	98.4	Very high	97.8	Very high	80 Å²	80	87.4 Å²	87.4	49%	0.485	47%	0.467	S	S	.	.	H	α-helix	trans	-67.3	-42.1	177.7	170.7	0	0	0	0	111.1	Q234 S235 E241 A242	Q234-V238 WeakPolarHBondContact O-CG2 3.46Å; Q234-V238 PolarHBondContact O-N 3.35Å; S235-V238 PolarHBondContact O-N 2.8Å; V238-E241 PolarHBondContact O-N 3.04Å; V238-A242 WeakPolarHBondContact O-CB 3.34Å; V238-A242 PolarHBondContact O-N 2.74Å
239	E	97.6	Very high	97.8	Very high	121 Å²	121	87.4 Å²	87.4	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-63.2	-43.5	175.4	-72.6	178.1	-169.4	0	0	111.6	S235 I236 E241 A242 E243	S235-E239 PolarHBondContact O-N 3.14Å; I236-E239 PolarHBondContact O-N 3.28Å; E239-E241 VanDerWaalsContact C-N 3.34Å; E239-E241 PolarHBondContact O-N 2.87Å; E239-A242 PolarHBondContact O-N 3.37Å; E239-E243 WeakPolarHBondContact O-CB 3.12Å; E239-E243 WeakPolarHBondContact O-CG 3.47Å; E239-E243 PolarHBondContact O-N 2.73Å
240	L	97.8	Very high	97.7	Very high	105 Å²	105	88.7 Å²	88.7	55%	0.55	47%	0.474	S	S	.	.	H	α-helix	trans	-55.5	-48.3	174.2	-179.9	95.6	0	0	0	111.4	I236 Q237 A244	I236-L240 VanDerWaalsContact O-CB 3.31Å; I236-L240 WeakPolarHBondContact O-CB 3.42Å; I236-L240 PolarHBondContact O-N 3.45Å; Q237-L240 WeakPolarHBondContact O-CB 3.4Å; Q237-L240 PolarHBondContact O-N 3.18Å; L240-A244 WeakPolarHBondContact O-CB 3.49Å; L240-A244 PolarHBondContact O-N 3.02Å
241	E	98.3	Very high	97.6	Very high	106 Å²	106	90.2 Å²	90.2	50%	0.495	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-43.5	-179.5	-75.2	171	-164.7	0	0	112.1	Q237 V238 E239 A244 D245	Q237-E241 PolarHBondContact NE2-OE1 2.91Å; Q237-E241 WeakPolarHBondContact O-CG 3.25Å; Q237-E241 PolarHBondContact O-N 3.19Å; V238-E241 PolarHBondContact O-N 3.04Å; E239-E241 VanDerWaalsContact C-N 3.34Å; E239-E241 PolarHBondContact O-N 2.87Å; E241-A244 PolarHBondContact O-N 3.26Å; E241-D245 PolarHBondContact O-N 3.35Å
242	A	98.1	Very high	97.6	Very high	59 Å²	59	90.9 Å²	90.9	49%	0.488	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-47.1	178	0	0	0	0	0	112	V238 E239 D245 Q246	V238-A242 WeakPolarHBondContact O-CB 3.34Å; V238-A242 PolarHBondContact O-N 2.74Å; E239-A242 PolarHBondContact O-N 3.37Å; A242-D245 PolarHBondContact O-N 2.88Å; A242-Q246 PolarHBondContact O-N 3.11Å
243	E	97.6	Very high	97.5	Very high	108 Å²	108	94.4 Å²	94.4	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-66.1	-39.8	176.9	-72.7	-62.8	145.8	0	0	111.6	E239 D245 Q246 M247	E239-E243 WeakPolarHBondContact O-CB 3.12Å; E239-E243 WeakPolarHBondContact O-CG 3.47Å; E239-E243 PolarHBondContact O-N 2.73Å; E243-D245 VanDerWaalsContact C-N 3.34Å; E243-D245 PolarHBondContact O-N 3.06Å; E243-Q246 PolarHBondContact O-N 3.3Å; E243-M247 WeakPolarHBondContact O-CB 3.41Å; E243-M247 VanDerWaalsContact O-CG 3.29Å; E243-M247 WeakPolarHBondContact O-CG 3.4Å; E243-M247 PolarHBondContact O-N 3.34Å
244	A	97.9	Very high	97.4	Very high	46 Å²	46	96.4 Å²	96.4	38%	0.38	50%	0.497	S	S	.	.	H	α-helix	trans	-61.1	-42.2	176.4	0	0	0	0	0	112	L240 E241 M247 R248	L240-A244 WeakPolarHBondContact O-CB 3.49Å; L240-A244 PolarHBondContact O-N 3.02Å; E241-A244 PolarHBondContact O-N 3.26Å; A244-M247 PolarHBondContact O-N 2.74Å; A244-R248 WeakPolarHBondContact O-CB 3.28Å; A244-R248 PolarHBondContact O-N 2.95Å
245	D	97.8	Very high	97.3	Very high	85 Å²	85	96.6 Å²	96.6	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-68.3	-41.7	176.6	-98.2	-32.1	0	0	0	112.4	E241 A242 E243 M247 R248 V249	E241-D245 PolarHBondContact O-N 3.35Å; A242-D245 PolarHBondContact O-N 2.88Å; E243-D245 VanDerWaalsContact C-N 3.34Å; E243-D245 PolarHBondContact O-N 3.06Å; D245-M247 VanDerWaalsContact C-N 3.34Å; D245-M247 PolarHBondContact O-N 2.85Å; D245-R248 WeakPolarHBondContact O-CB 3.41Å; D245-R248 PolarHBondContact O-N 3.29Å; D245-R248 IonicContact OD1-CZ 2.83Å; D245-R248 IonicContact OD1-NE 2.82Å; D245-R248 PolarHBondContact OD1-NE 2.94Å; D245-R248 VanDerWaalsContact OD1-NE 3.13Å; D245-R248 IonicContact OD1-NH2 3.37Å; D245-R248 PolarHBondContact OD1-NH2 3.47Å; D245-V249 WeakPolarHBondContact O-CG2 3.31Å; D245-V249 PolarHBondContact O-N 3Å
246	Q	97.4	Very high	97.2	Very high	120 Å²	120	98.1 Å²	98.1	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-61.7	-43.2	175	-176.7	173.2	-4.3	0	0	111.6	A242 E243 R248 V249 S250	A242-Q246 PolarHBondContact O-N 3.11Å; E243-Q246 PolarHBondContact O-N 3.3Å; Q246-R248 VanDerWaalsContact C-N 3.34Å; Q246-R248 PolarHBondContact O-N 3.47Å; Q246-V249 PolarHBondContact O-N 3.13Å; Q246-S250 WeakPolarHBondContact O-CB 3.24Å; Q246-S250 PolarHBondContact O-N 2.81Å; Q246-S250 PolarHBondContact O-OG 2.94Å
247	M	97.1	Very high	97.1	Very high	116 Å²	116	97 Å²	97	57%	0.571	51%	0.509	S	S	*	.	H	α-helix	trans	-62.8	-39.7	174.5	-75.4	-170.3	-70.2	0	0	111.7	E243 A244 D245 S250 Q251	E243-M247 WeakPolarHBondContact O-CB 3.41Å; E243-M247 VanDerWaalsContact O-CG 3.29Å; E243-M247 WeakPolarHBondContact O-CG 3.4Å; E243-M247 PolarHBondContact O-N 3.34Å; A244-M247 PolarHBondContact O-N 2.74Å; D245-M247 VanDerWaalsContact C-N 3.34Å; D245-M247 PolarHBondContact O-N 2.85Å; M247-S250 PolarHBondContact O-N 2.86Å; M247-Q251 VanDerWaalsContact O-CB 3.24Å; M247-Q251 WeakPolarHBondContact O-CB 3.38Å; M247-Q251 PolarHBondContact O-N 3.36Å
248	R	97.1	Very high	96.8	Very high	124 Å²	124	98.3 Å²	98.3	47%	0.468	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-42.5	178.2	-174.5	-177.2	61	72.3	2.3	112.2	A244 D245 Q246 Q251 Q252	A244-R248 WeakPolarHBondContact O-CB 3.28Å; A244-R248 PolarHBondContact O-N 2.95Å; D245-R248 WeakPolarHBondContact O-CB 3.41Å; D245-R248 PolarHBondContact O-N 3.29Å; D245-R248 IonicContact OD1-CZ 2.83Å; D245-R248 IonicContact OD1-NE 2.82Å; D245-R248 PolarHBondContact OD1-NE 2.94Å; D245-R248 VanDerWaalsContact OD1-NE 3.13Å; D245-R248 IonicContact OD1-NH2 3.37Å; D245-R248 PolarHBondContact OD1-NH2 3.47Å; Q246-R248 VanDerWaalsContact C-N 3.34Å; Q246-R248 PolarHBondContact O-N 3.47Å; R248-Q251 PolarHBondContact O-N 3.21Å; R248-Q252 PolarHBondContact O-N 2.82Å
249	V	97.3	Very high	96.5	Very high	62 Å²	62	101.6 Å²	101.6	38%	0.376	53%	0.528	S	S	.	.	H	α-helix	trans	-64.7	-48	175.1	174.1	0	0	0	0	110.3	D245 Q246 Q251 Q252 E253	D245-V249 WeakPolarHBondContact O-CG2 3.31Å; D245-V249 PolarHBondContact O-N 3Å; Q246-V249 PolarHBondContact O-N 3.13Å; V249-Q251 VanDerWaalsContact C-N 3.27Å; V249-Q251 PolarHBondContact O-N 3.15Å; V249-Q252 WeakPolarHBondContact O-CB 3.34Å; V249-Q252 PolarHBondContact O-N 3.39Å; V249-Q252 VanDerWaalsContact O-N 3.07Å; V249-E253 HydrophobicContact CG1-CG 4.49Å; V249-E253 WeakPolarHBondContact O-CG 3.41Å; V249-E253 PolarHBondContact O-N 2.97Å
250	S	96.7	Very high	96.1	Very high	50 Å²	50	98 Å²	98	35%	0.35	52%	0.517	S	S	.	.	H	α-helix	trans	-58.5	-41	177.6	-55.9	0	0	0	0	111.7	Q246 M247 E253 L254	Q246-S250 WeakPolarHBondContact O-CB 3.24Å; Q246-S250 PolarHBondContact O-N 2.81Å; Q246-S250 PolarHBondContact O-OG 2.94Å; M247-S250 PolarHBondContact O-N 2.86Å; S250-E253 PolarHBondContact O-N 3Å; S250-L254 WeakPolarHBondContact O-CB 3.5Å; S250-L254 VanDerWaalsContact O-CG 3.27Å; S250-L254 WeakPolarHBondContact O-CG 3.39Å; S250-L254 PolarHBondContact O-N 3.29Å
251	Q	96.6	Very high	95.7	Very high	122 Å²	122	97.7 Å²	97.7	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-61.7	-45.8	175	-177.1	-176.8	21	0	0	111.4	M247 R248 V249 E253 L254 L255	M247-Q251 VanDerWaalsContact O-CB 3.24Å; M247-Q251 WeakPolarHBondContact O-CB 3.38Å; M247-Q251 PolarHBondContact O-N 3.36Å; R248-Q251 PolarHBondContact O-N 3.21Å; V249-Q251 VanDerWaalsContact C-N 3.27Å; V249-Q251 PolarHBondContact O-N 3.15Å; Q251-E253 VanDerWaalsContact C-N 3.35Å; Q251-L254 PolarHBondContact O-N 3.17Å; Q251-L255 HydrophobicContact CG-CD1 3.96Å; Q251-L255 WeakPolarHBondContact O-CB 3.48Å; Q251-L255 VanDerWaalsContact O-CG 3.24Å; Q251-L255 WeakPolarHBondContact O-CG 3.38Å; Q251-L255 PolarHBondContact O-N 3.15Å
252	Q	96.6	Very high	95.4	Very high	127 Å²	127	99.2 Å²	99.2	59%	0.593	52%	0.521	S	S	*	.	H	α-helix	trans	-62.7	-42.5	178.7	-176.8	175.7	-7	0	0	111.7	R248 V249 L255 S256	R248-Q252 PolarHBondContact O-N 2.82Å; V249-Q252 WeakPolarHBondContact O-CB 3.34Å; V249-Q252 PolarHBondContact O-N 3.39Å; V249-Q252 VanDerWaalsContact O-N 3.07Å; Q252-L255 PolarHBondContact O-N 2.91Å; Q252-S256 WeakPolarHBondContact O-CB 3.34Å; Q252-S256 PolarHBondContact O-N 3.44Å; Q252-S256 VanDerWaalsContact O-N 3.11Å
253	E	96.3	Very high	95.1	Very high	127 Å²	127	99 Å²	99	59%	0.593	51%	0.514	S	S	*	.	H	α-helix	trans	-62.7	-47.8	177	-71.6	178.2	177.6	0	0	111.6	V249 S250 Q251 L255 S256	V249-E253 HydrophobicContact CG1-CG 4.49Å; V249-E253 WeakPolarHBondContact O-CG 3.41Å; V249-E253 PolarHBondContact O-N 2.97Å; S250-E253 PolarHBondContact O-N 3Å; Q251-E253 VanDerWaalsContact C-N 3.35Å; E253-L255 VanDerWaalsContact C-N 3.25Å; E253-L255 PolarHBondContact O-N 3.05Å; E253-S256 PolarHBondContact O-N 3.11Å; E253-S256 PolarHBondContact O-OG 3.42Å
254	L	96	Very high	94.7	Very high	129 Å²	129	97.6 Å²	97.6	68%	0.675	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-28.3	178.7	-71.1	172	0	0	0	113.5	S250 Q251	S250-L254 WeakPolarHBondContact O-CB 3.5Å; S250-L254 VanDerWaalsContact O-CG 3.27Å; S250-L254 WeakPolarHBondContact O-CG 3.39Å; S250-L254 PolarHBondContact O-N 3.29Å; Q251-L254 PolarHBondContact O-N 3.17Å
255	L	95.9	Very high	94.2	Very high	115 Å²	115	96.8 Å²	96.8	60%	0.602	50%	0.503	S	S	*	.	H	α-helix	trans	-83.9	-12.8	174.9	-68.8	174.5	0	0	0	113.1	Q251 Q252 E253 V257	Q251-L255 HydrophobicContact CG-CD1 3.96Å; Q251-L255 WeakPolarHBondContact O-CB 3.48Å; Q251-L255 VanDerWaalsContact O-CG 3.24Å; Q251-L255 WeakPolarHBondContact O-CG 3.38Å; Q251-L255 PolarHBondContact O-N 3.15Å; Q252-L255 PolarHBondContact O-N 2.91Å; E253-L255 VanDerWaalsContact C-N 3.25Å; E253-L255 PolarHBondContact O-N 3.05Å; L255-V257 PolarHBondContact O-N 3.22Å
256	S	95.4	Very high	93.4	Very high	94 Å²	94	96.6 Å²	96.6	66%	0.657	50%	0.501	S	S	*	.	S	Bend	trans	-86.8	20.2	-177.8	72.5	0	0	0	0	114.1	Q252 E253	Q252-S256 WeakPolarHBondContact O-CB 3.34Å; Q252-S256 PolarHBondContact O-N 3.44Å; Q252-S256 VanDerWaalsContact O-N 3.11Å; E253-S256 PolarHBondContact O-N 3.11Å; E253-S256 PolarHBondContact O-OG 3.42Å
257	V	94.8	Very high	92.2	Very high	61 Å²	61	95 Å²	95	37%	0.37	50%	0.497	S	S	.	.	S	Bend	trans	-82.3	157.8	177.8	-59	0	0	0	0	111.8	L255 V261 Y262	L255-V257 PolarHBondContact O-N 3.22Å; V257-V261 HydrophobicContact CB-CG2 4.1Å; V257-V261 HydrophobicContact CG2-CB 4.06Å; V257-V261 HydrophobicContact CG2-CG1 4.21Å; V257-V261 HydrophobicContact CG2-CG2 4.2Å; V257-Y262 HydrophobicContact CG2-CD2 4.45Å; V257-Y262 HydrophobicContact CG2-CE1 4.43Å; V257-Y262 HydrophobicContact CG2-CE2 3.46Å; V257-Y262 VanDerWaalsContact CG2-CE2 3.46Å; V257-Y262 VanDerWaalsContact CG2-CZ 3.44Å; V257-Y262 WeakPolarHBondContact CG2-OH 3.48Å
258	D	93	Very high	91.2	Very high	108 Å²	108	92.4 Å²	92.4	58%	0.578	49%	0.487	S	S	*	.			trans	-65.8	149.6	179.2	-175.6	-99.5	0	0	0	112.3	S260 V261	D258-S260 PolarHBondContact O-N 3.3Å; D258-S260 VanDerWaalsContact O-N 3.09Å; D258-S260 WeakPolarHBondContact OD1-CB 3.36Å; D258-S260 PolarHBondContact OD1-N 3.3Å; D258-S260 PolarHBondContact OD1-OG 3.29Å; D258-V261 WeakPolarHBondContact O-CB 3.3Å; D258-V261 PolarHBondContact O-N 3.22Å
259	E	91.5	Very high	90.2	Very high	149 Å²	149	90.9 Å²	90.9	70%	0.696	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-59.6	-23	-179.5	-168.4	174.3	-174.6	0	0	112.6	V261 Y262 T263	E259-V261 PolarHBondContact O-N 3.24Å; E259-Y262 PolarHBondContact O-N 3.24Å; E259-T263 PolarHBondContact O-N 2.88Å; E259-T263 PolarHBondContact O-OG1 3.34Å
260	S	89.1	Confident	89.3	Confident	45 Å²	45	93.4 Å²	93.4	32%	0.315	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-56.2	-30.8	171.9	58.9	0	0	0	0	114	D258 Y262 T263	D258-S260 PolarHBondContact O-N 3.3Å; D258-S260 VanDerWaalsContact O-N 3.09Å; D258-S260 WeakPolarHBondContact OD1-CB 3.36Å; D258-S260 PolarHBondContact OD1-N 3.3Å; D258-S260 PolarHBondContact OD1-OG 3.29Å; S260-Y262 PolarHBondContact O-N 3.4Å; S260-T263 PolarHBondContact O-N 3.45Å
261	V	89.3	Confident	88.6	Confident	99 Å²	99	92.6 Å²	92.6	60%	0.6	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-66.2	-31.1	178.1	178.1	0	0	0	0	111.4	V257 D258 E259	V257-V261 HydrophobicContact CB-CG2 4.1Å; V257-V261 HydrophobicContact CG2-CB 4.06Å; V257-V261 HydrophobicContact CG2-CG1 4.21Å; V257-V261 HydrophobicContact CG2-CG2 4.2Å; D258-V261 WeakPolarHBondContact O-CB 3.3Å; D258-V261 PolarHBondContact O-N 3.22Å; E259-V261 PolarHBondContact O-N 3.24Å
262	Y	92	Very high	88	Confident	138 Å²	138	94.2 Å²	94.2	54%	0.541	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-15.9	-177.6	-54.4	-64	0	0	0	113.4	V257 E259 S260 P264	V257-Y262 HydrophobicContact CG2-CD2 4.45Å; V257-Y262 HydrophobicContact CG2-CE1 4.43Å; V257-Y262 HydrophobicContact CG2-CE2 3.46Å; V257-Y262 VanDerWaalsContact CG2-CE2 3.46Å; V257-Y262 VanDerWaalsContact CG2-CZ 3.44Å; V257-Y262 WeakPolarHBondContact CG2-OH 3.48Å; E259-Y262 PolarHBondContact O-N 3.24Å; S260-Y262 PolarHBondContact O-N 3.4Å; Y262-P264 WeakPolarHBondContact O-CD 3.43Å
263	T	91	Very high	87.7	Confident	54 Å²	54	90 Å²	90	33%	0.331	50%	0.499	S	S	.	.	S	Bend	trans	-90.1	111.7	-176.2	-57.1	0	0	0	0	110.6	E259 S260 I266	E259-T263 PolarHBondContact O-N 2.88Å; E259-T263 PolarHBondContact O-OG1 3.34Å; S260-T263 PolarHBondContact O-N 3.45Å; T263-I266 HydrophobicContact CG2-CB 4.16Å; T263-I266 HydrophobicContact CG2-CD1 4.26Å; T263-I266 HydrophobicContact CG2-CG1 4.43Å
264	P	90.6	Very high	87.5	Confident	79 Å²	79	87.4 Å²	87.4	51%	0.513	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	141	179	28.2	-34.1	0	0	0	110.4	Y262 I266	Y262-P264 WeakPolarHBondContact O-CD 3.43Å; P264-I266 VanDerWaalsContact C-N 3.26Å; P264-I266 PolarHBondContact O-N 3.5Å
265	D	86.6	Confident	87.3	Confident	28 Å²	28	88.3 Å²	88.3	15%	0.15	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	23	171.6	-146	29.9	0	0	0	114.7	D267 V268 R339 Y340 S359 R360	D265-D267 VanDerWaalsContact C-N 3.33Å; D265-D267 PolarHBondContact O-N 2.87Å; D265-V268 WeakPolarHBondContact O-CB 3.27Å; D265-V268 PolarHBondContact O-N 3.49Å; D265-R339 IonicContact OD2-NH1 2.7Å; D265-R339 PolarHBondContact OD2-NH1 3.42Å; D265-Y340 VanDerWaalsContact CG-OH 3.27Å; D265-Y340 PolarHBondContact OD1-OH 3.1Å; D265-Y340 VanDerWaalsContact OD2-CE2 3.31Å; D265-Y340 WeakPolarHBondContact OD2-CE2 3.5Å; D265-Y340 PolarHBondContact OD2-OH 2.92Å; D265-S359 WeakPolarHBondContact OD1-CA 3.44Å; D265-R360 PolarHBondContact OD1-N 3.28Å
266	I	80.6	Confident	87	Confident	82 Å²	82	89.3 Å²	89.3	42%	0.421	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-35.3	-179.8	-162	166.6	0	0	0	113.2	T263 P264 V268	T263-I266 HydrophobicContact CG2-CB 4.16Å; T263-I266 HydrophobicContact CG2-CD1 4.26Å; T263-I266 HydrophobicContact CG2-CG1 4.43Å; P264-I266 VanDerWaalsContact C-N 3.26Å; P264-I266 PolarHBondContact O-N 3.5Å; I266-V268 VanDerWaalsContact C-N 3.29Å; I266-V268 PolarHBondContact O-N 3.24Å
267	D	72.4	Confident	86.7	Confident	86 Å²	86	86.5 Å²	86.5	46%	0.46	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	21.7	-179.4	-61	-31.3	0	0	0	113.4	D265 A269 T270 P271	D265-D267 VanDerWaalsContact C-N 3.33Å; D265-D267 PolarHBondContact O-N 2.87Å; D267-A269 PolarHBondContact O-N 3.07Å; D267-T270 CarbonylContact O-C 3.52Å; D267-T270 PolarHBondContact O-N 3.03Å; D267-P271 WeakPolarHBondContact O-CA 3.43Å; D267-P271 WeakPolarHBondContact O-CD 3.41Å
268	V	77	Confident	86.3	Confident	62 Å²	62	87.2 Å²	87.2	38%	0.376	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.3	-174.2	69	0	0	0	0	113.6	D265 I266	D265-V268 WeakPolarHBondContact O-CB 3.27Å; D265-V268 PolarHBondContact O-N 3.49Å; I266-V268 VanDerWaalsContact C-N 3.29Å; I266-V268 PolarHBondContact O-N 3.24Å
269	A	75.3	Confident	86.1	Confident	92 Å²	92	86.8 Å²	86.8	76%	0.76	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-33.6	178.9	0	0	0	0	0	113.6	D267	D267-A269 PolarHBondContact O-N 3.07Å
270	T	79.6	Confident	86.2	Confident	114 Å²	114	80.8 Å²	80.8	70%	0.699	43%	0.434	S	S	*	.	S	Bend	trans	-144.3	66.5	179.5	53.7	0	0	0	0	111.1	D267 Q272	D267-T270 CarbonylContact O-C 3.52Å; D267-T270 PolarHBondContact O-N 3.03Å; T270-Q272 PolarHBondContact O-N 3.38Å
271	P	81.1	Confident	86.5	Confident	34 Å²	34	81 Å²	81	22%	0.221	44%	0.439	C	S	.	.			trans	-70.3	129.1	-174.7	29.2	-35.5	0	0	0	110.2	D267 I273 K361	D267-P271 WeakPolarHBondContact O-CA 3.43Å; D267-P271 WeakPolarHBondContact O-CD 3.41Å; P271-I273 HydrophobicContact CB-CD1 3.92Å; P271-I273 HydrophobicContact CB-CG1 3.84Å; P271-I273 HydrophobicContact CG-CD1 3.7Å; P271-I273 HydrophobicContact CG-CG1 4.15Å; P271-I273 PolarHBondContact O-N 2.9Å; P271-K361 HydrophobicContact CB-CB 4.29Å
272	Q	85	Confident	86.7	Confident	155 Å²	155	76.9 Å²	76.9	72%	0.724	42%	0.417	S	S	*	.			trans	-81.6	99.7	170.5	-67.3	-170.7	-19.4	0	0	109.4	T270 K361	T270-Q272 PolarHBondContact O-N 3.38Å; Q272-K361 VanDerWaalsContact O-CD 3.29Å; Q272-K361 WeakPolarHBondContact O-CD 3.42Å; Q272-K361 WeakPolarHBondContact O-CE 3.34Å
273	I	90.3	Very high	87	Confident	39 Å²	39	74.7 Å²	74.7	20%	0.2	41%	0.408	C	S	.	.			trans	-107.6	119.9	-171	-60.3	173.7	0	0	0	109.9	P271 R275 K361 E364 E365	P271-I273 HydrophobicContact CB-CD1 3.92Å; P271-I273 HydrophobicContact CB-CG1 3.84Å; P271-I273 HydrophobicContact CG-CD1 3.7Å; P271-I273 HydrophobicContact CG-CG1 4.15Å; P271-I273 PolarHBondContact O-N 2.9Å; I273-R275 HydrophobicContact CG2-CG 3.94Å; I273-R275 PolarHBondContact O-N 2.75Å; I273-K361 HydrophobicContact CG1-CB 4.5Å; I273-K361 HydrophobicContact CG1-CG 4.37Å; I273-E364 HydrophobicContact CD1-CB 3.86Å; I273-E364 HydrophobicContact CD1-CG 4.01Å; I273-E364 WeakPolarHBondContact CD1-OE2 3.29Å; I273-E364 HydrophobicContact CG2-CB 3.83Å; I273-E365 HydrophobicContact CG2-CG 3.91Å
274	N	90.4	Very high	87.4	Confident	73 Å²	73	72.2 Å²	72.2	39%	0.39	39%	0.393	S	S	.	.			trans	-86.3	106.1	171.8	-171.6	-8.6	0	0	0	111.3	N276 L277 E365	N274-N276 PolarHBondContact OD1-N 3.31Å; N274-L277 HydrophobicContact CB-CD1 4.29Å; N274-L277 HydrophobicContact CB-CD2 4.37Å; N274-L277 HydrophobicContact CB-CG 4.06Å; N274-L277 WeakPolarHBondContact ND2-CD2 3.41Å; N274-E365 PolarHBondContact N-OE1 3.07Å
275	R	92.4	Very high	87.7	Confident	147 Å²	147	70.4 Å²	70.4	56%	0.555	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-5.7	-178	-61.3	-173.1	172.1	-170.8	-6.6	114.6	I273 E364 C368 N372	I273-R275 HydrophobicContact CG2-CG 3.94Å; I273-R275 PolarHBondContact O-N 2.75Å; R275-E364 IonicContact CZ-OE2 3.7Å; R275-E364 IonicContact NH2-OE2 3.61Å; R275-E364 PolarHBondContact NH2-OE2 3.44Å; R275-C368 HydrophobicContact CB-CB 4.37Å; R275-N372 PolarHBondContact O-ND2 3.41Å
276	N	89.5	Confident	88.2	Confident	136 Å²	136	69.9 Å²	69.9	73%	0.727	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	15.3	-174.1	-60.6	-30.9	0	0	0	112.8	N274 I278	N274-N276 PolarHBondContact OD1-N 3.31Å; N276-I278 PolarHBondContact O-N 3.07Å
277	L	89.1	Confident	88.9	Confident	35 Å²	35	69.1 Å²	69.1	18%	0.183	37%	0.368	C	S	.	.			trans	-63.5	132.6	177.3	-67.3	172.6	0	0	0	110.1	N274 K280 E365 A369 N372	N274-L277 HydrophobicContact CB-CD1 4.29Å; N274-L277 HydrophobicContact CB-CD2 4.37Å; N274-L277 HydrophobicContact CB-CG 4.06Å; N274-L277 WeakPolarHBondContact ND2-CD2 3.41Å; L277-K280 HydrophobicContact CD1-CD 4.18Å; L277-E365 HydrophobicContact CD1-CB 3.95Å; L277-E365 HydrophobicContact CD1-CG 4.13Å; L277-A369 HydrophobicContact CB-CB 3.97Å; L277-A369 WeakPolarHBondContact O-CA 3.49Å; L277-N372 WeakPolarHBondContact O-CB 3.47Å; L277-N372 PolarHBondContact O-ND2 2.91Å
278	I	86.1	Confident	89.9	Confident	77 Å²	77	67.6 Å²	67.6	40%	0.395	36%	0.359	S	S	.	.	S	Bend	trans	-111.2	1.7	171	58.2	171.2	0	0	0	111.6	N276 I373	N276-I278 PolarHBondContact O-N 3.07Å; I278-I373 WeakPolarHBondContact O-CG1 3.21Å
279	Q	88.3	Confident	90.2	Very high	99 Å²	99	70.8 Å²	70.8	46%	0.463	37%	0.368	S	S	.	.			trans	-149	142.5	173	63.7	-175.6	12	0	0	109.1	T304	Q279-T304 VanDerWaalsContact CA-OG1 3.23Å; Q279-T304 WeakPolarHBondContact CA-OG1 3.43Å
280	K	93.5	Very high	90.2	Very high	22 Å²	22	70.3 Å²	70.3	10%	0.096	36%	0.356	C	S	.	.			trans	-149.8	146.4	171.9	-166.1	166.5	172.3	68.9	0	110.2	L277 F303 T304 E362 E365 W366 A369	L277-K280 HydrophobicContact CD1-CD 4.18Å; K280-F303 WeakPolarHBondContact O-CA 3.46Å; K280-T304 PolarHBondContact N-OG1 3.48Å; K280-T304 PolarHBondContact O-N 3.5Å; K280-T304 PolarHBondContact O-OG1 3.49Å; K280-E362 WeakPolarHBondContact CE-OE2 3.42Å; K280-E362 IonicContact NZ-OE1 2.98Å; K280-E362 PolarHBondContact NZ-OE1 2.88Å; K280-E362 IonicContact NZ-OE2 3.93Å; K280-E362 PolarHBondContact NZ-OE2 2.94Å; K280-E365 HydrophobicContact CD-CB 3.94Å; K280-E365 IonicContact NZ-OE2 2.74Å; K280-E365 PolarHBondContact NZ-OE2 3.01Å; K280-W366 HydrophobicContact CB-CD2 4.45Å; K280-W366 HydrophobicContact CB-CE3 4.11Å; K280-W366 HydrophobicContact CB-CH2 4.2Å; K280-W366 HydrophobicContact CB-CZ3 3.98Å; K280-W366 HydrophobicContact CD-CB 4.4Å; K280-W366 HydrophobicContact CD-CD2 3.64Å; K280-W366 HydrophobicContact CD-CE3 4.09Å; K280-W366 HydrophobicContact CD-CG 3.78Å; K280-W366 HydrophobicContact CD-CZ2 4.45Å; K280-W366 VanDerWaalsContact CE-NE1 3.33Å; K280-W366 HydrophobicContact CG-CD2 4.01Å; K280-W366 HydrophobicContact CG-CE3 4.18Å; K280-W366 HydrophobicContact CG-CH2 4.17Å; K280-W366 HydrophobicContact CG-CZ2 3.99Å; K280-W366 HydrophobicContact CG-CZ3 4.25Å; K280-A369 HydrophobicContact CB-CB 4.03Å
281	A	95.8	Very high	89.8	Confident	51 Å²	51	67.5 Å²	67.5	42%	0.421	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	145.5	175.4	0	0	0	0	0	109.9	Y301 F302 F303	A281-Y301 HydrophobicContact CB-CE1 4.21Å; A281-F302 CarbonylContact C-O 3.52Å; A281-F302 VanDerWaalsContact CA-O 3.23Å; A281-F302 WeakPolarHBondContact CA-O 3.41Å; A281-F303 HydrophobicContact CB-CB 3.68Å
282	G	95.1	Very high	89.4	Confident	12 Å²	12	73.6 Å²	73.6	12%	0.124	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.1	168.3	-176.6	0	0	0	0	0	112.9	F302	G282-F302 PolarHBondContact N-O 2.91Å; G282-F302 PolarHBondContact O-N 3.22Å
283	Y	97.9	Very high	88.9	Confident	91 Å²	91	72.6 Å²	72.6	36%	0.357	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	135.3	176	-75	-80.2	0	0	0	111.3	R299 L300 Y301	Y283-R299 HydrophobicContact CD1-CG 4.11Å; Y283-L300 WeakPolarHBondContact CA-O 3.48Å; Y283-Y301 HydrophobicContact CD1-CD2 4.09Å; Y283-Y301 AromaticContact CD2-CD2 3.74Å; Y283-Y301 HydrophobicContact CD2-CD2 3.74Å; Y283-Y301 HydrophobicContact CD2-CE2 4.22Å; Y283-Y301 HydrophobicContact CE1-CD2 4.01Å; Y283-Y301 HydrophobicContact CE1-CG 4.43Å; Y283-Y301 AromaticContact CE2-CD2 3.64Å; Y283-Y301 HydrophobicContact CE2-CD2 3.64Å; Y283-Y301 HydrophobicContact CE2-CE2 4.15Å; Y283-Y301 AromaticContact CG-CD2 3.96Å; Y283-Y301 HydrophobicContact CG-CD2 3.96Å; Y283-Y301 AromaticContact CZ-CD2 3.78Å
284	L	98.3	Very high	88.6	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.01	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	156	170	-61.6	170.5	0	0	0	109.2	L300 F302 F342 L355 Q356 A357 W366	L284-L300 PolarHBondContact N-O 3.24Å; L284-L300 PolarHBondContact O-N 2.99Å; L284-F302 HydrophobicContact CB-CD2 3.6Å; L284-F302 HydrophobicContact CB-CE2 3.88Å; L284-F302 HydrophobicContact CB-CG 4.45Å; L284-F302 HydrophobicContact CD1-CB 4.08Å; L284-F302 HydrophobicContact CD1-CD2 4.03Å; L284-F302 HydrophobicContact CD1-CG 4.06Å; L284-F302 HydrophobicContact CG-CD2 4.1Å; L284-F342 HydrophobicContact CD1-CE1 4.47Å; L284-F342 HydrophobicContact CD1-CZ 3.82Å; L284-F342 HydrophobicContact CD2-CE1 4.18Å; L284-F342 HydrophobicContact CD2-CZ 4.32Å; L284-L355 HydrophobicContact CB-CD2 4.33Å; L284-L355 HydrophobicContact CD1-CB 4.24Å; L284-L355 HydrophobicContact CD1-CD1 3.98Å; L284-L355 HydrophobicContact CD1-CD2 4.4Å; L284-L355 HydrophobicContact CD1-CG 4.44Å; L284-Q356 WeakPolarHBondContact CA-O 3.43Å; L284-Q356 WeakPolarHBondContact CD2-O 3.37Å; L284-A357 HydrophobicContact CD2-CB 3.86Å; L284-W366 HydrophobicContact CD1-CD2 4Å; L284-W366 HydrophobicContact CD1-CE3 4.37Å; L284-W366 HydrophobicContact CD1-CG 4.42Å; L284-W366 HydrophobicContact CD1-CH2 4.44Å; L284-W366 HydrophobicContact CD1-CZ2 4.08Å; L284-W366 HydrophobicContact CD2-CG 4.37Å; L284-W366 HydrophobicContact CG-CZ2 4.32Å
285	N	98.1	Very high	88.7	Confident	41 Å²	41	73.4 Å²	73.4	22%	0.219	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	120.4	167.8	-50.4	-45.3	0	0	0	109.7	W297 E298 R299 L355 Q356	N285-W297 HydrophobicContact CB-CB 4.5Å; N285-W297 HydrophobicContact CB-CE3 3.86Å; N285-E298 CarbonylContact C-O 3.59Å; N285-E298 VanDerWaalsContact CA-O 3.3Å; N285-E298 WeakPolarHBondContact CA-O 3.24Å; N285-R299 WeakPolarHBondContact OD1-CA 3.36Å; N285-R299 VanDerWaalsContact OD1-CB 3.27Å; N285-R299 WeakPolarHBondContact OD1-CB 3.41Å; N285-R299 WeakPolarHBondContact OD1-CG 3.27Å; N285-L355 CarbonylContact O-C 3.54Å; N285-L355 WeakPolarHBondContact O-CA 3.29Å; N285-Q356 HydrophobicContact CB-CB 4.09Å; N285-Q356 PolarHBondContact N-O 3.04Å; N285-Q356 PolarHBondContact ND2-OE1 3.07Å; N285-Q356 PolarHBondContact O-N 3.03Å
286	L	97.1	Very high	88.7	Confident	17 Å²	17	69.9 Å²	69.9	9%	0.089	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.6	174	178.3	64.1	0	0	0	110.3	W297 E298 L300 F302 I353 L355	L286-W297 WeakPolarHBondContact O-CA 3.44Å; L286-E298 PolarHBondContact N-O 3.07Å; L286-E298 PolarHBondContact O-N 2.89Å; L286-L300 HydrophobicContact CB-CD1 4.36Å; L286-L300 HydrophobicContact CD2-CD1 4.13Å; L286-F302 HydrophobicContact CB-CE2 4.47Å; L286-F302 HydrophobicContact CB-CZ 4.02Å; L286-F302 HydrophobicContact CD2-CZ 4.45Å; L286-I353 HydrophobicContact CD1-CB 4.2Å; L286-L355 HydrophobicContact CB-CD2 4.15Å; L286-L355 HydrophobicContact CD1-CD2 3.72Å
287	R	95.6	Very high	89	Confident	66 Å²	66	65.5 Å²	65.5	25%	0.249	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	118.5	172.1	-170.4	-172.7	-176.5	-160	4.8	110.4	W297 C335 E336 I354	R287-W297 HydrophobicContact CB-CD2 4.07Å; R287-W297 HydrophobicContact CB-CE3 3.93Å; R287-W297 HydrophobicContact CB-CH2 3.77Å; R287-W297 HydrophobicContact CB-CZ2 3.87Å; R287-W297 HydrophobicContact CB-CZ3 3.78Å; R287-W297 HydrophobicContact CG-CD2 4.3Å; R287-W297 HydrophobicContact CG-CH2 4.22Å; R287-W297 HydrophobicContact CG-CZ2 3.8Å; R287-C335 PolarHBondContact NH1-SG 3.06Å; R287-E336 IonicContact CZ-OE1 3.77Å; R287-E336 IonicContact NE-OE1 3.39Å; R287-E336 PolarHBondContact NE-OE1 3.3Å; R287-E336 IonicContact NH2-OE1 2.84Å; R287-E336 PolarHBondContact NH2-OE1 3.3Å; R287-I354 HydrophobicContact CB-CB 4.06Å; R287-I354 HydrophobicContact CB-CG2 4.37Å; R287-I354 PolarHBondContact N-O 3.09Å; R287-I354 VanDerWaalsContact NH1-CD1 3.3Å
288	N	91.6	Very high	89.4	Confident	54 Å²	54	68.1 Å²	68.1	29%	0.289	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.3	171.2	-69.7	-32.1	0	0	0	109.3	T295 T296 E298	N288-T295 CarbonylContact O-C 3.55Å; N288-T295 WeakPolarHBondContact O-CA 3.17Å; N288-T296 PolarHBondContact N-O 3.11Å; N288-T296 PolarHBondContact O-N 3.39Å; N288-E298 PolarHBondContact ND2-OE2 3.44Å
289	K	85	Confident	89.9	Confident	129 Å²	129	71.1 Å²	71.1	56%	0.561	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	102.6	177	-175.3	171.2	-177.7	178.8	0	109.6	G291 L292 T295	K289-G291 VanDerWaalsContact CE-O 3.24Å; K289-G291 WeakPolarHBondContact CE-O 3.49Å; K289-G291 WeakPolarHBondContact CG-O 3.48Å; K289-G291 PolarHBondContact O-N 2.8Å; K289-L292 WeakPolarHBondContact CE-O 3.37Å; K289-L292 PolarHBondContact NZ-O 3.32Å; K289-T295 HydrophobicContact CB-CG2 4.18Å; K289-T295 HydrophobicContact CD-CG2 4.45Å; K289-T295 HydrophobicContact CG-CG2 3.96Å
290	T	74.9	Confident	90.3	Very high	82 Å²	82	67 Å²	67	50%	0.503	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	92.8	177.9	47.5	0	0	0	0	109.1	T294	T290-T294 PolarHBondContact N-O 3.44Å; T290-T294 VanDerWaalsContact N-O 3.07Å; T290-T294 PolarHBondContact O-OG1 3.48Å
291	G	71.4	Confident	90.4	Very high	56 Å²	56	69.9 Å²	69.9	58%	0.577	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-161	-178.5	0	0	0	0	0	114.2	K289	K289-G291 VanDerWaalsContact CE-O 3.24Å; K289-G291 WeakPolarHBondContact CE-O 3.49Å; K289-G291 WeakPolarHBondContact CG-O 3.48Å; K289-G291 PolarHBondContact O-N 2.8Å
292	L	71.8	Confident	90.5	Very high	162 Å²	162	67.5 Å²	67.5	85%	0.848	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-30.6	-171	-84.1	134.4	0	0	0	114	K289	K289-L292 WeakPolarHBondContact CE-O 3.37Å; K289-L292 PolarHBondContact NZ-O 3.32Å
293	V	74.2	Confident	90.5	Very high	134 Å²	134	68.1 Å²	68.1	81%	0.812	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-34.4	-168.8	-173.5	0	0	0	0	113.3
294	T	84.7	Confident	90.1	Very high	87 Å²	87	64.6 Å²	64.6	53%	0.534	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130.6	-175.8	34.2	0	0	0	0	112.3	T290	T290-T294 PolarHBondContact N-O 3.44Å; T290-T294 VanDerWaalsContact N-O 3.07Å; T290-T294 PolarHBondContact O-OG1 3.48Å
295	T	91.4	Very high	89.4	Confident	41 Å²	41	66.3 Å²	66.3	25%	0.252	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.6	175.9	55.9	0	0	0	0	110.1	N288 K289 E336	N288-T295 CarbonylContact O-C 3.55Å; N288-T295 WeakPolarHBondContact O-CA 3.17Å; K289-T295 HydrophobicContact CB-CG2 4.18Å; K289-T295 HydrophobicContact CD-CG2 4.45Å; K289-T295 HydrophobicContact CG-CG2 3.96Å; T295-E336 VanDerWaalsContact CB-OE1 3.27Å; T295-E336 WeakPolarHBondContact CB-OE1 3.3Å; T295-E336 WeakPolarHBondContact CG2-OE1 3.24Å; T295-E336 PolarHBondContact OG1-OE1 3.38Å; T295-E336 PolarHBondContact OG1-OE2 3.03Å
296	T	93.8	Very high	88.5	Confident	73 Å²	73	65.5 Å²	65.5	45%	0.448	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.6	175.8	59	0	0	0	0	109.3	N288	N288-T296 PolarHBondContact N-O 3.11Å; N288-T296 PolarHBondContact O-N 3.39Å
297	W	96.1	Very high	87.9	Confident	44 Å²	44	65 Å²	65	17%	0.167	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129	178	-69.9	82.6	0	0	0	109.4	N285 L286 R287 E336 R338 I354 Q356	N285-W297 HydrophobicContact CB-CB 4.5Å; N285-W297 HydrophobicContact CB-CE3 3.86Å; L286-W297 WeakPolarHBondContact O-CA 3.44Å; R287-W297 HydrophobicContact CB-CD2 4.07Å; R287-W297 HydrophobicContact CB-CE3 3.93Å; R287-W297 HydrophobicContact CB-CH2 3.77Å; R287-W297 HydrophobicContact CB-CZ2 3.87Å; R287-W297 HydrophobicContact CB-CZ3 3.78Å; R287-W297 HydrophobicContact CG-CD2 4.3Å; R287-W297 HydrophobicContact CG-CH2 4.22Å; R287-W297 HydrophobicContact CG-CZ2 3.8Å; W297-E336 PolarHBondContact NE1-OE2 3.01Å; W297-R338 VanDerWaalsContact CE2-CD 3.41Å; W297-R338 VanDerWaalsContact CZ2-CD 3.47Å; W297-I354 HydrophobicContact CH2-CG2 3.81Å; W297-I354 HydrophobicContact CZ3-CG2 4.4Å; W297-Q356 HydrophobicContact CE3-CB 4.26Å; W297-Q356 HydrophobicContact CH2-CB 4.42Å; W297-Q356 HydrophobicContact CZ3-CB 3.69Å
298	E	95.9	Very high	87.5	Confident	90 Å²	90	64 Å²	64	42%	0.421	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.6	-174.8	-166.2	178	180	0	0	110.7	N285 L286 N288 L300	N285-E298 CarbonylContact C-O 3.59Å; N285-E298 VanDerWaalsContact CA-O 3.3Å; N285-E298 WeakPolarHBondContact CA-O 3.24Å; L286-E298 PolarHBondContact N-O 3.07Å; L286-E298 PolarHBondContact O-N 2.89Å; N288-E298 PolarHBondContact ND2-OE2 3.44Å; E298-L300 HydrophobicContact CB-CD1 4.39Å; E298-L300 HydrophobicContact CB-CG 4.39Å; E298-L300 HydrophobicContact CG-CD1 4.18Å; E298-L300 HydrophobicContact CG-CD2 3.96Å; E298-L300 HydrophobicContact CG-CG 3.93Å; E298-L300 PolarHBondContact O-N 3Å
299	R	97.3	Very high	87.7	Confident	141 Å²	141	61.4 Å²	61.4	53%	0.532	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	109.2	179.8	-170	171.4	-171.5	-111.8	7.8	109.9	Y283 N285 E358	Y283-R299 HydrophobicContact CD1-CG 4.11Å; N285-R299 WeakPolarHBondContact OD1-CA 3.36Å; N285-R299 VanDerWaalsContact OD1-CB 3.27Å; N285-R299 WeakPolarHBondContact OD1-CB 3.41Å; N285-R299 WeakPolarHBondContact OD1-CG 3.27Å; R299-E358 IonicContact NH2-OE2 3.6Å
300	L	96.3	Very high	88.1	Confident	13 Å²	13	55.8 Å²	55.8	7%	0.068	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	156.8	-176.4	-58.6	169.4	0	0	0	110.2	Y283 L284 L286 E298 F302 C311 P313	Y283-L300 WeakPolarHBondContact CA-O 3.48Å; L284-L300 PolarHBondContact N-O 3.24Å; L284-L300 PolarHBondContact O-N 2.99Å; L286-L300 HydrophobicContact CB-CD1 4.36Å; L286-L300 HydrophobicContact CD2-CD1 4.13Å; E298-L300 HydrophobicContact CB-CD1 4.39Å; E298-L300 HydrophobicContact CB-CG 4.39Å; E298-L300 HydrophobicContact CG-CD1 4.18Å; E298-L300 HydrophobicContact CG-CD2 3.96Å; E298-L300 HydrophobicContact CG-CG 3.93Å; E298-L300 PolarHBondContact O-N 3Å; L300-F302 HydrophobicContact CB-CD2 4.43Å; L300-F302 HydrophobicContact CB-CE2 3.75Å; L300-F302 HydrophobicContact CB-CZ 4.28Å; L300-F302 WeakPolarHBondContact O-CD2 3.35Å; L300-C311 WeakPolarHBondContact CB-SG 3.16Å; L300-C311 VanDerWaalsContact CD1-SG 3.58Å; L300-P313 HydrophobicContact CD2-CB 3.86Å; L300-P313 HydrophobicContact CD2-CG 4.05Å
301	Y	96.6	Very high	89	Confident	82 Å²	82	52.2 Å²	52.2	32%	0.322	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.3	177.7	-165.5	-103.6	0	0	0	109.8	A281 Y283 F303 C311 Q312	A281-Y301 HydrophobicContact CB-CE1 4.21Å; Y283-Y301 HydrophobicContact CD1-CD2 4.09Å; Y283-Y301 AromaticContact CD2-CD2 3.74Å; Y283-Y301 HydrophobicContact CD2-CD2 3.74Å; Y283-Y301 HydrophobicContact CD2-CE2 4.22Å; Y283-Y301 HydrophobicContact CE1-CD2 4.01Å; Y283-Y301 HydrophobicContact CE1-CG 4.43Å; Y283-Y301 AromaticContact CE2-CD2 3.64Å; Y283-Y301 HydrophobicContact CE2-CD2 3.64Å; Y283-Y301 HydrophobicContact CE2-CE2 4.15Å; Y283-Y301 AromaticContact CG-CD2 3.96Å; Y283-Y301 HydrophobicContact CG-CD2 3.96Å; Y283-Y301 AromaticContact CZ-CD2 3.78Å; Y301-F303 HydrophobicContact CD1-CD1 4.2Å; Y301-F303 HydrophobicContact CE1-CD1 4.45Å; Y301-C311 CarbonylContact O-C 3.57Å; Y301-C311 VanDerWaalsContact O-CA 3.3Å; Y301-C311 WeakPolarHBondContact O-CA 3.31Å; Y301-Q312 WeakPolarHBondContact CB-O 3.38Å; Y301-Q312 PolarHBondContact N-O 3.02Å; Y301-Q312 VanDerWaalsContact N-O 3.16Å; Y301-Q312 PolarHBondContact O-N 3.13Å
302	F	96.5	Very high	89.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	146.2	179.7	-71.3	-95.1	0	0	0	110.6	A281 G282 L284 L286 L300 L309 M310 C311 I322 L355 W366	A281-F302 CarbonylContact C-O 3.52Å; A281-F302 VanDerWaalsContact CA-O 3.23Å; A281-F302 WeakPolarHBondContact CA-O 3.41Å; G282-F302 PolarHBondContact N-O 2.91Å; G282-F302 PolarHBondContact O-N 3.22Å; L284-F302 HydrophobicContact CB-CD2 3.6Å; L284-F302 HydrophobicContact CB-CE2 3.88Å; L284-F302 HydrophobicContact CB-CG 4.45Å; L284-F302 HydrophobicContact CD1-CB 4.08Å; L284-F302 HydrophobicContact CD1-CD2 4.03Å; L284-F302 HydrophobicContact CD1-CG 4.06Å; L284-F302 HydrophobicContact CG-CD2 4.1Å; L286-F302 HydrophobicContact CB-CE2 4.47Å; L286-F302 HydrophobicContact CB-CZ 4.02Å; L286-F302 HydrophobicContact CD2-CZ 4.45Å; L300-F302 HydrophobicContact CB-CD2 4.43Å; L300-F302 HydrophobicContact CB-CE2 3.75Å; L300-F302 HydrophobicContact CB-CZ 4.28Å; L300-F302 WeakPolarHBondContact O-CD2 3.35Å; F302-L309 HydrophobicContact CB-CD1 4.25Å; F302-L309 HydrophobicContact CD1-CD1 4.13Å; F302-L309 HydrophobicContact CD1-CD2 4.17Å; F302-L309 HydrophobicContact CD1-CG 4.06Å; F302-M310 VanDerWaalsContact CA-O 3.31Å; F302-M310 WeakPolarHBondContact CA-O 3.34Å; F302-C311 HydrophobicContact CD1-CB 3.93Å; F302-C311 HydrophobicContact CE1-CB 3.7Å; F302-C311 HydrophobicContact CZ-CB 4.18Å; F302-I322 HydrophobicContact CE1-CG1 4.23Å; F302-L355 HydrophobicContact CE1-CD2 3.88Å; F302-L355 HydrophobicContact CE2-CD2 3.9Å; F302-L355 HydrophobicContact CZ-CD2 3.53Å; F302-W366 HydrophobicContact CB-CH2 3.92Å; F302-W366 HydrophobicContact CB-CZ2 4.37Å
303	F	95.1	Very high	90.8	Very high	26 Å²	26	47.3 Å²	47.3	11%	0.114	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	149.3	173.1	60.4	-83.3	0	0	0	111	K280 A281 Y301 Q305 M310 Q312 V398	K280-F303 WeakPolarHBondContact O-CA 3.46Å; A281-F303 HydrophobicContact CB-CB 3.68Å; Y301-F303 HydrophobicContact CD1-CD1 4.2Å; Y301-F303 HydrophobicContact CE1-CD1 4.45Å; F303-Q305 HydrophobicContact CD2-CB 4.21Å; F303-Q305 HydrophobicContact CE2-CB 4.16Å; F303-M310 HydrophobicContact CD1-CB 4.05Å; F303-M310 HydrophobicContact CD2-CB 3.83Å; F303-M310 HydrophobicContact CD2-CG 4.11Å; F303-M310 HydrophobicContact CE1-CB 3.68Å; F303-M310 HydrophobicContact CE2-CB 3.44Å; F303-M310 VanDerWaalsContact CE2-CB 3.44Å; F303-M310 HydrophobicContact CE2-CG 3.63Å; F303-M310 HydrophobicContact CG-CB 4.12Å; F303-M310 HydrophobicContact CZ-CB 3.36Å; F303-M310 HydrophobicContact CZ-CG 3.97Å; F303-M310 PolarHBondContact N-O 3.33Å; F303-M310 WeakPolarHBondContact O-CB 3.5Å; F303-M310 PolarHBondContact O-N 2.87Å; F303-Q312 HydrophobicContact CE1-CB 4.28Å; F303-V398 HydrophobicContact CE2-CG2 4.48Å
304	T	90.1	Very high	91.5	Very high	17 Å²	17	52.1 Å²	52.1	10%	0.104	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.9	176.9	56.1	0	0	0	0	110.6	Q279 K280 N308 L309 L325 W366 I373	Q279-T304 VanDerWaalsContact CA-OG1 3.23Å; Q279-T304 WeakPolarHBondContact CA-OG1 3.43Å; K280-T304 PolarHBondContact N-OG1 3.48Å; K280-T304 PolarHBondContact O-N 3.5Å; K280-T304 PolarHBondContact O-OG1 3.49Å; T304-N308 CarbonylContact C-O 3.56Å; T304-N308 VanDerWaalsContact CA-O 3.25Å; T304-N308 WeakPolarHBondContact CA-O 3.47Å; T304-L309 HydrophobicContact CG2-CD1 4.35Å; T304-L325 HydrophobicContact CG2-CD1 4.16Å; T304-W366 HydrophobicContact CG2-CZ3 4.3Å; T304-I373 HydrophobicContact CG2-CD1 3.6Å
305	Q	84.6	Confident	91.2	Very high	38 Å²	38	51.8 Å²	51.8	18%	0.178	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	119.3	-179.7	-161.7	-172.6	3.2	0	0	110.3	F303 G307 N308 M310 A394 V398	F303-Q305 HydrophobicContact CD2-CB 4.21Å; F303-Q305 HydrophobicContact CE2-CB 4.16Å; Q305-G307 VanDerWaalsContact C-N 3.31Å; Q305-G307 PolarHBondContact O-N 2.96Å; Q305-N308 PolarHBondContact N-O 3.37Å; Q305-N308 WeakPolarHBondContact O-CB 3.41Å; Q305-N308 PolarHBondContact O-N 3.4Å; Q305-M310 HydrophobicContact CB-CG 3.88Å; Q305-A394 HydrophobicContact CB-CB 4.29Å; Q305-A394 HydrophobicContact CG-CB 3.43Å; Q305-A394 VanDerWaalsContact CG-CB 3.43Å; Q305-V398 HydrophobicContact CG-CG2 4.36Å
306	G	78.6	Confident	90.9	Very high	23 Å²	23	51.6 Å²	51.6	24%	0.237	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	38	172.8	0	0	0	0	0	115	N308	G306-N308 VanDerWaalsContact C-N 3.31Å
307	G	83.6	Confident	90.1	Very high	6 Å²	6	55.2 Å²	55.2	6%	0.062	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-3.4	-176.3	0	0	0	0	0	115	Q305 L325	Q305-G307 VanDerWaalsContact C-N 3.31Å; Q305-G307 PolarHBondContact O-N 2.96Å; G307-L325 WeakPolarHBondContact O-CB 3.46Å; G307-L325 PolarHBondContact O-N 3.44Å
308	N	88.4	Confident	89.3	Confident	45 Å²	45	56 Å²	56	24%	0.241	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	153.4	-179.9	-64.7	-62.9	0	0	0	112.5	T304 Q305 G306 M310 L321 D324	T304-N308 CarbonylContact C-O 3.56Å; T304-N308 VanDerWaalsContact CA-O 3.25Å; T304-N308 WeakPolarHBondContact CA-O 3.47Å; Q305-N308 PolarHBondContact N-O 3.37Å; Q305-N308 WeakPolarHBondContact O-CB 3.41Å; Q305-N308 PolarHBondContact O-N 3.4Å; G306-N308 VanDerWaalsContact C-N 3.31Å; N308-M310 HydrophobicContact CB-SD 4.06Å; N308-L321 HydrophobicContact CB-CD1 3.48Å; N308-L321 VanDerWaalsContact CB-CD1 3.48Å; N308-D324 WeakPolarHBondContact OD1-CA 3.44Å
309	L	94.2	Very high	88.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.8	164.5	-175.8	65.7	0	0	0	109.7	F302 T304 I322 Q323 L325 I344 I353 L355 W366	F302-L309 HydrophobicContact CB-CD1 4.25Å; F302-L309 HydrophobicContact CD1-CD1 4.13Å; F302-L309 HydrophobicContact CD1-CD2 4.17Å; F302-L309 HydrophobicContact CD1-CG 4.06Å; T304-L309 HydrophobicContact CG2-CD1 4.35Å; L309-I322 PolarHBondContact O-N 3.21Å; L309-Q323 HydrophobicContact CB-CB 4.37Å; L309-Q323 WeakPolarHBondContact CB-O 3.42Å; L309-Q323 PolarHBondContact N-O 3.36Å; L309-Q323 PolarHBondContact O-N 2.97Å; L309-L325 HydrophobicContact CB-CD1 4.12Å; L309-L325 HydrophobicContact CB-CD2 3.89Å; L309-L325 HydrophobicContact CB-CG 4.02Å; L309-I344 HydrophobicContact CD2-CD1 3.63Å; L309-I353 HydrophobicContact CD2-CD1 3.95Å; L309-L355 HydrophobicContact CD2-CD1 4.03Å; L309-W366 HydrophobicContact CD1-CZ3 4.22Å
310	M	93.7	Very high	87.9	Confident	11 Å²	11	46.9 Å²	46.9	5%	0.054	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	154.3	179.3	-52.4	-60.1	-73.4	0	0	110.3	F302 F303 Q305 N308 G320 L321	F302-M310 VanDerWaalsContact CA-O 3.31Å; F302-M310 WeakPolarHBondContact CA-O 3.34Å; F303-M310 HydrophobicContact CD1-CB 4.05Å; F303-M310 HydrophobicContact CD2-CB 3.83Å; F303-M310 HydrophobicContact CD2-CG 4.11Å; F303-M310 HydrophobicContact CE1-CB 3.68Å; F303-M310 HydrophobicContact CE2-CB 3.44Å; F303-M310 VanDerWaalsContact CE2-CB 3.44Å; F303-M310 HydrophobicContact CE2-CG 3.63Å; F303-M310 HydrophobicContact CG-CB 4.12Å; F303-M310 HydrophobicContact CZ-CB 3.36Å; F303-M310 HydrophobicContact CZ-CG 3.97Å; F303-M310 PolarHBondContact N-O 3.33Å; F303-M310 WeakPolarHBondContact O-CB 3.5Å; F303-M310 PolarHBondContact O-N 2.87Å; Q305-M310 HydrophobicContact CB-CG 3.88Å; N308-M310 HydrophobicContact CB-SD 4.06Å; M310-G320 CarbonylContact C-O 3.51Å; M310-G320 WeakPolarHBondContact CA-O 3.38Å; M310-L321 HydrophobicContact CE-CB 4.31Å; M310-L321 HydrophobicContact SD-CB 4.08Å; M310-L321 HydrophobicContact SD-CD1 3.82Å
311	C	93.8	Very high	87.6	Confident	7 Å²	7	51.2 Å²	51.2	5%	0.047	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	129.9	177.3	173.5	0	0	0	0	111.6	L300 Y301 F302 G319 G320 I322	L300-C311 WeakPolarHBondContact CB-SG 3.16Å; L300-C311 VanDerWaalsContact CD1-SG 3.58Å; Y301-C311 CarbonylContact O-C 3.57Å; Y301-C311 VanDerWaalsContact O-CA 3.3Å; Y301-C311 WeakPolarHBondContact O-CA 3.31Å; F302-C311 HydrophobicContact CD1-CB 3.93Å; F302-C311 HydrophobicContact CE1-CB 3.7Å; F302-C311 HydrophobicContact CZ-CB 4.18Å; C311-G319 CarbonylContact O-C 3.58Å; C311-G319 VanDerWaalsContact O-CA 3.24Å; C311-G319 WeakPolarHBondContact O-CA 3.47Å; C311-G320 PolarHBondContact N-O 3.02Å; C311-G320 PolarHBondContact O-N 2.9Å; C311-I322 HydrophobicContact CB-CD1 3.72Å; C311-I322 HydrophobicContact CB-CG1 3.18Å
312	Q	91.5	Very high	87.4	Confident	58 Å²	58	50.3 Å²	50.3	27%	0.271	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.1	176.8	-171.8	171.2	10.6	0	0	110.5	Y301 F303 A316	Y301-Q312 WeakPolarHBondContact CB-O 3.38Å; Y301-Q312 PolarHBondContact N-O 3.02Å; Y301-Q312 VanDerWaalsContact N-O 3.16Å; Y301-Q312 PolarHBondContact O-N 3.13Å; F303-Q312 HydrophobicContact CE1-CB 4.28Å; Q312-A316 HydrophobicContact CG-CB 4.32Å; Q312-A316 PolarHBondContact NE2-O 3.36Å
313	P	89.5	Confident	87	Confident	57 Å²	57	52 Å²	52	37%	0.37	31%	0.311	S	S	.	.			trans	-65.4	151.5	168.5	-19	31.4	0	0	0	111.9	L300 G315 A316	L300-P313 HydrophobicContact CD2-CB 3.86Å; L300-P313 HydrophobicContact CD2-CG 4.05Å; P313-G315 PolarHBondContact O-N 3.04Å; P313-A316 HydrophobicContact CB-CB 4.42Å; P313-A316 WeakPolarHBondContact O-CB 3.46Å; P313-A316 PolarHBondContact O-N 3.42Å; P313-A316 VanDerWaalsContact O-N 3.15Å
314	R	89.4	Confident	86.8	Confident	236 Å²	236	54.4 Å²	54.4	89%	0.891	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	125.7	174.2	-172.9	176.7	178.2	174.7	0.2	109.7
315	G	79.1	Confident	86.7	Confident	80 Å²	80	53.6 Å²	53.6	83%	0.825	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	94	-5.6	-177.8	0	0	0	0	0	114.7	P313	P313-G315 PolarHBondContact O-N 3.04Å
316	A	83.8	Confident	86.7	Confident	37 Å²	37	54.2 Å²	54.2	31%	0.306	33%	0.325	S	S	.	.			trans	-81.8	139.4	170.7	0	0	0	0	0	110.9	Q312 P313 A318	Q312-A316 HydrophobicContact CG-CB 4.32Å; Q312-A316 PolarHBondContact NE2-O 3.36Å; P313-A316 HydrophobicContact CB-CB 4.42Å; P313-A316 WeakPolarHBondContact O-CB 3.46Å; P313-A316 PolarHBondContact O-N 3.42Å; P313-A316 VanDerWaalsContact O-N 3.15Å; A316-A318 VanDerWaalsContact C-N 3.31Å; A316-A318 PolarHBondContact O-N 3.46Å
317	V	78.6	Confident	86.9	Confident	149 Å²	149	56.2 Å²	56.2	90%	0.903	33%	0.33	S	S	*	.	S	Bend	trans	-68.4	-30.5	178.1	179.6	0	0	0	0	111.9
318	A	77.7	Confident	87.2	Confident	60 Å²	60	56.1 Å²	56.1	50%	0.496	33%	0.329	S	S	.	.	S	Bend	trans	-140.6	156.7	-178.7	0	0	0	0	0	112.2	A316	A316-A318 VanDerWaalsContact C-N 3.31Å; A316-A318 PolarHBondContact O-N 3.46Å
319	G	80.1	Confident	87.2	Confident	11 Å²	11	56.9 Å²	56.9	11%	0.113	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-89.6	143.1	174.1	0	0	0	0	0	112.7	C311	C311-G319 CarbonylContact O-C 3.58Å; C311-G319 VanDerWaalsContact O-CA 3.24Å; C311-G319 WeakPolarHBondContact O-CA 3.47Å
320	G	83.8	Confident	87.2	Confident	29 Å²	29	57.4 Å²	57.4	30%	0.299	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	153.9	175.7	0	0	0	0	0	112.9	M310 C311 I322	M310-G320 CarbonylContact C-O 3.51Å; M310-G320 WeakPolarHBondContact CA-O 3.38Å; C311-G320 PolarHBondContact N-O 3.02Å; C311-G320 PolarHBondContact O-N 2.9Å; G320-I322 PolarHBondContact O-N 3.33Å
321	L	90.8	Very high	87.1	Confident	103 Å²	103	62 Å²	62	54%	0.539	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125.3	170.6	175.8	64.6	0	0	0	110	N308 M310	N308-L321 HydrophobicContact CB-CD1 3.48Å; N308-L321 VanDerWaalsContact CB-CD1 3.48Å; M310-L321 HydrophobicContact CE-CB 4.31Å; M310-L321 HydrophobicContact SD-CB 4.08Å; M310-L321 HydrophobicContact SD-CD1 3.82Å
322	I	91.6	Very high	87.1	Confident	64 Å²	64	64.4 Å²	64.4	33%	0.328	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-47.4	175.7	-66.6	-61.4	0	0	0	111.5	F302 L309 C311 G320 I353	F302-I322 HydrophobicContact CE1-CG1 4.23Å; L309-I322 PolarHBondContact O-N 3.21Å; C311-I322 HydrophobicContact CB-CD1 3.72Å; C311-I322 HydrophobicContact CB-CG1 3.18Å; G320-I322 PolarHBondContact O-N 3.33Å; I322-I353 HydrophobicContact CG2-CD1 3.49Å; I322-I353 VanDerWaalsContact CG2-CD1 3.49Å; I322-I353 HydrophobicContact CG2-CG2 4.48Å
323	Q	89.6	Confident	87.2	Confident	34 Å²	34	63.3 Å²	63.3	16%	0.159	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	128.6	-173.7	-177.1	59.8	67.4	0	0	109.8	L309 L325 I344 I353	L309-Q323 HydrophobicContact CB-CB 4.37Å; L309-Q323 WeakPolarHBondContact CB-O 3.42Å; L309-Q323 PolarHBondContact N-O 3.36Å; L309-Q323 PolarHBondContact O-N 2.97Å; Q323-L325 HydrophobicContact CG-CD2 4.27Å; Q323-I344 HydrophobicContact CG-CG2 4.12Å; Q323-I353 HydrophobicContact CB-CD1 4.24Å
324	D	89.4	Confident	87.4	Confident	78 Å²	78	68.5 Å²	68.5	42%	0.417	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	124.8	163.4	-177	-4.4	0	0	0	108.4	N308 D326 C328	N308-D324 WeakPolarHBondContact OD1-CA 3.44Å; D324-D326 WeakPolarHBondContact OD1-CB 3.21Å; D324-D326 PolarHBondContact OD1-N 3.03Å; D324-C328 PolarHBondContact O-SG 3.38Å
325	L	89.8	Confident	87.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	37%	0.366	C	S	.	.			trans	-88.9	-3.9	-177.4	-56.1	176.7	0	0	0	112.6	T304 G307 L309 Q323 N327 C328 I344 I370 I373 S374	T304-L325 HydrophobicContact CG2-CD1 4.16Å; G307-L325 WeakPolarHBondContact O-CB 3.46Å; G307-L325 PolarHBondContact O-N 3.44Å; L309-L325 HydrophobicContact CB-CD1 4.12Å; L309-L325 HydrophobicContact CB-CD2 3.89Å; L309-L325 HydrophobicContact CB-CG 4.02Å; Q323-L325 HydrophobicContact CG-CD2 4.27Å; L325-N327 PolarHBondContact O-N 3.4Å; L325-C328 PolarHBondContact O-N 2.89Å; L325-C328 VanDerWaalsContact O-N 3.16Å; L325-I344 HydrophobicContact CD2-CD1 4.23Å; L325-I344 HydrophobicContact CD2-CG2 4.22Å; L325-I370 HydrophobicContact CD1-CG1 4.2Å; L325-I370 HydrophobicContact CD1-CG2 4.34Å; L325-I370 HydrophobicContact CD2-CG2 3.94Å; L325-I373 HydrophobicContact CB-CG2 4.11Å; L325-I373 HydrophobicContact CD1-CD1 4.23Å; L325-I373 HydrophobicContact CD1-CG2 4.2Å; L325-S374 WeakPolarHBondContact O-CA 3.49Å; L325-S374 WeakPolarHBondContact O-CB 3.09Å; L325-S374 PolarHBondContact O-OG 2.81Å
326	D	84.6	Confident	88.1	Confident	51 Å²	51	57.7 Å²	57.7	27%	0.273	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	127.4	173.9	-173.3	25.7	0	0	0	110.4	D324 C328 P347 I377	D324-D326 WeakPolarHBondContact OD1-CB 3.21Å; D324-D326 PolarHBondContact OD1-N 3.03Å; D326-C328 PolarHBondContact O-N 3.15Å; D326-P347 WeakPolarHBondContact O-CG 3.48Å; D326-I377 HydrophobicContact CB-CD1 4.3Å; D326-I377 HydrophobicContact CB-CG2 4.37Å; D326-I377 WeakPolarHBondContact OD1-CG2 3.25Å
327	N	82.3	Confident	88.6	Confident	64 Å²	64	64.2 Å²	64.2	34%	0.342	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	17.6	-176	-66.2	-43.5	0	0	0	116.4	L325 P347 Y378	L325-N327 PolarHBondContact O-N 3.4Å; N327-P347 HydrophobicContact CB-CB 4.05Å; N327-P347 HydrophobicContact CB-CG 3.82Å; N327-Y378 WeakPolarHBondContact OD1-CB 3.41Å; N327-Y378 WeakPolarHBondContact OD1-CD2 3.35Å; N327-Y378 VanDerWaalsContact OD1-CG 3.29Å
328	C	89.1	Confident	89.4	Confident	4 Å²	4	61.8 Å²	61.8	3%	0.027	35%	0.349	C	S	.	.			trans	-76.7	144.4	172.4	-78.9	0	0	0	0	111.7	D324 L325 D326 I344 S345 S374	D324-C328 PolarHBondContact O-SG 3.38Å; L325-C328 PolarHBondContact O-N 2.89Å; L325-C328 VanDerWaalsContact O-N 3.16Å; D326-C328 PolarHBondContact O-N 3.15Å; C328-I344 HydrophobicContact CB-CG2 3.87Å; C328-S345 WeakPolarHBondContact CA-O 3.35Å; C328-S374 PolarHBondContact N-OG 3.16Å; C328-S374 WeakPolarHBondContact O-CB 3.41Å; C328-S374 PolarHBondContact O-OG 3.48Å
329	S	89.1	Confident	90.3	Very high	62 Å²	62	66.6 Å²	66.6	43%	0.434	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.9	169.2	65.3	0	0	0	0	109.9	S345	S329-S345 PolarHBondContact N-O 3.09Å; S329-S345 VanDerWaalsContact N-O 3.09Å; S329-S345 PolarHBondContact O-N 2.94Å
330	V	93.8	Very high	91.1	Very high	11 Å²	11	68.1 Å²	68.1	7%	0.067	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.6	173	61.1	0	0	0	0	110.5	F342 Q343 I344 I367 I370 N371	V330-F342 HydrophobicContact CG2-CD2 3.7Å; V330-F342 HydrophobicContact CG2-CE2 4.42Å; V330-Q343 WeakPolarHBondContact CA-O 3.5Å; V330-I344 HydrophobicContact CB-CG1 4.28Å; V330-I344 HydrophobicContact CG2-CG1 3.98Å; V330-I367 HydrophobicContact CG1-CG2 4.06Å; V330-I367 WeakPolarHBondContact CG1-O 3.39Å; V330-I367 HydrophobicContact CG2-CG1 4.12Å; V330-I367 HydrophobicContact CG2-CG2 4.48Å; V330-I370 HydrophobicContact CB-CB 4.26Å; V330-I370 HydrophobicContact CB-CG2 3.77Å; V330-I370 HydrophobicContact CG1-CB 3.84Å; V330-I370 HydrophobicContact CG1-CG2 3.67Å; V330-I370 HydrophobicContact CG2-CD1 4.23Å; V330-I370 HydrophobicContact CG2-CG2 4.44Å; V330-N371 HydrophobicContact CG1-CB 4.28Å; V330-N371 VanDerWaalsContact CG1-ND2 3.3Å; V330-N371 WeakPolarHBondContact CG1-ND2 3.46Å; V330-N371 WeakPolarHBondContact CG1-OD1 3.47Å
331	M	91.8	Very high	91.8	Very high	106 Å²	106	66.9 Å²	66.9	52%	0.522	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	153.4	-178.2	61.5	-170.4	-71.4	0	0	112.7	F342 Q343	M331-F342 CarbonylContact O-C 3.52Å; M331-F342 VanDerWaalsContact O-CA 3.26Å; M331-F342 WeakPolarHBondContact O-CA 3.4Å; M331-F342 WeakPolarHBondContact O-CB 3.35Å; M331-Q343 PolarHBondContact N-O 3.3Å; M331-Q343 PolarHBondContact O-N 2.91Å
332	A	93.9	Very high	92.1	Very high	59 Å²	59	62 Å²	62	49%	0.488	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	137.6	167.8	0	0	0	0	0	111.1	Y363	A332-Y363 WeakPolarHBondContact CA-OH 3.45Å; A332-Y363 WeakPolarHBondContact CB-OH 3.47Å
333	V	94.2	Very high	92.3	Very high	35 Å²	35	60.2 Å²	60.2	21%	0.212	31%	0.308	C	S	.	.			trans	-141.3	136	176.1	68.4	0	0	0	0	111.6	C341 Q343 I354	V333-C341 HydrophobicContact CG1-CB 4.09Å; V333-C341 PolarHBondContact N-O 3.44Å; V333-C341 VanDerWaalsContact O-CB 3.26Å; V333-C341 WeakPolarHBondContact O-CB 3.26Å; V333-C341 VanDerWaalsContact O-O 3.04Å; V333-Q343 HydrophobicContact CB-CB 4.35Å; V333-Q343 HydrophobicContact CG1-CB 4Å; V333-I354 HydrophobicContact CG1-CG2 4.2Å
334	D	93.1	Very high	92.5	Very high	166 Å²	166	58.6 Å²	58.6	89%	0.888	30%	0.301	S	S	*	.			trans	-81.9	117.6	167.3	-65.7	-41.3	0	0	0	109
335	C	91.4	Very high	92.6	Very high	7 Å²	7	55.5 Å²	55.5	5%	0.047	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-137.5	118.2	-176.4	-175.5	0	0	0	0	110.9	R287 D337 R338 C341 I354	R287-C335 PolarHBondContact NH1-SG 3.06Å; C335-D337 PolarHBondContact O-N 3.34Å; C335-D337 VanDerWaalsContact O-N 3.13Å; C335-R338 WeakPolarHBondContact O-CB 3.36Å; C335-R338 PolarHBondContact O-N 2.95Å; C335-C341 HydrophobicContact CB-CB 4.22Å; C335-I354 HydrophobicContact CB-CG2 4.34Å
336	E	91.8	Very high	92.5	Very high	82 Å²	82	57.1 Å²	57.1	38%	0.383	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	33.4	174.4	-60.5	173.5	-162.8	0	0	114.2	R287 T295 W297 R338	R287-E336 IonicContact CZ-OE1 3.77Å; R287-E336 IonicContact NE-OE1 3.39Å; R287-E336 PolarHBondContact NE-OE1 3.3Å; R287-E336 IonicContact NH2-OE1 2.84Å; R287-E336 PolarHBondContact NH2-OE1 3.3Å; T295-E336 VanDerWaalsContact CB-OE1 3.27Å; T295-E336 WeakPolarHBondContact CB-OE1 3.3Å; T295-E336 WeakPolarHBondContact CG2-OE1 3.24Å; T295-E336 PolarHBondContact OG1-OE1 3.38Å; T295-E336 PolarHBondContact OG1-OE2 3.03Å; W297-E336 PolarHBondContact NE1-OE2 3.01Å; E336-R338 PolarHBondContact O-N 3.34Å; E336-R338 VanDerWaalsContact O-N 3.14Å
337	D	94.1	Very high	92.3	Very high	174 Å²	174	58.8 Å²	58.8	93%	0.93	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	25.2	-176.4	-161.2	34.1	0	0	0	113.9	C335	C335-D337 PolarHBondContact O-N 3.34Å; C335-D337 VanDerWaalsContact O-N 3.13Å
338	R	96.6	Very high	92.2	Very high	98 Å²	98	59.7 Å²	59.7	37%	0.37	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-91	133.5	176.1	-72	176.9	173.7	-98.4	-4	111	W297 C335 E336 C341 Q356	W297-R338 VanDerWaalsContact CE2-CD 3.41Å; W297-R338 VanDerWaalsContact CZ2-CD 3.47Å; C335-R338 WeakPolarHBondContact O-CB 3.36Å; C335-R338 PolarHBondContact O-N 2.95Å; E336-R338 PolarHBondContact O-N 3.34Å; E336-R338 VanDerWaalsContact O-N 3.14Å; R338-C341 VanDerWaalsContact CB-SG 3.59Å; R338-Q356 VanDerWaalsContact NH1-OE1 3.08Å
339	R	95.7	Very high	91.3	Very high	160 Å²	160	62.5 Å²	62.5	60%	0.604	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	148.3	174.4	-58.5	-173.1	-64.7	148.2	1.2	110.9	D265 C341 Q356	D265-R339 IonicContact OD2-NH1 2.7Å; D265-R339 PolarHBondContact OD2-NH1 3.42Å; R339-C341 PolarHBondContact O-N 3.39Å; R339-Q356 WeakPolarHBondContact O-CG 3.39Å; R339-Q356 PolarHBondContact O-NE2 3.02Å
340	Y	96.5	Very high	90.8	Very high	44 Å²	44	66.5 Å²	66.5	17%	0.173	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	38	168.6	-51	-42.5	0	0	0	114.8	D265 Q356 A357 R360 Y363	D265-Y340 VanDerWaalsContact CG-OH 3.27Å; D265-Y340 PolarHBondContact OD1-OH 3.1Å; D265-Y340 VanDerWaalsContact OD2-CE2 3.31Å; D265-Y340 WeakPolarHBondContact OD2-CE2 3.5Å; D265-Y340 PolarHBondContact OD2-OH 2.92Å; Y340-Q356 WeakPolarHBondContact O-CA 3.45Å; Y340-A357 WeakPolarHBondContact CB-O 3.48Å; Y340-A357 PolarHBondContact O-N 2.94Å; Y340-R360 HydrophobicContact CE1-CB 3.85Å; Y340-R360 HydrophobicContact CE1-CG 4.48Å; Y340-Y363 VanDerWaalsContact C-CD2 3.46Å; Y340-Y363 HydrophobicContact CD1-CD1 4.27Å; Y340-Y363 HydrophobicContact CD1-CG 4.14Å; Y340-Y363 HydrophobicContact CG-CG 4.39Å; Y340-Y363 VanDerWaalsContact O-CD2 3.29Å; Y340-Y363 WeakPolarHBondContact O-CD2 3.42Å
341	C	97.8	Very high	89.8	Confident	2 Å²	2	71 Å²	71	1%	0.014	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.4	173.9	-70.6	0	0	0	0	111.7	V333 C335 R338 R339 L355 Y363	V333-C341 HydrophobicContact CG1-CB 4.09Å; V333-C341 PolarHBondContact N-O 3.44Å; V333-C341 VanDerWaalsContact O-CB 3.26Å; V333-C341 WeakPolarHBondContact O-CB 3.26Å; V333-C341 VanDerWaalsContact O-O 3.04Å; C335-C341 HydrophobicContact CB-CB 4.22Å; R338-C341 VanDerWaalsContact CB-SG 3.59Å; R339-C341 PolarHBondContact O-N 3.39Å; C341-L355 CarbonylContact C-O 3.53Å; C341-L355 VanDerWaalsContact CA-O 3.29Å; C341-L355 WeakPolarHBondContact CA-O 3.49Å; C341-Y363 WeakPolarHBondContact O-CE2 3.29Å
342	F	97.4	Very high	89.5	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	153.6	173.4	61.6	-84.3	0	0	0	110.4	L284 V330 M331 I344 I354 L355 A357 Y363 W366 I367 I370	L284-F342 HydrophobicContact CD1-CE1 4.47Å; L284-F342 HydrophobicContact CD1-CZ 3.82Å; L284-F342 HydrophobicContact CD2-CE1 4.18Å; L284-F342 HydrophobicContact CD2-CZ 4.32Å; V330-F342 HydrophobicContact CG2-CD2 3.7Å; V330-F342 HydrophobicContact CG2-CE2 4.42Å; M331-F342 CarbonylContact O-C 3.52Å; M331-F342 VanDerWaalsContact O-CA 3.26Å; M331-F342 WeakPolarHBondContact O-CA 3.4Å; M331-F342 WeakPolarHBondContact O-CB 3.35Å; F342-I344 HydrophobicContact CD2-CG1 4.48Å; F342-I344 HydrophobicContact CE2-CD1 4.49Å; F342-I344 HydrophobicContact CE2-CG1 4.49Å; F342-I354 WeakPolarHBondContact O-CA 3.24Å; F342-L355 HydrophobicContact CD1-CB 4.44Å; F342-L355 HydrophobicContact CD2-CB 4.35Å; F342-L355 HydrophobicContact CE1-CB 3.93Å; F342-L355 HydrophobicContact CE2-CB 3.84Å; F342-L355 HydrophobicContact CE2-CD1 3.74Å; F342-L355 HydrophobicContact CE2-CG 4.39Å; F342-L355 HydrophobicContact CZ-CB 3.62Å; F342-L355 HydrophobicContact CZ-CD1 3.95Å; F342-L355 HydrophobicContact CZ-CG 4.44Å; F342-L355 PolarHBondContact N-O 3.37Å; F342-L355 PolarHBondContact O-N 3.29Å; F342-A357 HydrophobicContact CE1-CB 4.47Å; F342-Y363 HydrophobicContact CB-CE2 3.9Å; F342-Y363 AromaticContact CD1-CD2 3.9Å; F342-Y363 HydrophobicContact CD1-CD2 3.9Å; F342-Y363 HydrophobicContact CD1-CE2 4.07Å; F342-Y363 HydrophobicContact CG-CE2 4.45Å; F342-W366 HydrophobicContact CE1-CB 4.07Å; F342-W366 HydrophobicContact CE1-CG 4.5Å; F342-W366 HydrophobicContact CE2-CB 4.4Å; F342-W366 HydrophobicContact CZ-CB 3.75Å; F342-W366 HydrophobicContact CZ-CG 4.14Å; F342-I367 HydrophobicContact CB-CD1 3.9Å; F342-I367 HydrophobicContact CB-CG1 3.91Å; F342-I367 HydrophobicContact CD2-CG1 4.39Å; F342-I367 HydrophobicContact CG-CD1 4.5Å; F342-I367 HydrophobicContact CG-CG1 4.07Å; F342-I370 HydrophobicContact CE2-CD1 3.84Å
343	Q	95.8	Very high	89.4	Confident	27 Å²	27	66 Å²	66	13%	0.126	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134	-179.5	-174.4	170.1	17.4	0	0	110.4	V330 M331 V333 G352 I353 I354	V330-Q343 WeakPolarHBondContact CA-O 3.5Å; M331-Q343 PolarHBondContact N-O 3.3Å; M331-Q343 PolarHBondContact O-N 2.91Å; V333-Q343 HydrophobicContact CB-CB 4.35Å; V333-Q343 HydrophobicContact CG1-CB 4Å; Q343-G352 PolarHBondContact NE2-O 3.09Å; Q343-I353 WeakPolarHBondContact CA-O 3.3Å; Q343-I353 WeakPolarHBondContact CG-O 3.37Å; Q343-I354 HydrophobicContact CB-CG1 4.13Å; Q343-I354 HydrophobicContact CG-CG1 3.94Å
344	I	95	Very high	89.5	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.1	169.7	-56.1	169.3	0	0	0	106.8	L309 Q323 L325 C328 V330 F342 G352 I353 L355 I370	L309-I344 HydrophobicContact CD2-CD1 3.63Å; Q323-I344 HydrophobicContact CG-CG2 4.12Å; L325-I344 HydrophobicContact CD2-CD1 4.23Å; L325-I344 HydrophobicContact CD2-CG2 4.22Å; C328-I344 HydrophobicContact CB-CG2 3.87Å; V330-I344 HydrophobicContact CB-CG1 4.28Å; V330-I344 HydrophobicContact CG2-CG1 3.98Å; F342-I344 HydrophobicContact CD2-CG1 4.48Å; F342-I344 HydrophobicContact CE2-CD1 4.49Å; F342-I344 HydrophobicContact CE2-CG1 4.49Å; I344-G352 CarbonylContact O-C 3.56Å; I344-G352 VanDerWaalsContact O-C 3.25Å; I344-G352 WeakPolarHBondContact O-CA 3.36Å; I344-G352 PolarHBondContact O-N 2.79Å; I344-I353 HydrophobicContact CB-CG1 4.14Å; I344-I353 HydrophobicContact CD1-CD1 4.19Å; I344-I353 HydrophobicContact CD1-CG1 4.3Å; I344-I353 PolarHBondContact N-O 2.69Å; I344-I353 PolarHBondContact O-N 3.08Å; I344-L355 HydrophobicContact CD1-CD1 3.96Å; I344-I370 HydrophobicContact CD1-CD1 3.62Å; I344-I370 HydrophobicContact CG1-CD1 4.11Å
345	S	91.3	Very high	89.8	Confident	14 Å²	14	57.4 Å²	57.4	10%	0.098	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.3	177.7	-59.5	0	0	0	0	110.3	C328 S329	C328-S345 WeakPolarHBondContact CA-O 3.35Å; S329-S345 PolarHBondContact N-O 3.09Å; S329-S345 VanDerWaalsContact N-O 3.09Å; S329-S345 PolarHBondContact O-N 2.94Å
346	T	86.6	Confident	90.1	Very high	33 Å²	33	58.2 Å²	58.2	20%	0.202	32%	0.317	C	S	.	.			trans	-66.3	160.4	179.7	64.4	0	0	0	0	111.5	S348 G349 K350	T346-S348 PolarHBondContact O-N 3.05Å; T346-S348 PolarHBondContact OG1-OG 3.29Å; T346-G349 PolarHBondContact O-N 3.4Å; T346-K350 PolarHBondContact N-O 2.87Å
347	P	81.9	Confident	90.4	Very high	87 Å²	87	54.5 Å²	54.5	57%	0.565	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-24	177.7	-25	33.9	0	0	0	113.9	D326 N327 G349	D326-P347 WeakPolarHBondContact O-CG 3.48Å; N327-P347 HydrophobicContact CB-CB 4.05Å; N327-P347 HydrophobicContact CB-CG 3.82Å; P347-G349 PolarHBondContact O-N 2.93Å
348	S	78.6	Confident	90.4	Very high	82 Å²	82	51 Å²	51	57%	0.573	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-3	176.6	72.9	0	0	0	0	114.7	T346 K350	T346-S348 PolarHBondContact O-N 3.05Å; T346-S348 PolarHBondContact OG1-OG 3.29Å; S348-K350 PolarHBondContact O-N 3.41Å
349	G	71.8	Confident	90.4	Very high	63 Å²	63	47 Å²	47	65%	0.649	27%	0.266	S	S	*	.			trans	75.8	1.8	-177.1	0	0	0	0	0	114.4	T346 P347	T346-G349 PolarHBondContact O-N 3.4Å; P347-G349 PolarHBondContact O-N 2.93Å
350	K	78.3	Confident	90.3	Very high	147 Å²	147	44.6 Å²	44.6	64%	0.639	26%	0.256	S	S	*	.			trans	-70.8	139	173.6	-69.2	-179.3	-177.9	177.4	0	110.6	T346 S348 G352	T346-K350 PolarHBondContact N-O 2.87Å; S348-K350 PolarHBondContact O-N 3.41Å; K350-G352 PolarHBondContact O-N 2.68Å; K350-G352 VanDerWaalsContact O-N 3.12Å
351	P	72.6	Confident	90.1	Very high	106 Å²	106	45.9 Å²	45.9	69%	0.688	26%	0.263	S	S	*	.			trans	-60.1	117.3	176	24.7	-32.4	0	0	0	109.1
352	G	84.1	Confident	90	Very high	23 Å²	23	48 Å²	48	24%	0.237	27%	0.273	C	S	.	.			trans	-94.1	-150	178.7	0	0	0	0	0	112	Q343 I344 K350	Q343-G352 PolarHBondContact NE2-O 3.09Å; I344-G352 CarbonylContact O-C 3.56Å; I344-G352 VanDerWaalsContact O-C 3.25Å; I344-G352 WeakPolarHBondContact O-CA 3.36Å; I344-G352 PolarHBondContact O-N 2.79Å; K350-G352 PolarHBondContact O-N 2.68Å; K350-G352 VanDerWaalsContact O-N 3.12Å
353	I	93.8	Very high	90	Very high	37 Å²	37	49.7 Å²	49.7	19%	0.19	28%	0.279	C	S	.	.			trans	-70.7	146.7	-172.1	65.1	-178.8	0	0	0	112.8	L286 L309 I322 Q323 Q343 I344 L355	L286-I353 HydrophobicContact CD1-CB 4.2Å; L309-I353 HydrophobicContact CD2-CD1 3.95Å; I322-I353 HydrophobicContact CG2-CD1 3.49Å; I322-I353 VanDerWaalsContact CG2-CD1 3.49Å; I322-I353 HydrophobicContact CG2-CG2 4.48Å; Q323-I353 HydrophobicContact CB-CD1 4.24Å; Q343-I353 WeakPolarHBondContact CA-O 3.3Å; Q343-I353 WeakPolarHBondContact CG-O 3.37Å; I344-I353 HydrophobicContact CB-CG1 4.14Å; I344-I353 HydrophobicContact CD1-CD1 4.19Å; I344-I353 HydrophobicContact CD1-CG1 4.3Å; I344-I353 PolarHBondContact N-O 2.69Å; I344-I353 PolarHBondContact O-N 3.08Å; I353-L355 HydrophobicContact CD1-CD1 4.13Å; I353-L355 HydrophobicContact CD1-CG 4.47Å; I353-L355 HydrophobicContact CG1-CD1 4.48Å
354	I	96.1	Very high	89.9	Confident	19 Å²	19	50 Å²	50	10%	0.097	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.8	175.5	-62.6	167.2	0	0	0	108.6	R287 W297 V333 C335 F342 Q343	R287-I354 HydrophobicContact CB-CB 4.06Å; R287-I354 HydrophobicContact CB-CG2 4.37Å; R287-I354 PolarHBondContact N-O 3.09Å; R287-I354 VanDerWaalsContact NH1-CD1 3.3Å; W297-I354 HydrophobicContact CH2-CG2 3.81Å; W297-I354 HydrophobicContact CZ3-CG2 4.4Å; V333-I354 HydrophobicContact CG1-CG2 4.2Å; C335-I354 HydrophobicContact CB-CG2 4.34Å; F342-I354 WeakPolarHBondContact O-CA 3.24Å; Q343-I354 HydrophobicContact CB-CG1 4.13Å; Q343-I354 HydrophobicContact CG-CG1 3.94Å
355	L	98.1	Very high	90	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	153.4	-177.6	-64.9	167	0	0	0	109.7	L284 N285 L286 F302 L309 C341 F342 I344 I353	L284-L355 HydrophobicContact CB-CD2 4.33Å; L284-L355 HydrophobicContact CD1-CB 4.24Å; L284-L355 HydrophobicContact CD1-CD1 3.98Å; L284-L355 HydrophobicContact CD1-CD2 4.4Å; L284-L355 HydrophobicContact CD1-CG 4.44Å; N285-L355 CarbonylContact O-C 3.54Å; N285-L355 WeakPolarHBondContact O-CA 3.29Å; L286-L355 HydrophobicContact CB-CD2 4.15Å; L286-L355 HydrophobicContact CD1-CD2 3.72Å; F302-L355 HydrophobicContact CE1-CD2 3.88Å; F302-L355 HydrophobicContact CE2-CD2 3.9Å; F302-L355 HydrophobicContact CZ-CD2 3.53Å; L309-L355 HydrophobicContact CD2-CD1 4.03Å; C341-L355 CarbonylContact C-O 3.53Å; C341-L355 VanDerWaalsContact CA-O 3.29Å; C341-L355 WeakPolarHBondContact CA-O 3.49Å; F342-L355 HydrophobicContact CD1-CB 4.44Å; F342-L355 HydrophobicContact CD2-CB 4.35Å; F342-L355 HydrophobicContact CE1-CB 3.93Å; F342-L355 HydrophobicContact CE2-CB 3.84Å; F342-L355 HydrophobicContact CE2-CD1 3.74Å; F342-L355 HydrophobicContact CE2-CG 4.39Å; F342-L355 HydrophobicContact CZ-CB 3.62Å; F342-L355 HydrophobicContact CZ-CD1 3.95Å; F342-L355 HydrophobicContact CZ-CG 4.44Å; F342-L355 PolarHBondContact N-O 3.37Å; F342-L355 PolarHBondContact O-N 3.29Å; I344-L355 HydrophobicContact CD1-CD1 3.96Å; I353-L355 HydrophobicContact CD1-CD1 4.13Å; I353-L355 HydrophobicContact CD1-CG 4.47Å; I353-L355 HydrophobicContact CG1-CD1 4.48Å
356	Q	98.3	Very high	90.2	Very high	24 Å²	24	50.1 Å²	50.1	11%	0.112	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.4	177	-176.9	-174.4	18.7	0	0	110.6	L284 N285 W297 R338 R339 Y340	L284-Q356 WeakPolarHBondContact CA-O 3.43Å; L284-Q356 WeakPolarHBondContact CD2-O 3.37Å; N285-Q356 HydrophobicContact CB-CB 4.09Å; N285-Q356 PolarHBondContact N-O 3.04Å; N285-Q356 PolarHBondContact ND2-OE1 3.07Å; N285-Q356 PolarHBondContact O-N 3.03Å; W297-Q356 HydrophobicContact CE3-CB 4.26Å; W297-Q356 HydrophobicContact CH2-CB 4.42Å; W297-Q356 HydrophobicContact CZ3-CB 3.69Å; R338-Q356 VanDerWaalsContact NH1-OE1 3.08Å; R339-Q356 WeakPolarHBondContact O-CG 3.39Å; R339-Q356 PolarHBondContact O-NE2 3.02Å; Y340-Q356 WeakPolarHBondContact O-CA 3.45Å
357	A	97.7	Very high	90.7	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.033	28%	0.276	C	S	.	.			trans	-95.1	164.5	171.3	0	0	0	0	0	111.9	L284 Y340 F342 E362	L284-A357 HydrophobicContact CD2-CB 3.86Å; Y340-A357 WeakPolarHBondContact CB-O 3.48Å; Y340-A357 PolarHBondContact O-N 2.94Å; F342-A357 HydrophobicContact CE1-CB 4.47Å; A357-E362 HydrophobicContact CB-CB 4.08Å
358	E	95.6	Very high	91.3	Very high	102 Å²	102	46.8 Å²	46.8	48%	0.477	26%	0.257	S	S	.	.	S	Bend	trans	-93.5	-16.8	-176.1	65.4	-175.5	-161.7	0	0	114.8	R299	R299-E358 IonicContact NH2-OE2 3.6Å
359	S	94.6	Very high	92	Very high	14 Å²	14	42.9 Å²	42.9	10%	0.098	23%	0.23	C	C	.	.	S	Bend	trans	-141.9	161.6	179.1	71.5	0	0	0	0	112.3	D265 K361 E362 Y363	D265-S359 WeakPolarHBondContact OD1-CA 3.44Å; S359-K361 VanDerWaalsContact C-N 3.27Å; S359-K361 PolarHBondContact O-N 3.49Å; S359-E362 PolarHBondContact O-N 2.91Å; S359-E362 WeakPolarHBondContact OG-CB 3.31Å; S359-E362 WeakPolarHBondContact OG-CG 3.49Å; S359-E362 PolarHBondContact OG-N 3.43Å; S359-Y363 WeakPolarHBondContact O-CB 3.04Å; S359-Y363 PolarHBondContact O-N 2.92Å
360	R	93.8	Very high	93.1	Very high	108 Å²	108	39.9 Å²	39.9	41%	0.408	20%	0.199	S	C	.	.	H	α-helix	trans	-59.7	-37.8	175	-177.7	174.4	-178.9	169.8	5.8	112.7	D265 Y340 Y363 E364	D265-R360 PolarHBondContact OD1-N 3.28Å; Y340-R360 HydrophobicContact CE1-CB 3.85Å; Y340-R360 HydrophobicContact CE1-CG 4.48Å; R360-Y363 WeakPolarHBondContact O-CB 3.27Å; R360-E364 IonicContact CZ-OE1 3.18Å; R360-E364 IonicContact NE-OE1 3.17Å; R360-E364 PolarHBondContact NE-OE1 3.09Å; R360-E364 VanDerWaalsContact NE-OE1 3.12Å; R360-E364 IonicContact NH2-OE1 3.04Å; R360-E364 PolarHBondContact O-N 2.79Å
361	K	93.7	Very high	93.7	Very high	72 Å²	72	34.7 Å²	34.7	31%	0.313	18%	0.178	S	C	.	.	H	α-helix	trans	-63.1	-55.5	177.6	175.7	-178.1	171	176.6	0	110.8	P271 Q272 I273 S359 Y363 E364 E365	P271-K361 HydrophobicContact CB-CB 4.29Å; Q272-K361 VanDerWaalsContact O-CD 3.29Å; Q272-K361 WeakPolarHBondContact O-CD 3.42Å; Q272-K361 WeakPolarHBondContact O-CE 3.34Å; I273-K361 HydrophobicContact CG1-CB 4.5Å; I273-K361 HydrophobicContact CG1-CG 4.37Å; S359-K361 VanDerWaalsContact C-N 3.27Å; S359-K361 PolarHBondContact O-N 3.49Å; K361-Y363 VanDerWaalsContact C-N 3.25Å; K361-Y363 PolarHBondContact O-N 2.77Å; K361-E364 PolarHBondContact O-N 2.79Å; K361-E365 VanDerWaalsContact CE-OE1 3.24Å; K361-E365 WeakPolarHBondContact CE-OE1 3.29Å; K361-E365 HydrophobicContact CG-CG 4.38Å; K361-E365 WeakPolarHBondContact O-CB 3.47Å; K361-E365 WeakPolarHBondContact O-CG 3.49Å; K361-E365 PolarHBondContact O-N 2.85Å
362	E	95.5	Very high	94.5	Very high	47 Å²	47	31.6 Å²	31.6	22%	0.22	16%	0.156	C	C	.	.	H	α-helix	trans	-56.6	-44.6	179.6	-77.5	-59.4	118	0	0	111.2	K280 A357 S359 E365 W366	K280-E362 WeakPolarHBondContact CE-OE2 3.42Å; K280-E362 IonicContact NZ-OE1 2.98Å; K280-E362 PolarHBondContact NZ-OE1 2.88Å; K280-E362 IonicContact NZ-OE2 3.93Å; K280-E362 PolarHBondContact NZ-OE2 2.94Å; A357-E362 HydrophobicContact CB-CB 4.08Å; S359-E362 PolarHBondContact O-N 2.91Å; S359-E362 WeakPolarHBondContact OG-CB 3.31Å; S359-E362 WeakPolarHBondContact OG-CG 3.49Å; S359-E362 PolarHBondContact OG-N 3.43Å; E362-E365 PolarHBondContact O-N 2.88Å; E362-W366 WeakPolarHBondContact O-CB 3.47Å; E362-W366 PolarHBondContact O-N 3.46Å; E362-W366 PolarHBondContact OE2-NE1 3.14Å
363	Y	95.9	Very high	94.7	Very high	35 Å²	35	30.7 Å²	30.7	14%	0.137	15%	0.145	C	C	.	.	H	α-helix	trans	-55.6	-54.3	176.7	174.1	-107.6	0	0	0	113.9	A332 Y340 C341 F342 S359 R360 K361 I367	A332-Y363 WeakPolarHBondContact CA-OH 3.45Å; A332-Y363 WeakPolarHBondContact CB-OH 3.47Å; Y340-Y363 VanDerWaalsContact C-CD2 3.46Å; Y340-Y363 HydrophobicContact CD1-CD1 4.27Å; Y340-Y363 HydrophobicContact CD1-CG 4.14Å; Y340-Y363 HydrophobicContact CG-CG 4.39Å; Y340-Y363 VanDerWaalsContact O-CD2 3.29Å; Y340-Y363 WeakPolarHBondContact O-CD2 3.42Å; C341-Y363 WeakPolarHBondContact O-CE2 3.29Å; F342-Y363 HydrophobicContact CB-CE2 3.9Å; F342-Y363 AromaticContact CD1-CD2 3.9Å; F342-Y363 HydrophobicContact CD1-CD2 3.9Å; F342-Y363 HydrophobicContact CD1-CE2 4.07Å; F342-Y363 HydrophobicContact CG-CE2 4.45Å; S359-Y363 WeakPolarHBondContact O-CB 3.04Å; S359-Y363 PolarHBondContact O-N 2.92Å; R360-Y363 WeakPolarHBondContact O-CB 3.27Å; K361-Y363 VanDerWaalsContact C-N 3.25Å; K361-Y363 PolarHBondContact O-N 2.77Å; Y363-I367 HydrophobicContact CD1-CD1 4.43Å; Y363-I367 HydrophobicContact CD2-CD1 4.22Å; Y363-I367 HydrophobicContact CE1-CD1 3.92Å; Y363-I367 HydrophobicContact CE2-CD1 3.68Å; Y363-I367 WeakPolarHBondContact O-CG1 3.47Å; Y363-I367 PolarHBondContact O-N 3.48Å
364	E	94.9	Very high	94.3	Very high	34 Å²	34	29.4 Å²	29.4	16%	0.159	14%	0.14	C	C	.	.	H	α-helix	trans	-67.4	-37.2	179.8	-73.6	-168.9	-148.8	0	0	111.5	I273 R275 R360 K361 I367 C368	I273-E364 HydrophobicContact CD1-CB 3.86Å; I273-E364 HydrophobicContact CD1-CG 4.01Å; I273-E364 WeakPolarHBondContact CD1-OE2 3.29Å; I273-E364 HydrophobicContact CG2-CB 3.83Å; R275-E364 IonicContact CZ-OE2 3.7Å; R275-E364 IonicContact NH2-OE2 3.61Å; R275-E364 PolarHBondContact NH2-OE2 3.44Å; R360-E364 IonicContact CZ-OE1 3.18Å; R360-E364 IonicContact NE-OE1 3.17Å; R360-E364 PolarHBondContact NE-OE1 3.09Å; R360-E364 VanDerWaalsContact NE-OE1 3.12Å; R360-E364 IonicContact NH2-OE1 3.04Å; R360-E364 PolarHBondContact O-N 2.79Å; K361-E364 PolarHBondContact O-N 2.79Å; E364-I367 PolarHBondContact O-N 3.37Å; E364-C368 WeakPolarHBondContact O-CB 3.43Å; E364-C368 PolarHBondContact O-N 3.28Å; E364-C368 PolarHBondContact O-SG 2.9Å
365	E	95.8	Very high	93.5	Very high	15 Å²	15	35.7 Å²	35.7	7%	0.07	16%	0.162	C	C	.	.	H	α-helix	trans	-66.5	-40.5	177.7	-74	-170.7	172.5	0	0	112.9	I273 N274 L277 K280 K361 E362 C368 A369	I273-E365 HydrophobicContact CG2-CG 3.91Å; N274-E365 PolarHBondContact N-OE1 3.07Å; L277-E365 HydrophobicContact CD1-CB 3.95Å; L277-E365 HydrophobicContact CD1-CG 4.13Å; K280-E365 HydrophobicContact CD-CB 3.94Å; K280-E365 IonicContact NZ-OE2 2.74Å; K280-E365 PolarHBondContact NZ-OE2 3.01Å; K361-E365 VanDerWaalsContact CE-OE1 3.24Å; K361-E365 WeakPolarHBondContact CE-OE1 3.29Å; K361-E365 HydrophobicContact CG-CG 4.38Å; K361-E365 WeakPolarHBondContact O-CB 3.47Å; K361-E365 WeakPolarHBondContact O-CG 3.49Å; K361-E365 PolarHBondContact O-N 2.85Å; E362-E365 PolarHBondContact O-N 2.88Å; E365-C368 PolarHBondContact O-N 3.02Å; E365-A369 VanDerWaalsContact O-CB 3.26Å; E365-A369 WeakPolarHBondContact O-CB 3.45Å; E365-A369 PolarHBondContact O-N 3.42Å
366	W	97.1	Very high	92	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-46.8	174.6	-85.7	111.9	0	0	0	111.8	K280 L284 F302 T304 L309 F342 E362 C368 A369 I370	K280-W366 HydrophobicContact CB-CD2 4.45Å; K280-W366 HydrophobicContact CB-CE3 4.11Å; K280-W366 HydrophobicContact CB-CH2 4.2Å; K280-W366 HydrophobicContact CB-CZ3 3.98Å; K280-W366 HydrophobicContact CD-CB 4.4Å; K280-W366 HydrophobicContact CD-CD2 3.64Å; K280-W366 HydrophobicContact CD-CE3 4.09Å; K280-W366 HydrophobicContact CD-CG 3.78Å; K280-W366 HydrophobicContact CD-CZ2 4.45Å; K280-W366 VanDerWaalsContact CE-NE1 3.33Å; K280-W366 HydrophobicContact CG-CD2 4.01Å; K280-W366 HydrophobicContact CG-CE3 4.18Å; K280-W366 HydrophobicContact CG-CH2 4.17Å; K280-W366 HydrophobicContact CG-CZ2 3.99Å; K280-W366 HydrophobicContact CG-CZ3 4.25Å; L284-W366 HydrophobicContact CD1-CD2 4Å; L284-W366 HydrophobicContact CD1-CE3 4.37Å; L284-W366 HydrophobicContact CD1-CG 4.42Å; L284-W366 HydrophobicContact CD1-CH2 4.44Å; L284-W366 HydrophobicContact CD1-CZ2 4.08Å; L284-W366 HydrophobicContact CD2-CG 4.37Å; L284-W366 HydrophobicContact CG-CZ2 4.32Å; F302-W366 HydrophobicContact CB-CH2 3.92Å; F302-W366 HydrophobicContact CB-CZ2 4.37Å; T304-W366 HydrophobicContact CG2-CZ3 4.3Å; L309-W366 HydrophobicContact CD1-CZ3 4.22Å; F342-W366 HydrophobicContact CE1-CB 4.07Å; F342-W366 HydrophobicContact CE1-CG 4.5Å; F342-W366 HydrophobicContact CE2-CB 4.4Å; F342-W366 HydrophobicContact CZ-CB 3.75Å; F342-W366 HydrophobicContact CZ-CG 4.14Å; E362-W366 WeakPolarHBondContact O-CB 3.47Å; E362-W366 PolarHBondContact O-N 3.46Å; E362-W366 PolarHBondContact OE2-NE1 3.14Å; W366-C368 PolarHBondContact O-N 3.26Å; W366-A369 PolarHBondContact O-N 3.04Å; W366-I370 HydrophobicContact CE3-CD1 4.45Å; W366-I370 WeakPolarHBondContact O-CD1 3.43Å; W366-I370 WeakPolarHBondContact O-CG1 3.29Å; W366-I370 PolarHBondContact O-N 3.38Å
367	I	95.8	Very high	90.1	Very high	25 Å²	25	39.1 Å²	39.1	13%	0.128	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-44.1	176.8	-66.5	174	0	0	0	110.9	V330 F342 Y363 E364 N371	V330-I367 HydrophobicContact CG1-CG2 4.06Å; V330-I367 WeakPolarHBondContact CG1-O 3.39Å; V330-I367 HydrophobicContact CG2-CG1 4.12Å; V330-I367 HydrophobicContact CG2-CG2 4.48Å; F342-I367 HydrophobicContact CB-CD1 3.9Å; F342-I367 HydrophobicContact CB-CG1 3.91Å; F342-I367 HydrophobicContact CD2-CG1 4.39Å; F342-I367 HydrophobicContact CG-CD1 4.5Å; F342-I367 HydrophobicContact CG-CG1 4.07Å; Y363-I367 HydrophobicContact CD1-CD1 4.43Å; Y363-I367 HydrophobicContact CD2-CD1 4.22Å; Y363-I367 HydrophobicContact CE1-CD1 3.92Å; Y363-I367 HydrophobicContact CE2-CD1 3.68Å; Y363-I367 WeakPolarHBondContact O-CG1 3.47Å; Y363-I367 PolarHBondContact O-N 3.48Å; E364-I367 PolarHBondContact O-N 3.37Å; I367-N371 WeakPolarHBondContact O-CB 3.42Å; I367-N371 PolarHBondContact O-N 2.91Å; I367-N371 VanDerWaalsContact O-N 3.07Å; I367-N371 PolarHBondContact O-ND2 2.92Å
368	C	94.6	Very high	87.9	Confident	25 Å²	25	46.6 Å²	46.6	17%	0.169	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-44.7	178.9	-67.7	0	0	0	0	111.5	R275 E364 E365 W366 I370 N371 N372	R275-C368 HydrophobicContact CB-CB 4.37Å; E364-C368 WeakPolarHBondContact O-CB 3.43Å; E364-C368 PolarHBondContact O-N 3.28Å; E364-C368 PolarHBondContact O-SG 2.9Å; E365-C368 PolarHBondContact O-N 3.02Å; W366-C368 PolarHBondContact O-N 3.26Å; C368-I370 PolarHBondContact O-N 3.11Å; C368-N371 PolarHBondContact O-N 2.85Å; C368-N372 WeakPolarHBondContact O-CB 3.48Å; C368-N372 PolarHBondContact O-N 2.85Å; C368-N372 PolarHBondContact O-ND2 2.92Å; C368-N372 PolarHBondContact O-OD1 3.01Å
369	A	93.9	Very high	85.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-47.8	179.5	0	0	0	0	0	112.1	L277 K280 E365 W366 N371 N372 I373	L277-A369 HydrophobicContact CB-CB 3.97Å; L277-A369 WeakPolarHBondContact O-CA 3.49Å; K280-A369 HydrophobicContact CB-CB 4.03Å; E365-A369 VanDerWaalsContact O-CB 3.26Å; E365-A369 WeakPolarHBondContact O-CB 3.45Å; E365-A369 PolarHBondContact O-N 3.42Å; W366-A369 PolarHBondContact O-N 3.04Å; A369-N371 PolarHBondContact O-N 3.02Å; A369-N372 PolarHBondContact O-N 3.43Å; A369-I373 WeakPolarHBondContact O-CD1 3.28Å; A369-I373 VanDerWaalsContact O-CG1 3.26Å; A369-I373 WeakPolarHBondContact O-CG1 3.47Å; A369-I373 PolarHBondContact O-N 2.96Å
370	I	94.1	Very high	84	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-42.8	178.8	-66.7	159.6	0	0	0	111	L325 V330 F342 I344 W366 C368 N372 I373 S374	L325-I370 HydrophobicContact CD1-CG1 4.2Å; L325-I370 HydrophobicContact CD1-CG2 4.34Å; L325-I370 HydrophobicContact CD2-CG2 3.94Å; V330-I370 HydrophobicContact CB-CB 4.26Å; V330-I370 HydrophobicContact CB-CG2 3.77Å; V330-I370 HydrophobicContact CG1-CB 3.84Å; V330-I370 HydrophobicContact CG1-CG2 3.67Å; V330-I370 HydrophobicContact CG2-CD1 4.23Å; V330-I370 HydrophobicContact CG2-CG2 4.44Å; F342-I370 HydrophobicContact CE2-CD1 3.84Å; I344-I370 HydrophobicContact CD1-CD1 3.62Å; I344-I370 HydrophobicContact CG1-CD1 4.11Å; W366-I370 HydrophobicContact CE3-CD1 4.45Å; W366-I370 WeakPolarHBondContact O-CD1 3.43Å; W366-I370 WeakPolarHBondContact O-CG1 3.29Å; W366-I370 PolarHBondContact O-N 3.38Å; C368-I370 PolarHBondContact O-N 3.11Å; I370-N372 VanDerWaalsContact C-N 3.34Å; I370-N372 PolarHBondContact O-N 2.91Å; I370-I373 PolarHBondContact O-N 3.33Å; I370-S374 WeakPolarHBondContact O-CB 3.49Å; I370-S374 PolarHBondContact O-N 2.74Å
371	N	91.3	Very high	81.8	Confident	38 Å²	38	53.1 Å²	53.1	20%	0.203	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-41	175.8	-84.7	-48.4	0	0	0	112.5	V330 I367 C368 A369 R375	V330-N371 HydrophobicContact CG1-CB 4.28Å; V330-N371 VanDerWaalsContact CG1-ND2 3.3Å; V330-N371 WeakPolarHBondContact CG1-ND2 3.46Å; V330-N371 WeakPolarHBondContact CG1-OD1 3.47Å; I367-N371 WeakPolarHBondContact O-CB 3.42Å; I367-N371 PolarHBondContact O-N 2.91Å; I367-N371 VanDerWaalsContact O-N 3.07Å; I367-N371 PolarHBondContact O-ND2 2.92Å; C368-N371 PolarHBondContact O-N 2.85Å; A369-N371 PolarHBondContact O-N 3.02Å; N371-R375 WeakPolarHBondContact O-CB 3.43Å; N371-R375 VanDerWaalsContact O-CG 3.26Å; N371-R375 WeakPolarHBondContact O-CG 3.45Å; N371-R375 PolarHBondContact O-N 2.84Å
372	N	89.8	Confident	79.9	Confident	40 Å²	40	53.6 Å²	53.6	21%	0.214	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-45.9	178.4	-68.5	-21.5	0	0	0	110.9	R275 L277 C368 A369 I370 R375 Q376	R275-N372 PolarHBondContact O-ND2 3.41Å; L277-N372 WeakPolarHBondContact O-CB 3.47Å; L277-N372 PolarHBondContact O-ND2 2.91Å; C368-N372 WeakPolarHBondContact O-CB 3.48Å; C368-N372 PolarHBondContact O-N 2.85Å; C368-N372 PolarHBondContact O-ND2 2.92Å; C368-N372 PolarHBondContact O-OD1 3.01Å; A369-N372 PolarHBondContact O-N 3.43Å; I370-N372 VanDerWaalsContact C-N 3.34Å; I370-N372 PolarHBondContact O-N 2.91Å; N372-R375 PolarHBondContact O-N 3.05Å; N372-Q376 WeakPolarHBondContact O-CB 3.25Å; N372-Q376 PolarHBondContact O-N 2.92Å
373	I	88.4	Confident	78	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-49.5	177.4	-67.8	164.1	0	0	0	110.6	I278 T304 L325 A369 I370 R375 Q376 I377	I278-I373 WeakPolarHBondContact O-CG1 3.21Å; T304-I373 HydrophobicContact CG2-CD1 3.6Å; L325-I373 HydrophobicContact CB-CG2 4.11Å; L325-I373 HydrophobicContact CD1-CD1 4.23Å; L325-I373 HydrophobicContact CD1-CG2 4.2Å; A369-I373 WeakPolarHBondContact O-CD1 3.28Å; A369-I373 VanDerWaalsContact O-CG1 3.26Å; A369-I373 WeakPolarHBondContact O-CG1 3.47Å; A369-I373 PolarHBondContact O-N 2.96Å; I370-I373 PolarHBondContact O-N 3.33Å; I373-R375 VanDerWaalsContact C-N 3.35Å; I373-R375 PolarHBondContact O-N 3.01Å; I373-Q376 PolarHBondContact O-N 2.56Å; I373-I377 HydrophobicContact CG2-CD1 4.22Å; I373-I377 WeakPolarHBondContact O-CG1 3.45Å; I373-I377 PolarHBondContact O-N 3.24Å
374	S	86.2	Confident	75.9	Confident	11 Å²	11	60.1 Å²	60.1	8%	0.077	30%	0.297	C	S	.	.	H	α-helix	trans	-58.5	-44.1	179.3	178.3	0	0	0	0	112.5	L325 C328 I370	L325-S374 WeakPolarHBondContact O-CA 3.49Å; L325-S374 WeakPolarHBondContact O-CB 3.09Å; L325-S374 PolarHBondContact O-OG 2.81Å; C328-S374 PolarHBondContact N-OG 3.16Å; C328-S374 WeakPolarHBondContact O-CB 3.41Å; C328-S374 PolarHBondContact O-OG 3.48Å; I370-S374 WeakPolarHBondContact O-CB 3.49Å; I370-S374 PolarHBondContact O-N 2.74Å
375	R	77.9	Confident	74	Confident	151 Å²	151	60.8 Å²	60.8	57%	0.57	31%	0.309	S	S	*	.	H	α-helix	trans	-73.4	-36.2	-179.2	-73	175.8	-175.2	-179.7	2.4	113.6	N371 N372 I373 I377 Y378 L379	N371-R375 WeakPolarHBondContact O-CB 3.43Å; N371-R375 VanDerWaalsContact O-CG 3.26Å; N371-R375 WeakPolarHBondContact O-CG 3.45Å; N371-R375 PolarHBondContact O-N 2.84Å; N372-R375 PolarHBondContact O-N 3.05Å; I373-R375 VanDerWaalsContact C-N 3.35Å; I373-R375 PolarHBondContact O-N 3.01Å; R375-I377 VanDerWaalsContact C-N 3.28Å; R375-I377 PolarHBondContact O-N 3.18Å; R375-Y378 PolarHBondContact O-N 3.41Å; R375-L379 HydrophobicContact CB-CD1 4.16Å; R375-L379 WeakPolarHBondContact O-CB 3.19Å; R375-L379 PolarHBondContact O-N 3.37Å
376	Q	67.2	Low	72.3	Confident	72 Å²	72	61.2 Å²	61.2	34%	0.336	31%	0.312	S	S	.	.	H	α-helix	trans	-69.1	-29.9	-174.8	-168.2	174.7	2.9	0	0	112	N372 I373 T380 V386	N372-Q376 WeakPolarHBondContact O-CB 3.25Å; N372-Q376 PolarHBondContact O-N 2.92Å; I373-Q376 PolarHBondContact O-N 2.56Å; Q376-T380 PolarHBondContact O-OG1 3.15Å; Q376-V386 HydrophobicContact CG-CG1 4.04Å
377	I	58.3	Low	70.3	Confident	23 Å²	23	63.1 Å²	63.1	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-72.1	-41.3	171.9	-60.3	167.5	0	0	0	110.5	D326 I373 R375 L390	D326-I377 HydrophobicContact CB-CD1 4.3Å; D326-I377 HydrophobicContact CB-CG2 4.37Å; D326-I377 WeakPolarHBondContact OD1-CG2 3.25Å; I373-I377 HydrophobicContact CG2-CD1 4.22Å; I373-I377 WeakPolarHBondContact O-CG1 3.45Å; I373-I377 PolarHBondContact O-N 3.24Å; R375-I377 VanDerWaalsContact C-N 3.28Å; R375-I377 PolarHBondContact O-N 3.18Å; I377-L390 HydrophobicContact CG1-CD1 4.43Å
378	Y	50.9	Low	68.4	Low	162 Å²	162	66.9 Å²	66.9	64%	0.635	35%	0.348	S	S	*	.	H	α-helix	trans	-78.4	-33	-174	-172.4	-109.7	0	0	0	115.7	N327 R375	N327-Y378 WeakPolarHBondContact OD1-CB 3.41Å; N327-Y378 WeakPolarHBondContact OD1-CD2 3.35Å; N327-Y378 VanDerWaalsContact OD1-CG 3.29Å; R375-Y378 PolarHBondContact O-N 3.41Å
379	L	53.1	Low	66.7	Low	128 Å²	128	72.7 Å²	72.7	67%	0.67	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	11.9	-169.2	-66.7	170.6	0	0	0	114.6	R375	R375-L379 HydrophobicContact CB-CD1 4.16Å; R375-L379 WeakPolarHBondContact O-CB 3.19Å; R375-L379 PolarHBondContact O-N 3.37Å
380	T	55.7	Low	64.9	Low	55 Å²	55	73.7 Å²	73.7	34%	0.337	38%	0.375	S	S	.	.			trans	-105.3	134.7	-178.8	-52.8	0	0	0	0	111.6	Q376 N382 V386	Q376-T380 PolarHBondContact O-OG1 3.15Å; T380-N382 PolarHBondContact O-N 3.29Å; T380-V386 HydrophobicContact CG2-CG2 3.55Å
381	D	48.3	Very low	63.1	Low	177 Å²	177	77.5 Å²	77.5	95%	0.947	40%	0.396	S	S	*	.	S	Bend	trans	-61.8	-8.9	179	-62.8	-36.4	0	0	0	114.3
382	N	53.9	Low	61.3	Low	83 Å²	83	81.4 Å²	81.4	44%	0.444	41%	0.413	S	S	.	.			trans	-142.8	86	173.4	-173	-13.8	0	0	0	110.6	T380 E384 A385	T380-N382 PolarHBondContact O-N 3.29Å; N382-E384 VanDerWaalsContact C-N 3.32Å; N382-E384 PolarHBondContact O-N 3.34Å; N382-E384 PolarHBondContact OD1-N 3.41Å; N382-A385 HydrophobicContact CB-CB 4.34Å; N382-A385 PolarHBondContact O-N 3.18Å; N382-A385 PolarHBondContact OD1-N 2.9Å
383	P	54.8	Low	59.7	Low	67 Å²	67	82.2 Å²	82.2	44%	0.435	42%	0.419	S	S	.	.	H	α-helix	trans	-65.7	-30	-176.7	24.7	-33.1	0	0	0	113.3	V386 A387	P383-V386 PolarHBondContact O-N 2.99Å; P383-A387 WeakPolarHBondContact O-CB 3.46Å; P383-A387 PolarHBondContact O-N 3.34Å
384	E	52.2	Low	57.8	Low	151 Å²	151	82.3 Å²	82.3	71%	0.706	42%	0.421	S	S	*	.	H	α-helix	trans	-64.8	-44.2	177.3	-79.2	-177.4	156.2	0	0	112.3	N382 V386 A387 I388	N382-E384 VanDerWaalsContact C-N 3.32Å; N382-E384 PolarHBondContact O-N 3.34Å; N382-E384 PolarHBondContact OD1-N 3.41Å; E384-V386 VanDerWaalsContact C-N 3.31Å; E384-V386 PolarHBondContact O-N 3.23Å; E384-A387 PolarHBondContact O-N 3.13Å; E384-I388 WeakPolarHBondContact O-CB 3.27Å; E384-I388 WeakPolarHBondContact O-CD1 3.12Å; E384-I388 WeakPolarHBondContact O-CG1 3.49Å; E384-I388 PolarHBondContact O-N 3.32Å
385	A	55.4	Low	55.8	Low	48 Å²	48	86.7 Å²	86.7	40%	0.397	44%	0.443	S	S	.	.	H	α-helix	trans	-65.7	-32.4	-180	0	0	0	0	0	113.1	N382 K389	N382-A385 HydrophobicContact CB-CB 4.34Å; N382-A385 PolarHBondContact O-N 3.18Å; N382-A385 PolarHBondContact OD1-N 2.9Å; A385-K389 PolarHBondContact O-N 2.95Å; A385-K389 VanDerWaalsContact O-N 3.17Å
386	V	58.7	Low	54.4	Low	24 Å²	24	86.8 Å²	86.8	15%	0.145	45%	0.45	C	S	.	.	H	α-helix	trans	-76.7	-41.5	177.7	175.7	0	0	0	0	111.5	Q376 T380 P383 E384 I388 K389 L390	Q376-V386 HydrophobicContact CG-CG1 4.04Å; T380-V386 HydrophobicContact CG2-CG2 3.55Å; P383-V386 PolarHBondContact O-N 2.99Å; E384-V386 VanDerWaalsContact C-N 3.31Å; E384-V386 PolarHBondContact O-N 3.23Å; V386-I388 VanDerWaalsContact C-N 3.31Å; V386-I388 PolarHBondContact O-N 2.84Å; V386-K389 PolarHBondContact O-N 3.01Å; V386-L390 HydrophobicContact CG1-CD1 3.98Å; V386-L390 WeakPolarHBondContact O-CB 3.36Å; V386-L390 PolarHBondContact O-N 2.99Å
387	A	55.2	Low	53.4	Low	42 Å²	42	86.5 Å²	86.5	35%	0.347	46%	0.459	S	S	.	.	H	α-helix	trans	-60.2	-41.7	173.3	0	0	0	0	0	111.5	P383 E384 K389 L390 N391	P383-A387 WeakPolarHBondContact O-CB 3.46Å; P383-A387 PolarHBondContact O-N 3.34Å; E384-A387 PolarHBondContact O-N 3.13Å; A387-K389 PolarHBondContact O-N 2.9Å; A387-L390 PolarHBondContact O-N 2.82Å; A387-N391 VanDerWaalsContact O-CB 3.26Å; A387-N391 WeakPolarHBondContact O-CB 3.25Å; A387-N391 PolarHBondContact O-N 3.43Å
388	I	56.1	Low	52.4	Low	104 Å²	104	88.9 Å²	88.9	53%	0.533	48%	0.475	S	S	.	.	H	α-helix	trans	-61.5	-43.3	174.5	-68.9	164.2	0	0	0	111.5	E384 V386 N391 Q392	E384-I388 WeakPolarHBondContact O-CB 3.27Å; E384-I388 WeakPolarHBondContact O-CD1 3.12Å; E384-I388 WeakPolarHBondContact O-CG1 3.49Å; E384-I388 PolarHBondContact O-N 3.32Å; V386-I388 VanDerWaalsContact C-N 3.31Å; V386-I388 PolarHBondContact O-N 2.84Å; I388-N391 PolarHBondContact O-N 3.44Å; I388-Q392 PolarHBondContact O-N 3Å
389	K	58.9	Low	51.5	Low	147 Å²	147	85.5 Å²	85.5	64%	0.639	47%	0.471	S	S	*	.	H	α-helix	trans	-68.7	-40.5	179.5	-170	177.1	-178.8	179.9	0	113	A385 V386 A387 N391 Q392 T393	A385-K389 PolarHBondContact O-N 2.95Å; A385-K389 VanDerWaalsContact O-N 3.17Å; V386-K389 PolarHBondContact O-N 3.01Å; A387-K389 PolarHBondContact O-N 2.9Å; K389-N391 VanDerWaalsContact C-N 3.35Å; K389-Q392 PolarHBondContact O-N 2.56Å; K389-T393 PolarHBondContact O-N 2.85Å; K389-T393 PolarHBondContact O-OG1 3.02Å
390	L	56.8	Low	50.3	Low	21 Å²	21	84.1 Å²	84.1	11%	0.11	47%	0.47	C	S	.	.	H	α-helix	trans	-63.1	-42.5	172.9	-81.4	163.9	0	0	0	110.8	I377 V386 A387 T393 A394	I377-L390 HydrophobicContact CG1-CD1 4.43Å; V386-L390 HydrophobicContact CG1-CD1 3.98Å; V386-L390 WeakPolarHBondContact O-CB 3.36Å; V386-L390 PolarHBondContact O-N 2.99Å; A387-L390 PolarHBondContact O-N 2.82Å; L390-T393 PolarHBondContact O-N 3.33Å; L390-A394 VanDerWaalsContact O-CB 3.27Å; L390-A394 WeakPolarHBondContact O-CB 3.31Å; L390-A394 PolarHBondContact O-N 2.96Å
391	N	55.5	Low	49.1	Very low	80 Å²	80	89.1 Å²	89.1	43%	0.428	49%	0.493	S	S	.	.	H	α-helix	trans	-66.2	-40.8	176.7	-162.4	12.6	0	0	0	112.1	A387 I388 K389 T393 A394 L395	A387-N391 VanDerWaalsContact O-CB 3.26Å; A387-N391 WeakPolarHBondContact O-CB 3.25Å; A387-N391 PolarHBondContact O-N 3.43Å; I388-N391 PolarHBondContact O-N 3.44Å; K389-N391 VanDerWaalsContact C-N 3.35Å; N391-T393 PolarHBondContact O-N 2.67Å; N391-A394 PolarHBondContact O-N 3.01Å; N391-L395 WeakPolarHBondContact O-CG 3.15Å; N391-L395 PolarHBondContact O-N 2.9Å
392	Q	55	Low	48.3	Very low	119 Å²	119	85.7 Å²	85.7	56%	0.556	48%	0.479	S	S	*	.	H	α-helix	trans	-60.5	-43.7	173.6	-97.3	-177.1	-17.3	0	0	113.1	I388 K389 A394 L395 Q396	I388-Q392 PolarHBondContact O-N 3Å; K389-Q392 PolarHBondContact O-N 2.56Å; Q392-A394 VanDerWaalsContact C-N 3.3Å; Q392-L395 PolarHBondContact O-N 3.23Å; Q392-Q396 WeakPolarHBondContact O-CG 3.02Å; Q392-Q396 PolarHBondContact O-N 2.9Å
393	T	55.9	Low	47.2	Very low	57 Å²	57	86.6 Å²	86.6	35%	0.35	49%	0.491	S	S	.	.	H	α-helix	trans	-67.7	-36.1	178.4	-53.5	0	0	0	0	110.6	K389 L390 N391 Q396 A397	K389-T393 PolarHBondContact O-N 2.85Å; K389-T393 PolarHBondContact O-OG1 3.02Å; L390-T393 PolarHBondContact O-N 3.33Å; N391-T393 PolarHBondContact O-N 2.67Å; T393-Q396 PolarHBondContact O-N 2.93Å; T393-A397 PolarHBondContact O-N 2.98Å; T393-A397 VanDerWaalsContact O-N 3.1Å
394	A	47.4	Very low	46.1	Very low	7 Å²	7	92.7 Å²	92.7	6%	0.058	51%	0.512	C	S	.	.	H	α-helix	trans	-73.5	-33.9	178.6	0	0	0	0	0	112.8	Q305 L390 N391 Q392 Q396 A397 V398	Q305-A394 HydrophobicContact CB-CB 4.29Å; Q305-A394 HydrophobicContact CG-CB 3.43Å; Q305-A394 VanDerWaalsContact CG-CB 3.43Å; L390-A394 VanDerWaalsContact O-CB 3.27Å; L390-A394 WeakPolarHBondContact O-CB 3.31Å; L390-A394 PolarHBondContact O-N 2.96Å; N391-A394 PolarHBondContact O-N 3.01Å; Q392-A394 VanDerWaalsContact C-N 3.3Å; A394-Q396 VanDerWaalsContact C-N 3.33Å; A394-Q396 PolarHBondContact O-N 3.29Å; A394-A397 PolarHBondContact O-N 3.39Å; A394-V398 WeakPolarHBondContact O-CB 3.37Å; A394-V398 VanDerWaalsContact O-CG2 3.25Å; A394-V398 WeakPolarHBondContact O-CG2 3.38Å; A394-V398 PolarHBondContact O-N 2.83Å
395	L	45.6	Very low	45	Very low	102 Å²	102	88.8 Å²	88.8	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-40.5	170.4	-76.6	165.6	0	0	0	111.8	N391 Q392 T399	N391-L395 WeakPolarHBondContact O-CG 3.15Å; N391-L395 PolarHBondContact O-N 2.9Å; Q392-L395 PolarHBondContact O-N 3.23Å; L395-T399 PolarHBondContact O-N 2.9Å; L395-T399 PolarHBondContact O-OG1 3.11Å
396	Q	48.4	Very low	43.8	Very low	153 Å²	153	96.2 Å²	96.2	72%	0.715	54%	0.535	S	S	*	.	H	α-helix	trans	-70.6	-27.7	176.1	-69.2	176.3	-6.6	0	0	113.8	Q392 T393 A394	Q392-Q396 WeakPolarHBondContact O-CG 3.02Å; Q392-Q396 PolarHBondContact O-N 2.9Å; T393-Q396 PolarHBondContact O-N 2.93Å; A394-Q396 VanDerWaalsContact C-N 3.33Å; A394-Q396 PolarHBondContact O-N 3.29Å
397	A	45.3	Very low	42.3	Very low	66 Å²	66	104.9 Å²	104.9	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-87	-23.6	-179.6	0	0	0	0	0	113.8	T393 A394	T393-A397 PolarHBondContact O-N 2.98Å; T393-A397 VanDerWaalsContact O-N 3.1Å; A394-A397 PolarHBondContact O-N 3.39Å
398	V	36.9	Very low	41	Very low	73 Å²	73	111.6 Å²	111.6	44%	0.442	60%	0.595	S	S	.	*	H	α-helix	trans	-101.1	-7.3	-177.8	-176	0	0	0	0	112.1	F303 Q305 A394 P400	F303-V398 HydrophobicContact CE2-CG2 4.48Å; Q305-V398 HydrophobicContact CG-CG2 4.36Å; A394-V398 WeakPolarHBondContact O-CB 3.37Å; A394-V398 VanDerWaalsContact O-CG2 3.25Å; A394-V398 WeakPolarHBondContact O-CG2 3.38Å; A394-V398 PolarHBondContact O-N 2.83Å; V398-P400 VanDerWaalsContact O-CD 3.28Å; V398-P400 WeakPolarHBondContact O-CD 3.28Å
399	T	31.8	Very low	39.6	Very low	91 Å²	91	114.7 Å²	114.7	56%	0.558	61%	0.607	S	S	*	*	S	Bend	trans	-75.6	117.8	164.1	2.6	0	0	0	0	108.4	L395 I401	L395-T399 PolarHBondContact O-N 2.9Å; L395-T399 PolarHBondContact O-OG1 3.11Å; T399-I401 PolarHBondContact O-N 3.26Å; T399-I401 VanDerWaalsContact O-N 3.17Å
400	P	28.5	Very low	37.9	Very low	99 Å²	99	113.2 Å²	113.2	64%	0.643	62%	0.615	S	S	*	*			trans	-56.1	128	161.9	23.5	-29.3	0	0	0	106.6	V398 T402	V398-P400 VanDerWaalsContact O-CD 3.28Å; V398-P400 WeakPolarHBondContact O-CD 3.28Å; P400-T402 PolarHBondContact O-N 2.62Å
401	I	30.9	Very low	36.3	Very low	161 Å²	161	121.7 Å²	121.7	83%	0.826	65%	0.651	S	S	*	*			trans	-63.6	88.2	162.7	-59.1	171.2	0	0	0	104.5	T399 S403	T399-I401 PolarHBondContact O-N 3.26Å; T399-I401 VanDerWaalsContact O-N 3.17Å; I401-S403 PolarHBondContact O-N 2.99Å
402	T	30.1	Very low	34.7	Very low	105 Å²	105	123.5 Å²	123.5	64%	0.644	67%	0.669	S	S	*	*			trans	-65.7	97.3	159	53.3	0	0	0	0	104.1	P400 F404	P400-T402 PolarHBondContact O-N 2.62Å; T402-F404 PolarHBondContact O-N 3.26Å
403	S	31.6	Very low	33.1	Very low	101 Å²	101	122.5 Å²	122.5	71%	0.706	68%	0.675	S	S	*	*			trans	-68.1	63.8	165.6	52	0	0	0	0	109.1	I401	I401-S403 PolarHBondContact O-N 2.99Å
404	F	31.1	Very low	31.5	Very low	196 Å²	196	125.5 Å²	125.5	86%	0.86	70%	0.698	S	S	*	*			trans	-123.8	48.5	158.2	-74.8	-75.8	0	0	0	107.3	T402 K406	T402-F404 PolarHBondContact O-N 3.26Å; F404-K406 PolarHBondContact O-N 2.9Å
405	G	29.2	Very low	30.5	Very low	68 Å²	68	133.4 Å²	133.4	70%	0.701	73%	0.734	S	S	*	*			trans	-79.8	109.4	161.2	0	0	0	0	0	107.9	K407	G405-K407 PolarHBondContact O-N 2.82Å
406	K	31.1	Very low	29.4	Very low	204 Å²	204	135.2 Å²	135.2	89%	0.887	74%	0.744	S	S	*	*			trans	-41.3	124.5	162.4	-80.9	175	172.3	175.1	0	108.5	F404 Q408	F404-K406 PolarHBondContact O-N 2.9Å; K406-Q408 VanDerWaalsContact C-N 3.35Å; K406-Q408 PolarHBondContact O-N 2.83Å
407	K	27.5	Very low	28.2	Very low	207 Å²	207	134.4 Å²	134.4	90%	0.9	74%	0.742	S	S	*	*			trans	-50.1	101.1	168.2	-94	176.8	175.1	169.8	0	108.2	G405 E409	G405-K407 PolarHBondContact O-N 2.82Å; K407-E409 PolarHBondContact O-N 2.95Å
408	Q	26.7	Very low	27.2	Very low	182 Å²	182	140.5 Å²	140.5	85%	0.85	75%	0.751	S	S	*	*			trans	-79.2	107.6	164.7	-160.7	164	13.7	0	0	105.3	K406 S410	K406-Q408 VanDerWaalsContact C-N 3.35Å; K406-Q408 PolarHBondContact O-N 2.83Å; Q408-S410 PolarHBondContact O-N 2.95Å
409	E	27.2	Very low	26.5	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.794	77%	0.767	S	S	*	*			trans	-58.2	102.6	175	-72.7	-176.5	149.1	0	0	109.7	K407	K407-E409 PolarHBondContact O-N 2.95Å
410	S	23.7	Very low	26.2	Very low	115 Å²	115	144.1 Å²	144.1	80%	0.804	77%	0.772	S	S	*	*			trans	-105	83.8	165.1	58.5	0	0	0	0	108.5	Q408	Q408-S410 PolarHBondContact O-N 2.95Å
411	F	22.7	Very low	26	Very low	199 Å²	199	146.3 Å²	146.3	87%	0.873	78%	0.778	S	S	*	*			trans	-88.4	111.6	161.4	-88.7	-79.2	0	0	0	108.9
412	C	21.2	Very low	25.7	Very low	119 Å²	119	144.5 Å²	144.5	80%	0.804	78%	0.775	S	S	*	*			trans	-111.4	105.1	163.3	-143.9	0	0	0	0	109.2
413	S	22.1	Very low	25.3	Very low	98 Å²	98	147.3 Å²	147.3	69%	0.685	78%	0.781	S	S	*	*			trans	27.8	125.8	142.3	48.1	0	0	0	0	121.1
414	S	23.4	Very low	25	Very low	119 Å²	119	149 Å²	149	83%	0.832	78%	0.782	S	S	*	*			trans	-160.9	108.8	136.2	-79.3	0	0	0	0	112.7
415	Q	24.9	Very low	24.6	Very low	174 Å²	174	145 Å²	145	81%	0.813	77%	0.77	S	S	*	*			trans	33.1	119.8	140.9	-61.9	-175.6	-10.3	0	0	120.8
416	N	23.9	Very low	24.4	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	77%	0.771	S	S	*	*				164.6	143.7	87.2	-103.1	-30.7	0	0	0	114.7
417	M	23.5	Very low	24.2	Very low	136 Å²	136	147.7 Å²	147.7	67%	0.67	77%	0.768	S	S	*	*			trans	80.1	109.9	147.5	-69.7	-113	111.1	0	0	122.7
418	R	22.6	Very low	24.3	Very low	194 Å²	194	143.8 Å²	143.8	73%	0.732	76%	0.761	S	S	*	*				90.3	123.7	123	-81.3	-176.2	-177.1	169.9	7	122.1
419	N	23.6	Very low	24.3	Very low	143 Å²	143	140.7 Å²	140.7	77%	0.765	76%	0.757	S	S	*	*			trans	70.9	142.8	144.2	-60.7	3.4	0	0	0	116.4
420	S	24.9	Very low	24.1	Very low	97 Å²	97	141.7 Å²	141.7	68%	0.678	76%	0.759	S	S	*	*			cis	-175.5	143.9	1.1	38.7	0	0	0	0	107.7
421	D	23.5	Very low	24.3	Very low	144 Å²	144	141 Å²	141	77%	0.77	76%	0.76	S	S	*	*			trans	51.6	121.5	142	-56.7	-28.9	0	0	0	124.2
422	T	24.7	Very low	24.5	Very low	124 Å²	124	136.5 Å²	136.5	76%	0.761	76%	0.759	S	S	*	*			trans	78.2	120.4	132.7	39.7	0	0	0	0	124.6
423	E	23.4	Very low	24.7	Very low	164 Å²	164	134.3 Å²	134.3	77%	0.766	76%	0.757	S	S	*	*				81.7	120.6	129.6	-79.7	-169.9	153.1	0	0	124
424	N	23.9	Very low	24.9	Very low	137 Å²	137	141.5 Å²	141.5	73%	0.733	77%	0.769	S	S	*	*			trans	52.6	140	141.3	-63.1	-21.4	0	0	0	119
425	D	23.6	Very low	25.1	Very low	111 Å²	111	141.9 Å²	141.9	59%	0.594	77%	0.766	S	S	*	*			cis	-170.9	146.7	41	-148.4	7.2	0	0	0	110.1
426	K	25.5	Very low	25.3	Very low	166 Å²	166	139.4 Å²	139.4	72%	0.722	77%	0.765	S	S	*	*			trans	54	126.5	152.7	-65.6	163.5	-172.6	140.1	0	122.6
427	I	25.1	Very low	25.6	Very low	163 Å²	163	141.8 Å²	141.8	84%	0.836	77%	0.772	S	S	*	*				165.3	133.5	112.9	-80.1	155.6	0	0	0	109.8
428	V	29.6	Very low	26.3	Very low	124 Å²	124	141.8 Å²	141.8	75%	0.752	78%	0.78	S	S	*	*			trans	-88.9	143.6	174.8	173.2	0	0	0	0	110
429	P	28.1	Very low	27.5	Very low	117 Å²	117	140.5 Å²	140.5	76%	0.76	78%	0.782	S	S	*	*				-143.6	126.4	106.7	27.4	-6.8	0	0	0	113.5
430	K	23.3	Very low	29.5	Very low	192 Å²	192	139.5 Å²	139.5	84%	0.835	77%	0.773	S	S	*	*				60.2	101.6	96.3	-101.3	-172.8	178	-177.9	0	116.2
431	A	26	Very low	31.8	Very low	100 Å²	100	136.6 Å²	136.6	83%	0.826	75%	0.749	S	S	*	*			trans	39.6	97.9	141.4	0	0	0	0	0	118.5
432	A	27.1	Very low	34.1	Very low	104 Å²	104	130.4 Å²	130.4	86%	0.86	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-70.5	128.9	155.5	0	0	0	0	0	109.6
433	G	26	Very low	35.7	Very low	74 Å²	74	126.1 Å²	126.1	76%	0.763	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-65.4	144.7	179	0	0	0	0	0	112.5
434	R	25.6	Very low	37.1	Very low	249 Å²	249	123 Å²	123	94%	0.94	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-61.9	132.4	173.6	-73.5	174.1	172.6	179.4	-5.8	110.7
435	V	27.8	Very low	38.7	Very low	127 Å²	127	120.4 Å²	120.4	77%	0.77	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-64.3	136.7	160.4	-179.8	0	0	0	0	108	E437	V435-E437 PolarHBondContact O-N 3.29Å
436	P	30.7	Very low	41	Very low	122 Å²	122	116.7 Å²	116.7	79%	0.792	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-71.2	122.1	171.7	-5.1	21.6	0	0	0	108.9
437	E	29.4	Very low	43.3	Very low	189 Å²	189	114 Å²	114	88%	0.883	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-63.1	135	171.3	-70.5	171.7	166.1	0	0	109.4	V435 E439	V435-E437 PolarHBondContact O-N 3.29Å; E437-E439 PolarHBondContact O-N 3.11Å
438	T	38.5	Very low	46	Very low	136 Å²	136	108.2 Å²	108.2	83%	0.834	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-64	122.3	170.7	5.5	0	0	0	0	108	E440	T438-E440 PolarHBondContact O-N 3.19Å; T438-E440 VanDerWaalsContact O-N 3.09Å
439	E	48.4	Very low	48.6	Very low	167 Å²	167	106.4 Å²	106.4	78%	0.78	63%	0.627	S	S	*	*			trans	-60.4	113.7	177	-78	-178.7	157.7	0	0	110.1	E437 L441	E437-E439 PolarHBondContact O-N 3.11Å; E439-L441 PolarHBondContact O-N 3.31Å
440	E	63.9	Low	51.2	Low	122 Å²	122	102.8 Å²	102.8	57%	0.57	60%	0.599	S	S	*	*			trans	-67.3	97.4	172.6	-74.7	-176.8	164.3	0	0	110.3	T438 I442 P444 K503	T438-E440 PolarHBondContact O-N 3.19Å; T438-E440 VanDerWaalsContact O-N 3.09Å; E440-I442 PolarHBondContact O-N 2.86Å; E440-P444 WeakPolarHBondContact OE2-CD 3.26Å; E440-P444 VanDerWaalsContact OE2-CG 3.31Å; E440-P444 WeakPolarHBondContact OE2-CG 3.05Å; E440-K503 WeakPolarHBondContact O-CD 3.17Å; E440-K503 PolarHBondContact O-NZ 2.82Å; E440-K503 VanDerWaalsContact O-NZ 3.09Å; E440-K503 IonicContact OE2-NZ 3.02Å
441	L	73.3	Confident	53.6	Low	37 Å²	37	98.3 Å²	98.3	19%	0.194	59%	0.585	C	S	.	*	S	Bend	trans	-60.1	-26.5	-177.9	-62.8	178.1	0	0	0	114.2	E439 K503 E509 V510	E439-L441 PolarHBondContact O-N 3.31Å; L441-K503 PolarHBondContact O-N 2.86Å; L441-E509 HydrophobicContact CD1-CB 4.15Å; L441-V510 HydrophobicContact CB-CG2 4.26Å; L441-V510 HydrophobicContact CD1-CG2 4.27Å; L441-V510 HydrophobicContact CD2-CG2 4.07Å; L441-V510 HydrophobicContact CG-CG2 4.43Å
442	I	72	Confident	55.7	Low	14 Å²	14	94.4 Å²	94.4	7%	0.072	55%	0.55	C	S	.	.	S	Bend	trans	-120.2	133.8	178	-57.1	-168.8	0	0	0	108.8	E440 M500 E513 A514 Q517	E440-I442 PolarHBondContact O-N 2.86Å; I442-M500 HydrophobicContact CD1-CE 4.18Å; I442-M500 HydrophobicContact CD1-SD 3.92Å; I442-M500 HydrophobicContact CG2-CE 3.82Å; I442-E513 HydrophobicContact CD1-CB 4.25Å; I442-E513 HydrophobicContact CD1-CG 3.73Å; I442-E513 HydrophobicContact CG1-CG 4.12Å; I442-A514 HydrophobicContact CD1-CB 4.27Å; I442-Q517 HydrophobicContact CD1-CG 4.44Å
443	A	59.4	Low	56.9	Low	33 Å²	33	94.6 Å²	94.6	27%	0.273	54%	0.54	S	S	.	.			trans	-70.7	128.4	179.4	0	0	0	0	0	111.3	G445 T446 K503	A443-G445 PolarHBondContact O-N 2.8Å; A443-T446 WeakPolarHBondContact CB-OG1 3.38Å; A443-T446 PolarHBondContact O-N 2.84Å; A443-T446 PolarHBondContact O-OG1 3.15Å; A443-K503 HydrophobicContact CB-CD 4.43Å; A443-K503 HydrophobicContact CB-CG 4.27Å
444	P	51.8	Low	57.5	Low	99 Å²	99	97.4 Å²	97.4	64%	0.643	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	125.9	175.7	-23.3	31.9	0	0	0	111	E440	E440-P444 WeakPolarHBondContact OE2-CD 3.26Å; E440-P444 VanDerWaalsContact OE2-CG 3.31Å; E440-P444 WeakPolarHBondContact OE2-CG 3.05Å
445	G	58.1	Low	57.6	Low	82 Å²	82	90.3 Å²	90.3	85%	0.845	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	8.7	179.3	0	0	0	0	0	116	A443	A443-G445 PolarHBondContact O-N 2.8Å
446	T	70.7	Confident	57.6	Low	33 Å²	33	88.4 Å²	88.4	20%	0.202	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-65.7	124	173.7	-54.3	0	0	0	0	110.7	A443 A501	A443-T446 WeakPolarHBondContact CB-OG1 3.38Å; A443-T446 PolarHBondContact O-N 2.84Å; A443-T446 PolarHBondContact O-OG1 3.15Å; T446-A501 HydrophobicContact CG2-CB 3.75Å
447	P	74.6	Confident	57.5	Low	110 Å²	110	88.4 Å²	88.4	71%	0.714	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-68.3	136.4	178.4	27.4	-32.8	0	0	0	111.1
448	I	82.4	Confident	57.6	Low	41 Å²	41	87.4 Å²	87.4	21%	0.21	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-89.8	126.8	172.1	-62.8	164.5	0	0	0	108.5	F450 M500 V518 A521	I448-F450 HydrophobicContact CB-CE2 4.2Å; I448-F450 HydrophobicContact CB-CZ 3.94Å; I448-F450 HydrophobicContact CG2-CD1 4.17Å; I448-F450 HydrophobicContact CG2-CE1 3.48Å; I448-F450 VanDerWaalsContact CG2-CE1 3.48Å; I448-F450 HydrophobicContact CG2-CE2 3.94Å; I448-F450 HydrophobicContact CG2-CZ 3.37Å; I448-M500 HydrophobicContact CD1-CE 4.09Å; I448-M500 HydrophobicContact CG1-CB 4.32Å; I448-M500 HydrophobicContact CG1-CE 3.68Å; I448-M500 HydrophobicContact CG1-SD 4.4Å; I448-V518 HydrophobicContact CG2-CG2 3.97Å; I448-A521 HydrophobicContact CD1-CB 3.4Å
449	Q	82.7	Confident	57.2	Low	86 Å²	86	89.6 Å²	89.6	40%	0.402	51%	0.512	S	S	.	.	B	Isolated β-bridge	trans	-97.5	127.9	178.1	179.8	173.5	0.4	0	0	110.2	D451 G498 S499	Q449-D451 VanDerWaalsContact CG-O 3.23Å; Q449-D451 WeakPolarHBondContact CG-O 3.36Å; Q449-D451 PolarHBondContact NE2-O 3.29Å; Q449-G498 CarbonylContact O-C 3.57Å; Q449-G498 WeakPolarHBondContact O-CA 3.47Å; Q449-S499 PolarHBondContact N-O 3.39Å; Q449-S499 PolarHBondContact O-N 2.99Å
450	F	82.9	Confident	56.3	Low	41 Å²	41	89.1 Å²	89.1	18%	0.18	51%	0.514	C	S	.	.			trans	-105	-7.1	-177.3	-62.4	-69.3	0	0	0	114.1	I448 L497 V518 A521 R522 I527	I448-F450 HydrophobicContact CB-CE2 4.2Å; I448-F450 HydrophobicContact CB-CZ 3.94Å; I448-F450 HydrophobicContact CG2-CD1 4.17Å; I448-F450 HydrophobicContact CG2-CE1 3.48Å; I448-F450 VanDerWaalsContact CG2-CE1 3.48Å; I448-F450 HydrophobicContact CG2-CE2 3.94Å; I448-F450 HydrophobicContact CG2-CZ 3.37Å; F450-L497 WeakPolarHBondContact CD1-O 3.44Å; F450-V518 HydrophobicContact CE1-CG1 4.46Å; F450-A521 HydrophobicContact CZ-CB 3.94Å; F450-R522 HydrophobicContact CD1-CG 3.91Å; F450-R522 HydrophobicContact CE1-CG 3.4Å; F450-R522 VanDerWaalsContact CE1-CG 3.4Å; F450-R522 HydrophobicContact CZ-CG 4.26Å; F450-I527 HydrophobicContact CB-CG2 4.49Å; F450-I527 HydrophobicContact CD1-CD1 4.08Å; F450-I527 HydrophobicContact CD2-CD1 3.25Å; F450-I527 HydrophobicContact CE1-CD1 4.1Å; F450-I527 HydrophobicContact CE2-CD1 3.24Å; F450-I527 HydrophobicContact CG-CD1 3.68Å; F450-I527 HydrophobicContact CG-CG2 4.41Å; F450-I527 HydrophobicContact CZ-CD1 3.68Å
451	D	75.3	Confident	54.7	Low	99 Å²	99	90.9 Å²	90.9	53%	0.529	53%	0.527	S	S	.	.			trans	-118.8	126.3	176	-74.5	-45.5	0	0	0	110.2	Q449 V453	Q449-D451 VanDerWaalsContact CG-O 3.23Å; Q449-D451 WeakPolarHBondContact CG-O 3.36Å; Q449-D451 PolarHBondContact NE2-O 3.29Å; D451-V453 PolarHBondContact O-N 3.45Å; D451-V453 VanDerWaalsContact O-N 3.14Å
452	I	68.7	Low	52.8	Low	17 Å²	17	97 Å²	97	9%	0.087	56%	0.555	C	S	.	*			trans	-78.9	10.1	-177.7	-161.2	147.4	0	0	0	113.8	L454 F496 L544 A554 Y592 F594	I452-L454 PolarHBondContact O-N 2.67Å; I452-F496 HydrophobicContact CB-CD1 3.9Å; I452-F496 HydrophobicContact CB-CE1 3.96Å; I452-F496 HydrophobicContact CB-CG 4.2Å; I452-F496 HydrophobicContact CB-CZ 4.32Å; I452-F496 HydrophobicContact CD1-CD2 3.79Å; I452-F496 HydrophobicContact CD1-CE2 3.91Å; I452-F496 HydrophobicContact CD1-CG 4.12Å; I452-F496 HydrophobicContact CD1-CZ 4.32Å; I452-L544 HydrophobicContact CD1-CD1 3.33Å; I452-L544 HydrophobicContact CG1-CD1 4.46Å; I452-A554 HydrophobicContact CG1-CB 4.38Å; I452-Y592 HydrophobicContact CD1-CD1 4.24Å; I452-Y592 HydrophobicContact CD1-CE1 4.49Å; I452-F594 HydrophobicContact CD1-CE1 4.24Å; I452-F594 HydrophobicContact CD1-CZ 4.14Å
453	V	52.3	Low	50.7	Low	109 Å²	109	104.1 Å²	104.1	66%	0.661	59%	0.593	S	S	*	*			trans	-83.3	107.6	-178.9	-168.5	0	0	0	0	108.5	D451	D451-V453 PolarHBondContact O-N 3.45Å; D451-V453 VanDerWaalsContact O-N 3.14Å
454	L	39.1	Very low	49.3	Very low	132 Å²	132	114.4 Å²	114.4	69%	0.691	63%	0.625	S	S	*	*			trans	-55.5	127.3	163.4	-73.6	162.6	0	0	0	108.2	I452 A456	I452-L454 PolarHBondContact O-N 2.67Å; L454-A456 PolarHBondContact O-N 2.8Å
455	P	27.3	Very low	48.2	Very low	101 Å²	101	113 Å²	113	66%	0.656	63%	0.629	S	S	*	*			trans	-55.7	136.2	171	-19.2	30	0	0	0	109.1	T457	P455-T457 PolarHBondContact O-N 3.35Å; P455-T457 PolarHBondContact O-OG1 2.84Å
456	A	28	Very low	46.9	Very low	86 Å²	86	114.8 Å²	114.8	71%	0.711	63%	0.628	S	S	*	*	S	Bend	trans	-50.1	97.7	179.9	0	0	0	0	0	112.8	L454 F459	L454-A456 PolarHBondContact O-N 2.8Å; A456-F459 HydrophobicContact CB-CD2 4.44Å
457	T	28.9	Very low	44.9	Very low	122 Å²	122	124.7 Å²	124.7	75%	0.748	66%	0.662	S	S	*	*			trans	-118.9	-5.4	164.8	38.5	0	0	0	0	113.4	P455	P455-T457 PolarHBondContact O-N 3.35Å; P455-T457 PolarHBondContact O-OG1 2.84Å
458	E	31.8	Very low	43.3	Very low	169 Å²	169	131 Å²	131	79%	0.79	67%	0.672	S	S	*	*	S	Bend	trans	-96.1	5.4	178.4	-69.5	-175.2	166.9	0	0	114.9	L460	E458-L460 PolarHBondContact O-N 2.9Å
459	F	30.4	Very low	40.7	Very low	182 Å²	182	136 Å²	136	80%	0.798	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	6.9	174.2	-96.2	-81.1	0	0	0	114.7	A456	A456-F459 HydrophobicContact CB-CD2 4.44Å
460	L	29.5	Very low	38.3	Very low	156 Å²	156	138.7 Å²	138.7	82%	0.817	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-12.4	-179.9	-89.7	159.7	0	0	0	115.6	E458	E458-L460 PolarHBondContact O-N 2.9Å
461	D	29.8	Very low	36.1	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	75%	0.745	S	S	*	*	S	Bend	trans	-98.9	-1	-178.1	-87.7	-18.6	0	0	0	115.5	N463	D461-N463 PolarHBondContact O-N 3.45Å
462	Q	33.1	Very low	34.2	Very low	166 Å²	166	145.8 Å²	145.8	78%	0.776	76%	0.758	S	S	*	*			trans	-86.8	6.5	177.4	-72.2	-172.1	4.5	0	0	115.3	R464	Q462-R464 PolarHBondContact O-N 3.36Å
463	N	27.4	Very low	33.2	Very low	163 Å²	163	148.7 Å²	148.7	87%	0.872	79%	0.792	S	S	*	*			trans	-99.7	40.7	178.8	-102.1	-14.9	0	0	0	114.8	D461	D461-N463 PolarHBondContact O-N 3.45Å
464	R	31.2	Very low	32.4	Very low	249 Å²	249	152.6 Å²	152.6	94%	0.94	80%	0.803	S	S	*	*	S	Bend	trans	-135.5	76.2	156.2	-78.3	-168.2	174.2	-179.1	1	111	Q462	Q462-R464 PolarHBondContact O-N 3.36Å
465	G	27.9	Very low	32	Very low	70 Å²	70	154.9 Å²	154.9	72%	0.722	81%	0.813	S	S	*	*			trans	168.4	76.1	172	0	0	0	0	0	113.2	R467	G465-R467 PolarHBondContact O-N 2.9Å
466	S	30	Very low	32.3	Very low	120 Å²	120	159.1 Å²	159.1	84%	0.839	82%	0.824	S	S	*	*			trans	-57.1	121.8	173.7	-171.9	0	0	0	0	111.9
467	R	28.9	Very low	32.2	Very low	241 Å²	241	161.8 Å²	161.8	91%	0.909	83%	0.826	S	S	*	*			trans	-160.1	116.1	140.2	-106.2	168.9	-169.1	-165.6	2.8	110.5	G465	G465-R467 PolarHBondContact O-N 2.9Å
468	R	41.7	Very low	32.5	Very low	243 Å²	243	164.8 Å²	164.8	92%	0.917	83%	0.831	S	S	*	*			trans	-72.6	144	172.6	-73.7	176.1	167.1	-178	-4.7	110.3
469	T	28.8	Very low	32.2	Very low	144 Å²	144	160.8 Å²	160.8	88%	0.883	82%	0.822	S	S	*	*			trans	-135.9	149.1	159.9	-1.6	0	0	0	0	111.5
470	N	31.9	Very low	32.1	Very low	144 Å²	144	160.3 Å²	160.3	77%	0.77	82%	0.82	S	S	*	*			trans	-82.5	165.5	-157.2	-140.7	10	0	0	0	113.1	F472	N470-F472 PolarHBondContact O-N 3.09Å
471	P	37.1	Very low	32.3	Very low	104 Å²	104	158.6 Å²	158.6	68%	0.675	82%	0.818	S	S	*	*	S	Bend	trans	-91.3	20.6	-169.9	37.9	-33.4	0	0	0	114.9
472	F	35.1	Very low	32.6	Very low	185 Å²	185	160.2 Å²	160.2	81%	0.811	82%	0.821	S	S	*	*	S	Bend	trans	-127.3	111.8	173.5	-77.2	-83.6	0	0	0	108.5	N470	N470-F472 PolarHBondContact O-N 3.09Å
473	G	47.6	Very low	32.8	Very low	78 Å²	78	156.4 Å²	156.4	80%	0.804	82%	0.818	S	S	*	*			trans	-63.9	129.9	-176.3	0	0	0	0	0	112.3
474	E	34.5	Very low	33.3	Very low	191 Å²	191	157.4 Å²	157.4	89%	0.893	82%	0.817	S	S	*	*			trans	179.6	120.5	136.8	-100.2	173	-167.3	0	0	106.9
475	M	31.2	Very low	34.1	Very low	180 Å²	180	153.1 Å²	153.1	89%	0.887	81%	0.813	S	S	*	*			trans	-140.9	114.3	157.7	-82.5	-86.4	-75.9	0	0	106.3	D477	M475-D477 PolarHBondContact O-N 2.81Å
476	E	32.6	Very low	35.5	Very low	189 Å²	189	152.2 Å²	152.2	88%	0.883	80%	0.796	S	S	*	*			trans	-61.6	115.1	161	-66.3	174.5	144.2	0	0	108.4
477	D	26.8	Very low	37.2	Very low	142 Å²	142	151 Å²	151	76%	0.759	78%	0.78	S	S	*	*			trans	-169.1	99.6	143.4	-104.2	-24	0	0	0	106.9	M475 S479	M475-D477 PolarHBondContact O-N 2.81Å; D477-S479 PolarHBondContact O-N 2.91Å
478	E	34.2	Very low	39.4	Very low	185 Å²	185	139.9 Å²	139.9	86%	0.864	74%	0.738	S	S	*	*			trans	-64.6	83.5	160.2	-83.4	-102.7	152.9	0	0	107.7
479	S	25.7	Very low	41.3	Very low	85 Å²	85	132.1 Å²	132.1	59%	0.594	71%	0.712	S	S	*	*			trans	-138.2	90.8	162.9	66.6	0	0	0	0	108.6	D477	D477-S479 PolarHBondContact O-N 2.91Å
480	F	28.5	Very low	43.9	Very low	173 Å²	173	126 Å²	126	76%	0.759	67%	0.673	S	S	*	*			trans	-49.4	123.1	154.1	-72	-92.1	0	0	0	107.8	E482	F480-E482 PolarHBondContact O-N 3.22Å
481	P	33.5	Very low	46.5	Very low	120 Å²	120	124.5 Å²	124.5	78%	0.779	66%	0.663	S	S	*	*	S	Bend	trans	-73.5	117.9	172.5	2.9	12.3	0	0	0	108.2
482	E	36.6	Very low	49	Very low	192 Å²	192	120.5 Å²	120.5	90%	0.897	64%	0.635	S	S	*	*			trans	70	58.5	157.7	-58.1	-179.6	172	0	0	117.5	F480	F480-E482 PolarHBondContact O-N 3.22Å
483	A	37.3	Very low	51.7	Low	87 Å²	87	114.3 Å²	114.3	72%	0.719	61%	0.61	S	S	*	*			trans	-100.3	18.8	163.4	0	0	0	0	0	113.8
484	E	38.6	Very low	53.9	Low	184 Å²	184	110.6 Å²	110.6	86%	0.86	57%	0.572	S	S	*	*	S	Bend	trans	-106.7	-9	-171.5	-79.4	-165.2	154.7	0	0	117.5
485	D	47.5	Very low	56.6	Low	158 Å²	158	104.6 Å²	104.6	85%	0.845	54%	0.541	S	S	*	.	S	Bend	trans	-140	37.8	-173.1	-84.1	-33.9	0	0	0	115.8
486	S	58.3	Low	59.5	Low	52 Å²	52	96.3 Å²	96.3	36%	0.364	50%	0.5	S	S	.	.			trans	-117.1	113.1	169.1	-162.2	0	0	0	0	111.6	L488 S539	S486-L488 PolarHBondContact O-N 3.03Å; S486-L488 PolarHBondContact OG-O 3.35Å; S486-L488 VanDerWaalsContact OG-O 3.09Å; S486-S539 PolarHBondContact OG-N 3.48Å; S486-S539 PolarHBondContact OG-OG 3.37Å
487	L	65.5	Low	62.2	Low	95 Å²	95	87.6 Å²	87.6	50%	0.497	46%	0.459	S	S	.	.	S	Bend	trans	-62.6	-9	178.5	-66	168	0	0	0	113.6	I613 L623	L487-I613 HydrophobicContact CB-CD1 4.46Å; L487-I613 HydrophobicContact CB-CG2 4.39Å; L487-I613 HydrophobicContact CD1-CG2 4.1Å; L487-L623 HydrophobicContact CD1-CD1 4.16Å; L487-L623 HydrophobicContact CD1-CD2 3.99Å
488	L	75.5	Confident	65.2	Low	7 Å²	7	80.9 Å²	80.9	4%	0.037	42%	0.423	C	S	.	.			trans	-142.6	124.8	179	178.9	67.4	0	0	0	109.4	S486 Q490 T538 S539 A606 L609 I613	S486-L488 PolarHBondContact O-N 3.03Å; S486-L488 PolarHBondContact OG-O 3.35Å; S486-L488 VanDerWaalsContact OG-O 3.09Å; L488-Q490 HydrophobicContact CD1-CG 3.96Å; L488-T538 WeakPolarHBondContact O-CA 3.4Å; L488-S539 PolarHBondContact O-N 3.09Å; L488-A606 WeakPolarHBondContact CD2-O 3.35Å; L488-L609 HydrophobicContact CD1-CD2 3.82Å; L488-L609 HydrophobicContact CD1-CG 4.43Å; L488-L609 HydrophobicContact CD2-CB 4.44Å; L488-L609 HydrophobicContact CD2-CG 4.3Å; L488-I613 HydrophobicContact CB-CD1 3.8Å; L488-I613 HydrophobicContact CD2-CD1 4.32Å
489	Q	81.3	Confident	67.8	Low	79 Å²	79	72.3 Å²	72.3	37%	0.369	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	107.8	169	-169.4	177.9	19.6	0	0	109.6	M536 V537 Y638	Q489-M536 HydrophobicContact CG-CG 4.32Å; Q489-M536 HydrophobicContact CG-SD 4.28Å; Q489-M536 PolarHBondContact NE2-SD 3.49Å; Q489-V537 WeakPolarHBondContact CA-O 3.35Å; Q489-Y638 VanDerWaalsContact O-CD1 3.3Å; Q489-Y638 WeakPolarHBondContact O-CD1 3.38Å; Q489-Y638 WeakPolarHBondContact O-CE1 3.39Å
490	Q	82.3	Confident	70.8	Confident	15 Å²	15	68.5 Å²	68.5	7%	0.07	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.5	176.4	-63.5	-168	20.8	0	0	110.8	L488 F492 M536 V537 A606	L488-Q490 HydrophobicContact CD1-CG 3.96Å; Q490-F492 HydrophobicContact CB-CE2 3.71Å; Q490-F492 HydrophobicContact CB-CZ 4.08Å; Q490-M536 CarbonylContact O-C 3.5Å; Q490-M536 WeakPolarHBondContact O-CA 3.32Å; Q490-V537 PolarHBondContact N-O 2.87Å; Q490-V537 PolarHBondContact O-N 2.93Å; Q490-A606 HydrophobicContact CB-CB 4.38Å
491	M	86.9	Confident	73.6	Confident	114 Å²	114	62.4 Å²	62.4	56%	0.562	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.5	-178.2	-175.8	171.1	66.5	0	0	110.5	H534 L535	M491-H534 HydrophobicContact CG-CB 4.11Å; M491-H534 HydrophobicContact SD-CB 4Å; M491-L535 WeakPolarHBondContact CA-O 3.48Å
492	F	90.4	Very high	76.1	Confident	19 Å²	19	57.3 Å²	57.3	8%	0.083	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.1	179.1	-57.2	-86.3	0	0	0	110.4	Q490 V494 H534 L535 V537 K602 I603 A606	Q490-F492 HydrophobicContact CB-CE2 3.71Å; Q490-F492 HydrophobicContact CB-CZ 4.08Å; F492-V494 HydrophobicContact CB-CG1 4.29Å; F492-H534 CarbonylContact O-C 3.52Å; F492-H534 WeakPolarHBondContact O-CA 3.32Å; F492-L535 HydrophobicContact CB-CB 4.46Å; F492-L535 PolarHBondContact N-O 2.83Å; F492-L535 PolarHBondContact O-N 3.01Å; F492-V537 HydrophobicContact CD2-CG2 4.1Å; F492-V537 HydrophobicContact CE2-CG2 3.94Å; F492-K602 HydrophobicContact CE1-CB 4.02Å; F492-I603 HydrophobicContact CB-CD1 4.02Å; F492-I603 HydrophobicContact CB-CG1 4.07Å; F492-I603 HydrophobicContact CD1-CD1 4.3Å; F492-I603 HydrophobicContact CD1-CG1 3.61Å; F492-I603 HydrophobicContact CD2-CG1 3.81Å; F492-I603 HydrophobicContact CE1-CG1 3.9Å; F492-I603 HydrophobicContact CE2-CG1 4.08Å; F492-I603 HydrophobicContact CG-CD1 4.07Å; F492-I603 HydrophobicContact CG-CG1 3.55Å; F492-I603 HydrophobicContact CZ-CG1 4.11Å; F492-A606 HydrophobicContact CE2-CB 3.9Å; F492-A606 HydrophobicContact CZ-CB 4.01Å
493	I	90.8	Very high	78.3	Confident	55 Å²	55	52.9 Å²	52.9	28%	0.282	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.4	173.4	-53	178.7	0	0	0	107.6	E532 N597	I493-E532 HydrophobicContact CG2-CG 3.57Å; I493-N597 HydrophobicContact CB-CB 4.4Å; I493-N597 WeakPolarHBondContact CB-ND2 3.49Å; I493-N597 PolarHBondContact O-N 3.39Å; I493-N597 PolarHBondContact O-OD1 3.48Å; I493-N597 VanDerWaalsContact O-OD1 3.13Å
494	V	93.3	Very high	80.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	154.1	-176.8	-59	0	0	0	0	111.2	F492 E532 S533 L535 L544 F594 E595 I603	F492-V494 HydrophobicContact CB-CG1 4.29Å; V494-E532 CarbonylContact O-C 3.45Å; V494-E532 WeakPolarHBondContact O-CA 3.29Å; V494-S533 PolarHBondContact N-O 2.9Å; V494-S533 PolarHBondContact O-N 2.89Å; V494-S533 VanDerWaalsContact O-O 3.13Å; V494-L535 HydrophobicContact CB-CB 4.49Å; V494-L535 HydrophobicContact CG1-CB 3.94Å; V494-L535 HydrophobicContact CG1-CD2 4.1Å; V494-L535 HydrophobicContact CG2-CB 3.71Å; V494-L544 HydrophobicContact CG2-CD2 3.7Å; V494-F594 HydrophobicContact CB-CB 4.19Å; V494-F594 HydrophobicContact CB-CD1 4.19Å; V494-F594 HydrophobicContact CB-CG 4.48Å; V494-F594 HydrophobicContact CG2-CD1 3.84Å; V494-F594 HydrophobicContact CG2-CE1 4.4Å; V494-F594 HydrophobicContact CG2-CG 4.49Å; V494-E595 CarbonylContact C-O 3.51Å; V494-E595 WeakPolarHBondContact CA-O 3.2Å; V494-I603 HydrophobicContact CG1-CD1 3.93Å
495	R	92.8	Very high	82.6	Confident	66 Å²	66	42.1 Å²	42.1	25%	0.249	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.6	173.4	-61.9	-171.7	-175.1	93.6	13.9	108.9	L497 M530 T531 E532 F594 E595	R495-L497 PolarHBondContact O-N 2.8Å; R495-M530 HydrophobicContact CB-CB 4.14Å; R495-M530 HydrophobicContact CB-SD 4.46Å; R495-T531 WeakPolarHBondContact CA-O 3.17Å; R495-E532 HydrophobicContact CG-CB 4.37Å; R495-E532 HydrophobicContact CG-CG 4.43Å; R495-E532 IonicContact CZ-OE2 3.12Å; R495-E532 IonicContact NE-OE2 2.83Å; R495-E532 PolarHBondContact NE-OE2 2.8Å; R495-E532 IonicContact NH2-OE2 3.33Å; R495-E532 PolarHBondContact NH2-OE2 2.83Å; R495-F594 CarbonylContact O-C 3.25Å; R495-F594 VanDerWaalsContact O-CA 3.27Å; R495-F594 WeakPolarHBondContact O-CA 3.49Å; R495-E595 HydrophobicContact CB-CB 4.33Å; R495-E595 PolarHBondContact N-O 2.93Å; R495-E595 IonicContact NH1-OE2 3.79Å; R495-E595 PolarHBondContact NH1-OE2 3.48Å; R495-E595 PolarHBondContact O-N 3.46Å
496	F	92.1	Very high	84.3	Confident	5 Å²	5	41.8 Å²	41.8	2%	0.022	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	124.8	178	-178.5	-116.9	0	0	0	110.4	I452 G498 T531 Y592 F594	I452-F496 HydrophobicContact CB-CD1 3.9Å; I452-F496 HydrophobicContact CB-CE1 3.96Å; I452-F496 HydrophobicContact CB-CG 4.2Å; I452-F496 HydrophobicContact CB-CZ 4.32Å; I452-F496 HydrophobicContact CD1-CD2 3.79Å; I452-F496 HydrophobicContact CD1-CE2 3.91Å; I452-F496 HydrophobicContact CD1-CG 4.12Å; I452-F496 HydrophobicContact CD1-CZ 4.32Å; F496-G498 WeakPolarHBondContact CE2-O 2.88Å; F496-G498 VanDerWaalsContact CZ-CA 3.47Å; F496-T531 PolarHBondContact N-O 2.86Å; F496-T531 VanDerWaalsContact N-O 3.15Å; F496-Y592 AromaticContact CE2-CD1 3.91Å; F496-Y592 HydrophobicContact CE2-CD1 3.91Å; F496-Y592 HydrophobicContact CZ-CD1 4.43Å; F496-F594 HydrophobicContact CB-CD1 4.14Å; F496-F594 HydrophobicContact CB-CE1 4.01Å; F496-F594 HydrophobicContact CD2-CD1 4.05Å; F496-F594 AromaticContact CD2-CE1 3.53Å; F496-F594 HydrophobicContact CD2-CE1 3.53Å; F496-F594 AromaticContact CD2-CZ 3.8Å; F496-F594 HydrophobicContact CD2-CZ 3.8Å; F496-F594 HydrophobicContact CE2-CE1 4.48Å; F496-F594 HydrophobicContact CE2-CZ 4.34Å; F496-F594 HydrophobicContact CG-CE1 4.22Å
497	L	88.4	Confident	85.7	Confident	7 Å²	7	41.9 Å²	41.9	4%	0.037	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-37.7	179.4	-64.2	-177.9	0	0	0	111.8	F450 R495 V518 L519 R522 M530 L573 I593 E595	F450-L497 WeakPolarHBondContact CD1-O 3.44Å; R495-L497 PolarHBondContact O-N 2.8Å; L497-V518 HydrophobicContact CB-CG1 4.17Å; L497-L519 HydrophobicContact CD1-CD2 4.07Å; L497-R522 WeakPolarHBondContact O-CD 3.47Å; L497-R522 PolarHBondContact O-NH1 3.12Å; L497-M530 HydrophobicContact CD2-CG 4.11Å; L497-M530 HydrophobicContact CD2-SD 3.36Å; L497-M530 WeakPolarHBondContact CD2-SD 3.48Å; L497-L573 HydrophobicContact CD1-CD2 3.36Å; L497-I593 HydrophobicContact CB-CB 4.45Å; L497-I593 HydrophobicContact CB-CG2 4.19Å; L497-I593 WeakPolarHBondContact CB-O 3.37Å; L497-I593 HydrophobicContact CD1-CG2 4.04Å; L497-I593 PolarHBondContact N-O 2.98Å; L497-E595 HydrophobicContact CD1-CB 4.07Å; L497-E595 HydrophobicContact CD2-CB 4.2Å; L497-E595 HydrophobicContact CG-CB 4.21Å
498	G	89.1	Confident	86.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.6	168.2	174.4	0	0	0	0	0	112.3	Q449 F496 I593	Q449-G498 CarbonylContact O-C 3.57Å; Q449-G498 WeakPolarHBondContact O-CA 3.47Å; F496-G498 WeakPolarHBondContact CE2-O 2.88Å; F496-G498 VanDerWaalsContact CZ-CA 3.47Å; G498-I593 PolarHBondContact N-O 2.89Å; G498-I593 PolarHBondContact O-N 3.26Å
499	S	90.1	Very high	87.3	Confident	6 Å²	6	45.3 Å²	45.3	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.3	172.5	58.6	0	0	0	0	111.1	Q449 T591	Q449-S499 PolarHBondContact N-O 3.39Å; Q449-S499 PolarHBondContact O-N 2.99Å; S499-T591 WeakPolarHBondContact CA-O 3.39Å; S499-T591 WeakPolarHBondContact CB-O 3.29Å
500	M	87.3	Confident	87.7	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.025	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	151.3	174.4	67.8	-164.7	-45.1	0	0	111.5	I442 I448 V502 A514 Q517 V518 S590 T591	I442-M500 HydrophobicContact CD1-CE 4.18Å; I442-M500 HydrophobicContact CD1-SD 3.92Å; I442-M500 HydrophobicContact CG2-CE 3.82Å; I448-M500 HydrophobicContact CD1-CE 4.09Å; I448-M500 HydrophobicContact CG1-CB 4.32Å; I448-M500 HydrophobicContact CG1-CE 3.68Å; I448-M500 HydrophobicContact CG1-SD 4.4Å; M500-V502 HydrophobicContact CG-CG1 4.49Å; M500-A514 HydrophobicContact CG-CB 4.16Å; M500-A514 HydrophobicContact SD-CB 3.81Å; M500-Q517 HydrophobicContact CE-CB 4.15Å; M500-Q517 VanDerWaalsContact CE-OE1 3.32Å; M500-Q517 HydrophobicContact SD-CB 4.19Å; M500-V518 HydrophobicContact SD-CG2 4.08Å; M500-S590 WeakPolarHBondContact O-CA 3.48Å; M500-T591 PolarHBondContact N-O 3.04Å; M500-T591 PolarHBondContact O-N 3.27Å
501	A	87.6	Confident	88.1	Confident	44 Å²	44	40.8 Å²	40.8	36%	0.364	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	144.5	174.2	0	0	0	0	0	111.1	T446 L589	T446-A501 HydrophobicContact CG2-CB 3.75Å; A501-L589 CarbonylContact C-O 3.54Å; A501-L589 VanDerWaalsContact CA-O 3.29Å; A501-L589 WeakPolarHBondContact CA-O 3.49Å
502	V	87.1	Confident	88.2	Confident	13 Å²	13	38.8 Å²	38.8	8%	0.079	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	155.7	-177.8	-62.2	0	0	0	0	110.6	M500 V510 V577 L589 T591	M500-V502 HydrophobicContact CG-CG1 4.49Å; V502-V510 HydrophobicContact CB-CG1 3.55Å; V502-V510 HydrophobicContact CG1-CG1 3.54Å; V502-V510 HydrophobicContact CG2-CG1 3.87Å; V502-V577 HydrophobicContact CG2-CG1 4.07Å; V502-L589 HydrophobicContact CG2-CB 3.66Å; V502-L589 PolarHBondContact N-O 3.42Å; V502-T591 WeakPolarHBondContact CG1-OG1 3.39Å
503	K	82.9	Confident	88.1	Confident	100 Å²	100	40.3 Å²	40.3	44%	0.435	20%	0.201	S	C	.	.	S	Bend	trans	-87.9	-24.8	-175.3	-65	-170.8	-164.7	151.6	0	113.9	E440 L441 A443	E440-K503 WeakPolarHBondContact O-CD 3.17Å; E440-K503 PolarHBondContact O-NZ 2.82Å; E440-K503 VanDerWaalsContact O-NZ 3.09Å; E440-K503 IonicContact OE2-NZ 3.02Å; L441-K503 PolarHBondContact O-N 2.86Å; A443-K503 HydrophobicContact CB-CD 4.43Å; A443-K503 HydrophobicContact CB-CG 4.27Å
504	T	82.4	Confident	87.8	Confident	30 Å²	30	37.7 Å²	37.7	18%	0.184	19%	0.188	C	C	.	.			trans	-139.6	156.1	-173	66.4	0	0	0	0	111.1	V510	T504-V510 WeakPolarHBondContact OG1-CG2 3.36Å
505	D	83.9	Confident	87.7	Confident	14 Å²	14	37.7 Å²	37.7	8%	0.075	19%	0.188	C	C	.	.			trans	-127.8	19	173.5	64.8	-5.3	0	0	0	112.4	T562 Q563 V577 R579 L589	D505-T562 VanDerWaalsContact CB-OG1 3.32Å; D505-T562 WeakPolarHBondContact CB-OG1 3.39Å; D505-T562 WeakPolarHBondContact OD2-CB 3.47Å; D505-T562 VanDerWaalsContact OD2-CG2 3.23Å; D505-T562 WeakPolarHBondContact OD2-CG2 3.44Å; D505-T562 PolarHBondContact OD2-OG1 3.13Å; D505-Q563 WeakPolarHBondContact O-CG 3.41Å; D505-Q563 PolarHBondContact O-NE2 3.35Å; D505-V577 HydrophobicContact CB-CG1 4.17Å; D505-R579 IonicContact OD1-NH2 3.3Å; D505-R579 IonicContact OD2-CZ 3.94Å; D505-R579 IonicContact OD2-NE 3.76Å; D505-R579 PolarHBondContact OD2-NE 3.17Å; D505-R579 IonicContact OD2-NH2 3.88Å; D505-R579 PolarHBondContact OD2-NH2 3.38Å; D505-L589 HydrophobicContact CB-CD1 3.99Å; D505-L589 HydrophobicContact CB-CD2 4.09Å
506	H	82.8	Confident	87.3	Confident	151 Å²	151	41.7 Å²	41.7	70%	0.699	20%	0.203	S	C	*	.	S	Bend	trans	-78.7	-24	-177.1	-61	-33.2	0	0	0	113.2
507	T	86.6	Confident	86.9	Confident	54 Å²	54	44.2 Å²	44.2	33%	0.331	22%	0.215	S	C	.	.			trans	-133.5	149.8	-176.3	68.2	0	0	0	0	111.3	E509	T507-E509 PolarHBondContact O-N 3.48Å
508	T	88	Confident	86.7	Confident	50 Å²	50	43.9 Å²	43.9	31%	0.307	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-11	171.2	57	0	0	0	0	112.8	V510 I511 Y512 A565	T508-V510 PolarHBondContact O-N 2.91Å; T508-I511 WeakPolarHBondContact O-CB 3.31Å; T508-I511 PolarHBondContact O-N 2.92Å; T508-Y512 WeakPolarHBondContact O-CD2 3.45Å; T508-Y512 PolarHBondContact O-N 3.29Å; T508-A565 HydrophobicContact CG2-CB 4.34Å
509	E	87.6	Confident	86.4	Confident	124 Å²	124	47.2 Å²	47.2	58%	0.579	23%	0.231	S	C	*	.	H	α-helix	trans	-60	-32.4	177.1	-63.5	-174.3	168.6	0	0	112.4	L441 T507 I511 Y512 E513	L441-E509 HydrophobicContact CD1-CB 4.15Å; T507-E509 PolarHBondContact O-N 3.48Å; E509-I511 PolarHBondContact O-N 2.97Å; E509-Y512 PolarHBondContact O-N 3.36Å; E509-Y512 VanDerWaalsContact O-N 3.17Å; E509-E513 PolarHBondContact O-N 2.82Å
510	V	88.8	Confident	85.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.2	-38.9	173.4	179.3	0	0	0	0	111.4	L441 V502 T504 T508 A514	L441-V510 HydrophobicContact CB-CG2 4.26Å; L441-V510 HydrophobicContact CD1-CG2 4.27Å; L441-V510 HydrophobicContact CD2-CG2 4.07Å; L441-V510 HydrophobicContact CG-CG2 4.43Å; V502-V510 HydrophobicContact CB-CG1 3.55Å; V502-V510 HydrophobicContact CG1-CG1 3.54Å; V502-V510 HydrophobicContact CG2-CG1 3.87Å; T504-V510 WeakPolarHBondContact OG1-CG2 3.36Å; T508-V510 PolarHBondContact O-N 2.91Å; V510-A514 VanDerWaalsContact O-CB 3.28Å; V510-A514 WeakPolarHBondContact O-CB 3.17Å; V510-A514 PolarHBondContact O-N 2.95Å
511	I	90.4	Very high	85.1	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.8	-42.8	179.4	-61.4	166.5	0	0	0	110.4	T508 E509 A514 M515 Q563 A565 V577 T591 I593	T508-I511 WeakPolarHBondContact O-CB 3.31Å; T508-I511 PolarHBondContact O-N 2.92Å; E509-I511 PolarHBondContact O-N 2.97Å; I511-A514 PolarHBondContact O-N 3.43Å; I511-M515 HydrophobicContact CG2-CE 3.78Å; I511-M515 HydrophobicContact CG2-CG 4.49Å; I511-M515 HydrophobicContact CG2-SD 4.39Å; I511-M515 VanDerWaalsContact O-CG 3.28Å; I511-M515 WeakPolarHBondContact O-CG 3.35Å; I511-M515 PolarHBondContact O-N 3.17Å; I511-Q563 HydrophobicContact CD1-CB 3.9Å; I511-A565 HydrophobicContact CB-CB 4.42Å; I511-A565 HydrophobicContact CD1-CB 3.87Å; I511-A565 HydrophobicContact CG2-CB 4.27Å; I511-V577 HydrophobicContact CD1-CG2 4.1Å; I511-V577 HydrophobicContact CG1-CG2 3.69Å; I511-T591 HydrophobicContact CG1-CG2 4.23Å; I511-I593 HydrophobicContact CG2-CD1 4.12Å
512	Y	90.7	Very high	84.7	Confident	71 Å²	71	47.9 Å²	47.9	28%	0.278	23%	0.233	S	C	.	.	H	α-helix	trans	-67.2	-39.9	179.3	-58	-51.4	0	0	0	112	T508 E509 M515 R516 A565 A566	T508-Y512 WeakPolarHBondContact O-CD2 3.45Å; T508-Y512 PolarHBondContact O-N 3.29Å; E509-Y512 PolarHBondContact O-N 3.36Å; E509-Y512 VanDerWaalsContact O-N 3.17Å; Y512-M515 HydrophobicContact CD1-SD 4.18Å; Y512-M515 WeakPolarHBondContact O-CB 3.42Å; Y512-M515 PolarHBondContact O-N 3.47Å; Y512-R516 PolarHBondContact O-N 3.3Å; Y512-A565 HydrophobicContact CE1-CB 4.1Å; Y512-A566 PolarHBondContact OH-O 2.97Å
513	E	86.7	Confident	83.6	Confident	51 Å²	51	50.2 Å²	50.2	24%	0.238	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-39.3	174.7	-176.6	52.7	-156.2	0	0	111.3	I442 E509 R516 Q517	I442-E513 HydrophobicContact CD1-CB 4.25Å; I442-E513 HydrophobicContact CD1-CG 3.73Å; I442-E513 HydrophobicContact CG1-CG 4.12Å; E509-E513 PolarHBondContact O-N 2.82Å; E513-R516 WeakPolarHBondContact O-CB 3.49Å; E513-R516 PolarHBondContact O-N 3.02Å; E513-R516 IonicContact OE1-CZ 2.88Å; E513-R516 IonicContact OE1-NE 3.45Å; E513-R516 PolarHBondContact OE1-NE 3.36Å; E513-R516 IonicContact OE1-NH2 3.3Å; E513-R516 PolarHBondContact OE1-NH2 3.05Å; E513-R516 IonicContact OE2-CZ 3.45Å; E513-R516 IonicContact OE2-NE 3.14Å; E513-R516 PolarHBondContact OE2-NE 2.99Å; E513-R516 IonicContact OE2-NH2 2.67Å; E513-R516 PolarHBondContact OE2-NH2 3.33Å; E513-Q517 WeakPolarHBondContact O-CG 3.33Å; E513-Q517 PolarHBondContact O-N 2.83Å; E513-Q517 PolarHBondContact OE1-NE2 3.45Å
514	A	86.4	Confident	82.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-42.1	172.9	0	0	0	0	0	112.3	I442 M500 V510 I511 R516 Q517 V518 T591 I593	I442-A514 HydrophobicContact CD1-CB 4.27Å; M500-A514 HydrophobicContact CG-CB 4.16Å; M500-A514 HydrophobicContact SD-CB 3.81Å; V510-A514 VanDerWaalsContact O-CB 3.28Å; V510-A514 WeakPolarHBondContact O-CB 3.17Å; V510-A514 PolarHBondContact O-N 2.95Å; I511-A514 PolarHBondContact O-N 3.43Å; A514-R516 VanDerWaalsContact C-N 3.32Å; A514-R516 PolarHBondContact O-N 3.3Å; A514-Q517 PolarHBondContact O-N 3.43Å; A514-V518 VanDerWaalsContact O-CB 3.31Å; A514-V518 WeakPolarHBondContact O-CB 3.39Å; A514-V518 WeakPolarHBondContact O-CG2 3.1Å; A514-V518 PolarHBondContact O-N 3.04Å; A514-T591 HydrophobicContact CB-CG2 3.79Å; A514-I593 HydrophobicContact CB-CD1 4.33Å
515	M	89.6	Confident	81.6	Confident	1 Å²	1	56 Å²	56	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-56.4	-47.5	172.5	-74.3	175.3	175.4	0	0	110.9	I511 Y512 L519 H567 L573 G575 I593	I511-M515 HydrophobicContact CG2-CE 3.78Å; I511-M515 HydrophobicContact CG2-CG 4.49Å; I511-M515 HydrophobicContact CG2-SD 4.39Å; I511-M515 VanDerWaalsContact O-CG 3.28Å; I511-M515 WeakPolarHBondContact O-CG 3.35Å; I511-M515 PolarHBondContact O-N 3.17Å; Y512-M515 HydrophobicContact CD1-SD 4.18Å; Y512-M515 WeakPolarHBondContact O-CB 3.42Å; Y512-M515 PolarHBondContact O-N 3.47Å; M515-L519 VanDerWaalsContact O-CB 3.29Å; M515-L519 WeakPolarHBondContact O-CB 3.33Å; M515-L519 WeakPolarHBondContact O-CG 3.38Å; M515-L519 PolarHBondContact O-N 3.29Å; M515-H567 HydrophobicContact SD-CB 3.99Å; M515-L573 HydrophobicContact CE-CB 4.27Å; M515-L573 HydrophobicContact SD-CB 4.35Å; M515-G575 VanDerWaalsContact CE-N 3.33Å; M515-I593 HydrophobicContact CE-CD1 4.41Å; M515-I593 HydrophobicContact CG-CD1 3.61Å; M515-I593 HydrophobicContact CG-CG1 4.21Å; M515-I593 HydrophobicContact CG-CG2 3.81Å
516	R	85.9	Confident	80.3	Confident	149 Å²	149	58.5 Å²	58.5	56%	0.562	30%	0.296	S	S	*	.	H	α-helix	trans	-59.9	-48.6	179.4	-169	-176.1	74	86.2	1	111.5	Y512 E513 A514 A520	Y512-R516 PolarHBondContact O-N 3.3Å; E513-R516 WeakPolarHBondContact O-CB 3.49Å; E513-R516 PolarHBondContact O-N 3.02Å; E513-R516 IonicContact OE1-CZ 2.88Å; E513-R516 IonicContact OE1-NE 3.45Å; E513-R516 PolarHBondContact OE1-NE 3.36Å; E513-R516 IonicContact OE1-NH2 3.3Å; E513-R516 PolarHBondContact OE1-NH2 3.05Å; E513-R516 IonicContact OE2-CZ 3.45Å; E513-R516 IonicContact OE2-NE 3.14Å; E513-R516 PolarHBondContact OE2-NE 2.99Å; E513-R516 IonicContact OE2-NH2 2.67Å; E513-R516 PolarHBondContact OE2-NH2 3.33Å; A514-R516 VanDerWaalsContact C-N 3.32Å; A514-R516 PolarHBondContact O-N 3.3Å; R516-A520 WeakPolarHBondContact O-CB 3.23Å; R516-A520 PolarHBondContact O-N 3.31Å
517	Q	83.1	Confident	79.6	Confident	58 Å²	58	53.6 Å²	53.6	27%	0.271	27%	0.274	S	S	.	.	H	α-helix	trans	-69.1	-41.5	-179.1	-67.9	-169.5	19.9	0	0	112.6	I442 M500 E513 A514 A520 A521	I442-Q517 HydrophobicContact CD1-CG 4.44Å; M500-Q517 HydrophobicContact CE-CB 4.15Å; M500-Q517 VanDerWaalsContact CE-OE1 3.32Å; M500-Q517 HydrophobicContact SD-CB 4.19Å; E513-Q517 WeakPolarHBondContact O-CG 3.33Å; E513-Q517 PolarHBondContact O-N 2.83Å; E513-Q517 PolarHBondContact OE1-NE2 3.45Å; A514-Q517 PolarHBondContact O-N 3.43Å; Q517-A520 PolarHBondContact O-N 2.97Å; Q517-A521 WeakPolarHBondContact O-CB 3.39Å; Q517-A521 PolarHBondContact O-N 2.88Å
518	V	84.5	Confident	78.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-48.3	175.7	170.6	0	0	0	0	110.5	I448 F450 L497 M500 A514 A521 R522 I593	I448-V518 HydrophobicContact CG2-CG2 3.97Å; F450-V518 HydrophobicContact CE1-CG1 4.46Å; L497-V518 HydrophobicContact CB-CG1 4.17Å; M500-V518 HydrophobicContact SD-CG2 4.08Å; A514-V518 VanDerWaalsContact O-CB 3.31Å; A514-V518 WeakPolarHBondContact O-CB 3.39Å; A514-V518 WeakPolarHBondContact O-CG2 3.1Å; A514-V518 PolarHBondContact O-N 3.04Å; V518-A521 PolarHBondContact O-N 3.39Å; V518-R522 VanDerWaalsContact O-CG 3.26Å; V518-R522 WeakPolarHBondContact O-CG 3.37Å; V518-R522 PolarHBondContact O-N 2.91Å; V518-I593 HydrophobicContact CG2-CG1 4.29Å
519	L	83.1	Confident	77.6	Confident	70 Å²	70	65.6 Å²	65.6	37%	0.366	31%	0.312	S	S	.	.	H	α-helix	trans	-65.5	-42.1	179.1	-69.3	173	0	0	0	112.1	L497 M515 R522 A523 L573	L497-L519 HydrophobicContact CD1-CD2 4.07Å; M515-L519 VanDerWaalsContact O-CB 3.29Å; M515-L519 WeakPolarHBondContact O-CB 3.33Å; M515-L519 WeakPolarHBondContact O-CG 3.38Å; M515-L519 PolarHBondContact O-N 3.29Å; L519-R522 PolarHBondContact O-N 3.24Å; L519-A523 WeakPolarHBondContact O-CB 3.33Å; L519-A523 PolarHBondContact O-N 2.83Å; L519-L573 HydrophobicContact CD1-CD1 3.75Å
520	A	74.4	Confident	77.1	Confident	39 Å²	39	63.4 Å²	63.4	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-61.7	-45.3	174.7	0	0	0	0	0	111.3	R516 Q517 R522 A523 I524	R516-A520 WeakPolarHBondContact O-CB 3.23Å; R516-A520 PolarHBondContact O-N 3.31Å; Q517-A520 PolarHBondContact O-N 2.97Å; A520-R522 PolarHBondContact O-N 2.86Å; A520-A523 WeakPolarHBondContact O-CB 3.12Å; A520-A523 PolarHBondContact O-N 2.97Å; A520-I524 HydrophobicContact CB-CD1 4.48Å; A520-I524 WeakPolarHBondContact O-CB 3.24Å; A520-I524 WeakPolarHBondContact O-CD1 3.29Å; A520-I524 WeakPolarHBondContact O-CG1 3.09Å; A520-I524 PolarHBondContact O-N 2.99Å
521	A	74.2	Confident	76.7	Confident	10 Å²	10	65 Å²	65	8%	0.083	31%	0.313	C	S	.	.	H	α-helix	trans	-64.3	-40.7	177.6	0	0	0	0	0	112	I448 F450 Q517 V518 A523 I524 H525	I448-A521 HydrophobicContact CD1-CB 3.4Å; F450-A521 HydrophobicContact CZ-CB 3.94Å; Q517-A521 WeakPolarHBondContact O-CB 3.39Å; Q517-A521 PolarHBondContact O-N 2.88Å; V518-A521 PolarHBondContact O-N 3.39Å; A521-A523 VanDerWaalsContact C-N 3.28Å; A521-A523 PolarHBondContact O-N 2.79Å; A521-I524 PolarHBondContact O-N 3.33Å; A521-H525 VanDerWaalsContact O-CB 3.28Å; A521-H525 WeakPolarHBondContact O-CB 3.43Å; A521-H525 PolarHBondContact O-CD2 3.42Å; A521-H525 PolarHBondContact O-N 2.72Å
522	R	80.2	Confident	76.5	Confident	21 Å²	21	68.6 Å²	68.6	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-38.2	173.1	-70.2	-178.3	76	83.7	11.2	112.1	F450 L497 V518 L519 A520 N526 I527 R529 M530	F450-R522 HydrophobicContact CD1-CG 3.91Å; F450-R522 HydrophobicContact CE1-CG 3.4Å; F450-R522 VanDerWaalsContact CE1-CG 3.4Å; F450-R522 HydrophobicContact CZ-CG 4.26Å; L497-R522 WeakPolarHBondContact O-CD 3.47Å; L497-R522 PolarHBondContact O-NH1 3.12Å; V518-R522 VanDerWaalsContact O-CG 3.26Å; V518-R522 WeakPolarHBondContact O-CG 3.37Å; V518-R522 PolarHBondContact O-N 2.91Å; L519-R522 PolarHBondContact O-N 3.24Å; A520-R522 PolarHBondContact O-N 2.86Å; R522-N526 WeakPolarHBondContact O-CA 3.33Å; R522-N526 PolarHBondContact O-N 2.59Å; R522-I527 HydrophobicContact CG-CB 4.46Å; R522-I527 PolarHBondContact NE-O 3.33Å; R522-I527 PolarHBondContact NH2-O 2.95Å; R522-I527 PolarHBondContact O-N 3.32Å; R522-R529 PolarHBondContact NH2-O 3.12Å; R522-M530 VanDerWaalsContact NH2-CG 3.3Å
523	A	63.8	Low	76.5	Confident	62 Å²	62	65.3 Å²	65.3	51%	0.512	32%	0.317	S	S	.	.	H	α-helix	trans	-70.9	-45.9	176.4	0	0	0	0	0	112.2	L519 A520 A521 H525 N526	L519-A523 WeakPolarHBondContact O-CB 3.33Å; L519-A523 PolarHBondContact O-N 2.83Å; A520-A523 WeakPolarHBondContact O-CB 3.12Å; A520-A523 PolarHBondContact O-N 2.97Å; A521-A523 VanDerWaalsContact C-N 3.28Å; A521-A523 PolarHBondContact O-N 2.79Å; A523-H525 PolarHBondContact O-N 3.44Å; A523-N526 PolarHBondContact O-N 2.96Å; A523-N526 PolarHBondContact O-OD1 3.23Å
524	I	60.7	Low	76.7	Confident	124 Å²	124	64.5 Å²	64.5	64%	0.636	31%	0.313	S	S	*	.	H	α-helix	trans	-63.8	-41.7	179.4	-69	163	0	0	0	111	A520 A521	A520-I524 HydrophobicContact CB-CD1 4.48Å; A520-I524 WeakPolarHBondContact O-CB 3.24Å; A520-I524 WeakPolarHBondContact O-CD1 3.29Å; A520-I524 WeakPolarHBondContact O-CG1 3.09Å; A520-I524 PolarHBondContact O-N 2.99Å; A521-I524 PolarHBondContact O-N 3.33Å
525	H	62.3	Low	77	Confident	127 Å²	127	64.5 Å²	64.5	59%	0.588	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	6.4	-177	-62.2	-68.2	0	0	0	113.8	A521 A523 I527	A521-H525 VanDerWaalsContact O-CB 3.28Å; A521-H525 WeakPolarHBondContact O-CB 3.43Å; A521-H525 PolarHBondContact O-CD2 3.42Å; A521-H525 PolarHBondContact O-N 2.72Å; A523-H525 PolarHBondContact O-N 3.44Å; H525-I527 VanDerWaalsContact C-N 3.33Å; H525-I527 HydrophobicContact CB-CD1 3.95Å; H525-I527 HydrophobicContact CB-CG1 3.93Å; H525-I527 PolarHBondContact O-N 2.89Å
526	N	55.7	Low	77	Confident	67 Å²	67	65.6 Å²	65.6	36%	0.358	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	44.3	177.3	-69.1	-50.7	0	0	0	114	R522 A523 F528	R522-N526 WeakPolarHBondContact O-CA 3.33Å; R522-N526 PolarHBondContact O-N 2.59Å; A523-N526 PolarHBondContact O-N 2.96Å; A523-N526 PolarHBondContact O-OD1 3.23Å; N526-F528 HydrophobicContact CB-CE2 3.78Å; N526-F528 HydrophobicContact CB-CZ 4.15Å; N526-F528 WeakPolarHBondContact O-CD2 3.14Å; N526-F528 VanDerWaalsContact O-CE2 3.31Å; N526-F528 WeakPolarHBondContact O-CE2 3.45Å; N526-F528 PolarHBondContact O-N 3.48Å
527	I	69.1	Low	77.1	Confident	48 Å²	48	58.5 Å²	58.5	25%	0.246	29%	0.292	C	S	.	.			trans	-90.6	97.9	-177.8	-55.8	177.3	0	0	0	109.3	F450 R522 H525	F450-I527 HydrophobicContact CB-CG2 4.49Å; F450-I527 HydrophobicContact CD1-CD1 4.08Å; F450-I527 HydrophobicContact CD2-CD1 3.25Å; F450-I527 HydrophobicContact CE1-CD1 4.1Å; F450-I527 HydrophobicContact CE2-CD1 3.24Å; F450-I527 HydrophobicContact CG-CD1 3.68Å; F450-I527 HydrophobicContact CG-CG2 4.41Å; F450-I527 HydrophobicContact CZ-CD1 3.68Å; R522-I527 HydrophobicContact CG-CB 4.46Å; R522-I527 PolarHBondContact NE-O 3.33Å; R522-I527 PolarHBondContact NH2-O 2.95Å; R522-I527 PolarHBondContact O-N 3.32Å; H525-I527 VanDerWaalsContact C-N 3.33Å; H525-I527 HydrophobicContact CB-CD1 3.95Å; H525-I527 HydrophobicContact CB-CG1 3.93Å; H525-I527 PolarHBondContact O-N 2.89Å
528	F	61.4	Low	77.3	Confident	150 Å²	150	56.1 Å²	56.1	66%	0.658	28%	0.282	S	S	*	.			trans	-94.5	-21.2	-177.6	-58.3	-72	0	0	0	114.2	N526 M530	N526-F528 HydrophobicContact CB-CE2 3.78Å; N526-F528 HydrophobicContact CB-CZ 4.15Å; N526-F528 WeakPolarHBondContact O-CD2 3.14Å; N526-F528 VanDerWaalsContact O-CE2 3.31Å; N526-F528 WeakPolarHBondContact O-CE2 3.45Å; N526-F528 PolarHBondContact O-N 3.48Å; F528-M530 PolarHBondContact O-N 3.31Å
529	R	70.9	Confident	77.2	Confident	205 Å²	205	56.3 Å²	56.3	77%	0.774	28%	0.283	S	S	*	.			trans	-71	124.9	179.2	-167	177.9	-177.3	-178.8	-0.4	109.4	R522	R522-R529 PolarHBondContact NH2-O 3.12Å
530	M	77.3	Confident	77.2	Confident	78 Å²	78	58.6 Å²	58.6	38%	0.384	29%	0.292	S	S	.	.			trans	-124.2	138.1	171.3	-64.2	-178	-73.1	0	0	107.9	R495 L497 R522 F528	R495-M530 HydrophobicContact CB-CB 4.14Å; R495-M530 HydrophobicContact CB-SD 4.46Å; L497-M530 HydrophobicContact CD2-CG 4.11Å; L497-M530 HydrophobicContact CD2-SD 3.36Å; L497-M530 WeakPolarHBondContact CD2-SD 3.48Å; R522-M530 VanDerWaalsContact NH2-CG 3.3Å; F528-M530 PolarHBondContact O-N 3.31Å
531	T	79.5	Confident	77.9	Confident	35 Å²	35	58 Å²	58	22%	0.215	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.8	-179.4	-40.5	0	0	0	0	109.7	R495 F496	R495-T531 WeakPolarHBondContact CA-O 3.17Å; F496-T531 PolarHBondContact N-O 2.86Å; F496-T531 VanDerWaalsContact N-O 3.15Å
532	E	87.8	Confident	78.7	Confident	74 Å²	74	57.5 Å²	57.5	35%	0.346	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	141.6	176.9	-166.7	168.2	94.6	0	0	110.5	I493 V494 R495	I493-E532 HydrophobicContact CG2-CG 3.57Å; V494-E532 CarbonylContact O-C 3.45Å; V494-E532 WeakPolarHBondContact O-CA 3.29Å; R495-E532 HydrophobicContact CG-CB 4.37Å; R495-E532 HydrophobicContact CG-CG 4.43Å; R495-E532 IonicContact CZ-OE2 3.12Å; R495-E532 IonicContact NE-OE2 2.83Å; R495-E532 PolarHBondContact NE-OE2 2.8Å; R495-E532 IonicContact NH2-OE2 3.33Å; R495-E532 PolarHBondContact NH2-OE2 2.83Å
533	S	89.7	Confident	79.2	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	150.6	179.9	-63.1	0	0	0	0	110	V494 I545 R553	V494-S533 PolarHBondContact N-O 2.9Å; V494-S533 PolarHBondContact O-N 2.89Å; V494-S533 VanDerWaalsContact O-O 3.13Å; S533-I545 WeakPolarHBondContact CA-O 3.21Å; S533-R553 PolarHBondContact OG-NH1 3.07Å
534	H	91.6	Very high	80.4	Confident	33 Å²	33	57.9 Å²	57.9	15%	0.153	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	111.6	169.3	-67.3	177.3	0	0	0	108.7	M491 F492 M536 I545	M491-H534 HydrophobicContact CG-CB 4.11Å; M491-H534 HydrophobicContact SD-CB 4Å; F492-H534 CarbonylContact O-C 3.52Å; F492-H534 WeakPolarHBondContact O-CA 3.32Å; H534-M536 PolarHBondContact O-N 2.85Å; H534-I545 HydrophobicContact CB-CB 4.28Å; H534-I545 PolarHBondContact N-O 3.49Å; H534-I545 PolarHBondContact O-N 3.03Å
535	L	92.1	Very high	81.7	Confident	1 Å²	1	53 Å²	53	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	108.2	171.6	178.1	64.5	0	0	0	109.1	M491 F492 V494 V537 L542 R543 L544 I603	M491-L535 WeakPolarHBondContact CA-O 3.48Å; F492-L535 HydrophobicContact CB-CB 4.46Å; F492-L535 PolarHBondContact N-O 2.83Å; F492-L535 PolarHBondContact O-N 3.01Å; V494-L535 HydrophobicContact CB-CB 4.49Å; V494-L535 HydrophobicContact CG1-CB 3.94Å; V494-L535 HydrophobicContact CG1-CD2 4.1Å; V494-L535 HydrophobicContact CG2-CB 3.71Å; L535-V537 HydrophobicContact CG-CG2 4.42Å; L535-L542 HydrophobicContact CD1-CB 4.46Å; L535-R543 CarbonylContact C-O 3.55Å; L535-R543 WeakPolarHBondContact CA-O 3.23Å; L535-L544 HydrophobicContact CB-CD2 3.98Å; L535-L544 HydrophobicContact CD1-CD2 3.82Å; L535-L544 HydrophobicContact CD1-CG 4.15Å; L535-L544 HydrophobicContact CG-CD2 4.49Å; L535-I603 HydrophobicContact CD2-CD1 4.48Å; L535-I603 HydrophobicContact CD2-CG2 3.84Å
536	M	90.1	Very high	82.7	Confident	23 Å²	23	47.8 Å²	47.8	11%	0.113	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.8	173.9	-175.9	-179.8	-67.8	0	0	109.9	Q489 Q490 H534 T538 R543 I545	Q489-M536 HydrophobicContact CG-CG 4.32Å; Q489-M536 HydrophobicContact CG-SD 4.28Å; Q489-M536 PolarHBondContact NE2-SD 3.49Å; Q490-M536 CarbonylContact O-C 3.5Å; Q490-M536 WeakPolarHBondContact O-CA 3.32Å; H534-M536 PolarHBondContact O-N 2.85Å; M536-T538 HydrophobicContact CG-CG2 4.01Å; M536-T538 HydrophobicContact SD-CG2 4.22Å; M536-R543 HydrophobicContact CB-CB 4.37Å; M536-R543 PolarHBondContact N-O 2.83Å; M536-R543 PolarHBondContact O-N 3.45Å; M536-R543 PolarHBondContact SD-NH2 3.49Å; M536-I545 HydrophobicContact CB-CD1 4.15Å; M536-I545 HydrophobicContact CE-CD1 3.68Å; M536-I545 HydrophobicContact SD-CD1 4.29Å
537	V	88.4	Confident	83.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.1	173.7	-174.2	0	0	0	0	108.5	Q489 Q490 F492 L535 L542 A606 I607	Q489-V537 WeakPolarHBondContact CA-O 3.35Å; Q490-V537 PolarHBondContact N-O 2.87Å; Q490-V537 PolarHBondContact O-N 2.93Å; F492-V537 HydrophobicContact CD2-CG2 4.1Å; F492-V537 HydrophobicContact CE2-CG2 3.94Å; L535-V537 HydrophobicContact CG-CG2 4.42Å; V537-L542 HydrophobicContact CB-CD2 4.02Å; V537-L542 HydrophobicContact CG1-CD2 3.73Å; V537-L542 HydrophobicContact CG2-CD2 3.78Å; V537-A606 HydrophobicContact CB-CB 4.26Å; V537-A606 HydrophobicContact CG1-CB 4.04Å; V537-A606 HydrophobicContact CG2-CB 4.3Å; V537-I607 HydrophobicContact CG1-CG1 4.32Å
538	T	86.4	Confident	84.3	Confident	9 Å²	9	52.9 Å²	52.9	6%	0.055	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	174.5	173.4	74.3	0	0	0	0	111.8	L488 M536 Q540 T541	L488-T538 WeakPolarHBondContact O-CA 3.4Å; M536-T538 HydrophobicContact CG-CG2 4.01Å; M536-T538 HydrophobicContact SD-CG2 4.22Å; T538-Q540 PolarHBondContact O-N 2.8Å; T538-Q540 VanDerWaalsContact O-N 3.11Å; T538-Q540 PolarHBondContact OG1-N 3.32Å; T538-T541 PolarHBondContact N-O 3.41Å; T538-T541 PolarHBondContact OG1-N 2.93Å; T538-T541 PolarHBondContact OG1-O 2.67Å; T538-T541 PolarHBondContact OG1-OG1 2.96Å
539	S	82.6	Confident	85.2	Confident	4 Å²	4	49.6 Å²	49.6	3%	0.028	24%	0.236	C	C	.	.	S	Bend	trans	-66.1	-4.6	173	64.2	0	0	0	0	114.2	S486 L488 I614	S486-S539 PolarHBondContact OG-N 3.48Å; S486-S539 PolarHBondContact OG-OG 3.37Å; L488-S539 PolarHBondContact O-N 3.09Å; S539-I614 VanDerWaalsContact O-CD1 3.28Å; S539-I614 WeakPolarHBondContact O-CD1 3.39Å; S539-I614 WeakPolarHBondContact O-CG1 3.26Å
540	Q	83.3	Confident	85.5	Confident	117 Å²	117	45.8 Å²	45.8	55%	0.547	23%	0.227	S	C	.	.	S	Bend	trans	-132.2	-27.1	-178.3	-64.4	-177	10.2	0	0	113.6	T538 L558	T538-Q540 PolarHBondContact O-N 2.8Å; T538-Q540 VanDerWaalsContact O-N 3.11Å; T538-Q540 PolarHBondContact OG1-N 3.32Å; Q540-L558 WeakPolarHBondContact O-CB 3.44Å; Q540-L558 PolarHBondContact O-N 3.48Å
541	T	89.6	Confident	85.6	Confident	27 Å²	27	46.2 Å²	46.2	17%	0.166	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	153.5	-168.6	62.2	0	0	0	0	113.3	T538 F556	T538-T541 PolarHBondContact N-O 3.41Å; T538-T541 PolarHBondContact OG1-N 2.93Å; T538-T541 PolarHBondContact OG1-O 2.67Å; T538-T541 PolarHBondContact OG1-OG1 2.96Å; T541-F556 CarbonylContact C-O 3.54Å; T541-F556 VanDerWaalsContact CA-O 3.25Å; T541-F556 WeakPolarHBondContact CA-O 3.21Å
542	L	90.4	Very high	85.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116	162.7	-61.1	-177.5	0	0	0	109	L535 V537 C555 F556 L558 V561 F576 I607	L535-L542 HydrophobicContact CD1-CB 4.46Å; V537-L542 HydrophobicContact CB-CD2 4.02Å; V537-L542 HydrophobicContact CG1-CD2 3.73Å; V537-L542 HydrophobicContact CG2-CD2 3.78Å; L542-C555 WeakPolarHBondContact O-CA 3.31Å; L542-F556 HydrophobicContact CB-CB 4.4Å; L542-F556 HydrophobicContact CB-CD2 4.45Å; L542-F556 PolarHBondContact N-O 2.79Å; L542-F556 PolarHBondContact O-N 3.26Å; L542-L558 HydrophobicContact CD1-CD1 4.31Å; L542-L558 HydrophobicContact CD2-CD1 3.91Å; L542-L558 HydrophobicContact CG-CD1 3.89Å; L542-V561 HydrophobicContact CD1-CG2 3.55Å; L542-V561 HydrophobicContact CG-CG2 4.34Å; L542-F576 HydrophobicContact CD1-CE1 4.47Å; L542-F576 HydrophobicContact CD1-CE2 4.43Å; L542-F576 HydrophobicContact CD1-CZ 4.37Å; L542-I607 HydrophobicContact CD1-CD1 4.24Å; L542-I607 HydrophobicContact CD1-CG1 4.44Å; L542-I607 HydrophobicContact CD2-CG1 4.05Å
543	R	89.7	Confident	85.1	Confident	90 Å²	90	47.7 Å²	47.7	34%	0.34	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.4	-178.6	-65.3	-173.5	-71	-166.5	-2.4	111.2	L535 M536 I545 A554 C555	L535-R543 CarbonylContact C-O 3.55Å; L535-R543 WeakPolarHBondContact CA-O 3.23Å; M536-R543 HydrophobicContact CB-CB 4.37Å; M536-R543 PolarHBondContact N-O 2.83Å; M536-R543 PolarHBondContact O-N 3.45Å; M536-R543 PolarHBondContact SD-NH2 3.49Å; R543-I545 HydrophobicContact CB-CG1 4.34Å; R543-A554 WeakPolarHBondContact CA-O 3.28Å; R543-C555 HydrophobicContact CG-CB 4.2Å
544	L	89.6	Confident	84.9	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	111.2	171.6	-74.7	167.5	0	0	0	109	I452 V494 L535 S552 R553 A554 F556 F594	I452-L544 HydrophobicContact CD1-CD1 3.33Å; I452-L544 HydrophobicContact CG1-CD1 4.46Å; V494-L544 HydrophobicContact CG2-CD2 3.7Å; L535-L544 HydrophobicContact CB-CD2 3.98Å; L535-L544 HydrophobicContact CD1-CD2 3.82Å; L535-L544 HydrophobicContact CD1-CG 4.15Å; L535-L544 HydrophobicContact CG-CD2 4.49Å; L544-S552 CarbonylContact O-C 3.48Å; L544-R553 PolarHBondContact O-N 2.93Å; L544-A554 HydrophobicContact CB-CB 4.41Å; L544-A554 HydrophobicContact CD1-CB 4.25Å; L544-A554 PolarHBondContact N-O 3.43Å; L544-F556 HydrophobicContact CD1-CE2 4.41Å; L544-F594 HydrophobicContact CD1-CE1 3.72Å; L544-F594 HydrophobicContact CD1-CZ 3.73Å; L544-F594 HydrophobicContact CD2-CE1 3.99Å; L544-F594 HydrophobicContact CD2-CZ 4.5Å
545	I	87.3	Confident	84.7	Confident	20 Å²	20	50.1 Å²	50.1	10%	0.103	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.9	-173.4	-55.2	170.2	0	0	0	109	S533 H534 M536 R543	S533-I545 WeakPolarHBondContact CA-O 3.21Å; H534-I545 HydrophobicContact CB-CB 4.28Å; H534-I545 PolarHBondContact N-O 3.49Å; H534-I545 PolarHBondContact O-N 3.03Å; M536-I545 HydrophobicContact CB-CD1 4.15Å; M536-I545 HydrophobicContact CE-CD1 3.68Å; M536-I545 HydrophobicContact SD-CD1 4.29Å; R543-I545 HydrophobicContact CB-CG1 4.34Å
546	D	84.7	Confident	84.6	Confident	19 Å²	19	51 Å²	51	10%	0.102	27%	0.265	C	S	.	.			trans	-67.3	123.1	172	-174.2	-65.2	0	0	0	110.2	Q548 T549 Q550 V551 R553	D546-Q548 PolarHBondContact O-N 2.89Å; D546-Q548 WeakPolarHBondContact OD1-CA 3.5Å; D546-Q548 WeakPolarHBondContact OD1-CB 3.33Å; D546-Q548 PolarHBondContact OD1-N 3.18Å; D546-T549 WeakPolarHBondContact CB-OG1 3.35Å; D546-T549 PolarHBondContact OD1-N 3.36Å; D546-T549 PolarHBondContact OD1-OG1 3.37Å; D546-Q550 VanDerWaalsContact O-CA 3.29Å; D546-Q550 WeakPolarHBondContact O-CA 3.41Å; D546-Q550 PolarHBondContact O-N 2.86Å; D546-V551 PolarHBondContact N-O 2.85Å; D546-R553 HydrophobicContact CB-CG 4.19Å; D546-R553 IonicContact OD2-CZ 3.48Å; D546-R553 IonicContact OD2-NE 3.48Å; D546-R553 PolarHBondContact OD2-NE 2.8Å; D546-R553 IonicContact OD2-NH2 2.67Å; D546-R553 PolarHBondContact OD2-NH2 3.49Å
547	P	81.4	Confident	84.5	Confident	41 Å²	41	56 Å²	56	27%	0.266	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-26.5	-175.3	25	-33.3	0	0	0	113.3	Q550	P547-Q550 PolarHBondContact O-NE2 3.37Å
548	Q	76.9	Confident	84.5	Confident	180 Å²	180	56 Å²	56	84%	0.841	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-42.6	-177.3	-62.2	-174.3	-11.3	0	0	112.4	D546	D546-Q548 PolarHBondContact O-N 2.89Å; D546-Q548 WeakPolarHBondContact OD1-CA 3.5Å; D546-Q548 WeakPolarHBondContact OD1-CB 3.33Å; D546-Q548 PolarHBondContact OD1-N 3.18Å
549	T	79.4	Confident	84.6	Confident	82 Å²	82	60 Å²	60	50%	0.503	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-11.9	-174.1	61.8	0	0	0	0	113.7	D546 V551	D546-T549 WeakPolarHBondContact CB-OG1 3.35Å; D546-T549 PolarHBondContact OD1-N 3.36Å; D546-T549 PolarHBondContact OD1-OG1 3.37Å; T549-V551 PolarHBondContact O-N 2.82Å; T549-V551 VanDerWaalsContact O-N 3.11Å
550	Q	77.8	Confident	84.9	Confident	125 Å²	125	61 Å²	61	58%	0.584	32%	0.32	S	S	*	.			trans	57.5	16	-172.4	-59.5	-63.2	-48.2	0	0	113.8	D546 P547	D546-Q550 VanDerWaalsContact O-CA 3.29Å; D546-Q550 WeakPolarHBondContact O-CA 3.41Å; D546-Q550 PolarHBondContact O-N 2.86Å; P547-Q550 PolarHBondContact O-NE2 3.37Å
551	V	78.6	Confident	85.3	Confident	87 Å²	87	55.4 Å²	55.4	53%	0.527	29%	0.294	S	S	.	.			trans	-84.4	134	176.9	178.1	0	0	0	0	109.7	D546 T549 R553	D546-V551 PolarHBondContact N-O 2.85Å; T549-V551 PolarHBondContact O-N 2.82Å; T549-V551 VanDerWaalsContact O-N 3.11Å; V551-R553 PolarHBondContact O-N 2.84Å
552	S	78.2	Confident	85.4	Confident	57 Å²	57	55.5 Å²	55.5	40%	0.399	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	116.7	171.9	-173.6	0	0	0	0	110.2	L544 A554	L544-S552 CarbonylContact O-C 3.48Å; S552-A554 PolarHBondContact OG-O 2.96Å
553	R	79.4	Confident	85.5	Confident	83 Å²	83	57.9 Å²	57.9	31%	0.313	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-31.5	179.1	-66.4	178	167.9	-168.5	-2.9	113.1	S533 L544 D546 V551	S533-R553 PolarHBondContact OG-NH1 3.07Å; L544-R553 PolarHBondContact O-N 2.93Å; D546-R553 HydrophobicContact CB-CG 4.19Å; D546-R553 IonicContact OD2-CZ 3.48Å; D546-R553 IonicContact OD2-NE 3.48Å; D546-R553 PolarHBondContact OD2-NE 2.8Å; D546-R553 IonicContact OD2-NH2 2.67Å; D546-R553 PolarHBondContact OD2-NH2 3.49Å; V551-R553 PolarHBondContact O-N 2.84Å
554	A	84.6	Confident	85.8	Confident	12 Å²	12	55.5 Å²	55.5	10%	0.099	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	144.8	173.4	0	0	0	0	0	109.4	I452 R543 L544 S552 F556	I452-A554 HydrophobicContact CG1-CB 4.38Å; R543-A554 WeakPolarHBondContact CA-O 3.28Å; L544-A554 HydrophobicContact CB-CB 4.41Å; L544-A554 HydrophobicContact CD1-CB 4.25Å; L544-A554 PolarHBondContact N-O 3.43Å; S552-A554 PolarHBondContact OG-O 2.96Å; A554-F556 HydrophobicContact CB-CE2 3.95Å; A554-F556 HydrophobicContact CB-CZ 3.89Å
555	C	87.6	Confident	86	Confident	74 Å²	74	55.8 Å²	55.8	50%	0.5	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	124.9	177.4	-178.5	0	0	0	0	108.5	L542 R543	L542-C555 WeakPolarHBondContact O-CA 3.31Å; R543-C555 HydrophobicContact CG-CB 4.2Å
556	F	89.9	Confident	86.3	Confident	19 Å²	19	55.5 Å²	55.5	8%	0.083	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.4	177.9	-50.5	-74	0	0	0	109.2	T541 L542 L544 A554 F576 I578 Y592	T541-F556 CarbonylContact C-O 3.54Å; T541-F556 VanDerWaalsContact CA-O 3.25Å; T541-F556 WeakPolarHBondContact CA-O 3.21Å; L542-F556 HydrophobicContact CB-CB 4.4Å; L542-F556 HydrophobicContact CB-CD2 4.45Å; L542-F556 PolarHBondContact N-O 2.79Å; L542-F556 PolarHBondContact O-N 3.26Å; L544-F556 HydrophobicContact CD1-CE2 4.41Å; A554-F556 HydrophobicContact CB-CE2 3.95Å; A554-F556 HydrophobicContact CB-CZ 3.89Å; F556-F576 HydrophobicContact CD2-CE2 4.26Å; F556-F576 HydrophobicContact CE2-CE2 4.3Å; F556-I578 HydrophobicContact CB-CD1 4.02Å; F556-I578 HydrophobicContact CD1-CD1 4.34Å; F556-I578 HydrophobicContact CD1-CG1 4.06Å; F556-I578 HydrophobicContact CD1-CG2 4.01Å; F556-I578 HydrophobicContact CE1-CG1 4.37Å; F556-I578 HydrophobicContact CG-CD1 4.07Å; F556-I578 HydrophobicContact CG-CG1 4.22Å; F556-Y592 HydrophobicContact CE1-CE2 4.25Å; F556-Y592 HydrophobicContact CZ-CD1 4.36Å; F556-Y592 AromaticContact CZ-CE1 3.94Å; F556-Y592 HydrophobicContact CZ-CE1 3.94Å; F556-Y592 HydrophobicContact CZ-CE2 4.26Å; F556-Y592 AromaticContact CZ-CZ 3.88Å
557	E	89.4	Confident	86.6	Confident	129 Å²	129	57 Å²	57	60%	0.603	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	138.7	170	-64	-170	170.5	0	0	109.7	T559 S560	E557-T559 WeakPolarHBondContact CB-OG1 3.28Å; E557-T559 PolarHBondContact O-N 2.87Å; E557-T559 PolarHBondContact OE2-OG1 3.49Å; E557-S560 WeakPolarHBondContact O-CB 3.19Å; E557-S560 PolarHBondContact O-N 2.81Å; E557-S560 PolarHBondContact O-OG 2.67Å
558	L	88.6	Confident	86.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-65.1	-27.2	-178.1	-164.5	66.5	0	0	0	112.2	Q540 L542 S560 V561 I607 K611 I614	Q540-L558 WeakPolarHBondContact O-CB 3.44Å; Q540-L558 PolarHBondContact O-N 3.48Å; L542-L558 HydrophobicContact CD1-CD1 4.31Å; L542-L558 HydrophobicContact CD2-CD1 3.91Å; L542-L558 HydrophobicContact CG-CD1 3.89Å; L558-S560 VanDerWaalsContact C-N 3.27Å; L558-S560 PolarHBondContact O-N 3.4Å; L558-V561 HydrophobicContact CD1-CG2 4.29Å; L558-V561 WeakPolarHBondContact O-CB 3.43Å; L558-V561 PolarHBondContact O-N 2.94Å; L558-I607 HydrophobicContact CD1-CG2 4.01Å; L558-K611 HydrophobicContact CD2-CG 4.17Å; L558-K611 HydrophobicContact CG-CG 4.08Å; L558-I614 HydrophobicContact CB-CD1 3.97Å; L558-I614 HydrophobicContact CD2-CD1 3.84Å; L558-I614 HydrophobicContact CG-CD1 4.26Å
559	T	87.6	Confident	86.8	Confident	93 Å²	93	60.1 Å²	60.1	57%	0.571	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-64.3	-28.1	171.7	47.8	0	0	0	0	113.1	E557 V561 I614	E557-T559 WeakPolarHBondContact CB-OG1 3.28Å; E557-T559 PolarHBondContact O-N 2.87Å; E557-T559 PolarHBondContact OE2-OG1 3.49Å; T559-V561 VanDerWaalsContact C-N 3.33Å; T559-I614 HydrophobicContact CG2-CD1 4.43Å
560	S	89.9	Confident	87.1	Confident	24 Å²	24	59.6 Å²	59.6	17%	0.168	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-80.4	-14.7	177.7	74.4	0	0	0	0	113.3	E557 L558 T562 I578 R579	E557-S560 WeakPolarHBondContact O-CB 3.19Å; E557-S560 PolarHBondContact O-N 2.81Å; E557-S560 PolarHBondContact O-OG 2.67Å; L558-S560 VanDerWaalsContact C-N 3.27Å; L558-S560 PolarHBondContact O-N 3.4Å; S560-T562 PolarHBondContact O-N 3.4Å; S560-I578 WeakPolarHBondContact O-CA 3.18Å; S560-R579 PolarHBondContact O-N 2.85Å
561	V	91.8	Very high	87.5	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	111.9	175	-175.3	0	0	0	0	108.1	L542 L558 T559 F564 F576 V577 I578 I607 K611	L542-V561 HydrophobicContact CD1-CG2 3.55Å; L542-V561 HydrophobicContact CG-CG2 4.34Å; L558-V561 HydrophobicContact CD1-CG2 4.29Å; L558-V561 WeakPolarHBondContact O-CB 3.43Å; L558-V561 PolarHBondContact O-N 2.94Å; T559-V561 VanDerWaalsContact C-N 3.33Å; V561-F564 HydrophobicContact CG1-CB 4.48Å; V561-F564 HydrophobicContact CG1-CD1 4.03Å; V561-F576 HydrophobicContact CG1-CB 4.07Å; V561-V577 CarbonylContact C-O 3.51Å; V561-V577 WeakPolarHBondContact CA-O 3.4Å; V561-I578 HydrophobicContact CB-CD1 4.25Å; V561-I578 HydrophobicContact CG2-CD1 3.55Å; V561-I607 HydrophobicContact CG1-CG2 4.45Å; V561-K611 WeakPolarHBondContact O-CE 3.38Å; V561-K611 PolarHBondContact O-NZ 2.89Å
562	T	91.1	Very high	88	Confident	28 Å²	28	59 Å²	59	17%	0.172	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-43.9	-176.2	52.7	0	0	0	0	111.4	D505 S560 V577 R579	D505-T562 VanDerWaalsContact CB-OG1 3.32Å; D505-T562 WeakPolarHBondContact CB-OG1 3.39Å; D505-T562 WeakPolarHBondContact OD2-CB 3.47Å; D505-T562 VanDerWaalsContact OD2-CG2 3.23Å; D505-T562 WeakPolarHBondContact OD2-CG2 3.44Å; D505-T562 PolarHBondContact OD2-OG1 3.13Å; S560-T562 PolarHBondContact O-N 3.4Å; T562-V577 PolarHBondContact N-O 3.24Å; T562-V577 WeakPolarHBondContact OG1-CG1 3.25Å; T562-V577 PolarHBondContact OG1-O 2.94Å; T562-R579 HydrophobicContact CG2-CB 3.91Å
563	Q	93.3	Very high	88.7	Confident	51 Å²	51	56.6 Å²	56.6	24%	0.238	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	151.5	176.3	-62.4	-64	-19.1	0	0	111.2	D505 I511 F576 V577	D505-Q563 WeakPolarHBondContact O-CG 3.41Å; D505-Q563 PolarHBondContact O-NE2 3.35Å; I511-Q563 HydrophobicContact CD1-CB 3.9Å; Q563-F576 CarbonylContact O-C 3.21Å; Q563-F576 VanDerWaalsContact O-CA 3.25Å; Q563-F576 WeakPolarHBondContact O-CA 3.42Å; Q563-F576 WeakPolarHBondContact O-CB 3.23Å; Q563-V577 HydrophobicContact CB-CB 4.22Å; Q563-V577 HydrophobicContact CB-CG2 3.93Å; Q563-V577 PolarHBondContact O-N 2.84Å
564	F	94.9	Very high	89.5	Confident	39 Å²	39	52.7 Å²	52.7	17%	0.171	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.1	172.4	53.3	-88	0	0	0	110	V561 G575 F576 C604 I607 N608 K611	V561-F564 HydrophobicContact CG1-CB 4.48Å; V561-F564 HydrophobicContact CG1-CD1 4.03Å; F564-G575 WeakPolarHBondContact CA-O 3.26Å; F564-F576 HydrophobicContact CB-CB 3.8Å; F564-C604 HydrophobicContact CD2-CB 3.87Å; F564-C604 HydrophobicContact CE2-CB 4.18Å; F564-C604 VanDerWaalsContact CE2-O 3.28Å; F564-C604 WeakPolarHBondContact CE2-O 3.37Å; F564-I607 HydrophobicContact CB-CD1 4.33Å; F564-I607 HydrophobicContact CD1-CB 4.49Å; F564-I607 HydrophobicContact CD1-CG2 3.48Å; F564-I607 VanDerWaalsContact CD1-CG2 3.48Å; F564-I607 HydrophobicContact CD2-CB 4.28Å; F564-I607 HydrophobicContact CD2-CG2 4.11Å; F564-I607 HydrophobicContact CE1-CG2 3.56Å; F564-I607 HydrophobicContact CE2-CB 4.31Å; F564-I607 HydrophobicContact CE2-CG2 4.17Å; F564-I607 HydrophobicContact CG-CB 4.37Å; F564-I607 HydrophobicContact CG-CD1 4.46Å; F564-I607 HydrophobicContact CG-CG2 3.78Å; F564-I607 HydrophobicContact CZ-CB 4.43Å; F564-I607 HydrophobicContact CZ-CG2 3.91Å; F564-N608 HydrophobicContact CE2-CB 4.06Å; F564-N608 HydrophobicContact CZ-CB 3.82Å; F564-K611 HydrophobicContact CE1-CD 4.13Å
565	A	94.5	Very high	89.9	Confident	7 Å²	7	52.1 Å²	52.1	6%	0.058	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	145.4	-177	0	0	0	0	0	111.8	T508 I511 Y512 V574 G575 C604	T508-A565 HydrophobicContact CG2-CB 4.34Å; I511-A565 HydrophobicContact CB-CB 4.42Å; I511-A565 HydrophobicContact CD1-CB 3.87Å; I511-A565 HydrophobicContact CG2-CB 4.27Å; Y512-A565 HydrophobicContact CE1-CB 4.1Å; A565-V574 WeakPolarHBondContact O-CA 3.25Å; A565-G575 PolarHBondContact N-O 2.75Å; A565-G575 PolarHBondContact O-N 3.14Å; A565-C604 VanDerWaalsContact C-SG 3.55Å
566	A	92.4	Very high	90.3	Very high	14 Å²	14	48.6 Å²	48.6	12%	0.116	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	147	167	0	0	0	0	0	109.1	Y512 L573 E601 C604	Y512-A566 PolarHBondContact OH-O 2.97Å; A566-L573 WeakPolarHBondContact CA-O 3.32Å; A566-E601 HydrophobicContact CB-CG 4Å; A566-C604 PolarHBondContact N-SG 2.86Å; A566-C604 VanDerWaalsContact N-SG 3.43Å
567	H	91	Very high	90.5	Very high	52 Å²	52	47.7 Å²	47.7	24%	0.241	23%	0.234	C	C	.	.			trans	-72.3	135	179.8	-169.3	-64.6	0	0	0	110.8	M515 E569 N570 L573	M515-H567 HydrophobicContact SD-CB 3.99Å; H567-E569 PolarHBondContact ND1-N 2.98Å; H567-E569 VanDerWaalsContact ND1-N 3.15Å; H567-E569 PolarHBondContact O-N 3.06Å; H567-N570 WeakPolarHBondContact CB-O 3.34Å; H567-N570 PolarHBondContact ND1-N 2.74Å; H567-L573 HydrophobicContact CB-CB 3.67Å; H567-L573 HydrophobicContact CB-CD1 4.37Å; H567-L573 PolarHBondContact N-O 3.03Å
568	Q	82.4	Confident	90.6	Very high	148 Å²	148	41.6 Å²	41.6	69%	0.692	21%	0.205	S	C	*	.	S	Bend	trans	-63.7	-44.2	-173.2	-63.4	-179.6	5	0	0	113.2
569	E	81.4	Confident	90.6	Very high	138 Å²	138	46.2 Å²	46.2	65%	0.645	22%	0.223	S	C	*	.	S	Bend	trans	-89.1	-48	-179.4	-60.4	175.9	-170.3	0	0	113.1	N72 H567 K571	N72-E569 PolarHBondContact ND2-OE1 3.17Å; H567-E569 PolarHBondContact ND1-N 2.98Å; H567-E569 VanDerWaalsContact ND1-N 3.15Å; H567-E569 PolarHBondContact O-N 3.06Å; E569-K571 PolarHBondContact O-N 3.28Å
570	N	85.6	Confident	90.3	Very high	71 Å²	71	44.8 Å²	44.8	38%	0.38	21%	0.211	S	C	.	.			trans	-90.4	89.1	176.2	-172.3	-14.8	0	0	0	110.9	H567 R572 L573	H567-N570 WeakPolarHBondContact CB-O 3.34Å; H567-N570 PolarHBondContact ND1-N 2.74Å; N570-R572 PolarHBondContact O-N 3.38Å; N570-R572 WeakPolarHBondContact OD1-CB 3.3Å; N570-R572 PolarHBondContact OD1-N 3Å; N570-R572 VanDerWaalsContact OD1-N 3.11Å; N570-L573 HydrophobicContact CB-CD1 3.88Å; N570-L573 HydrophobicContact CB-CG 4.12Å; N570-L573 PolarHBondContact O-N 3.35Å
571	K	84.8	Confident	89.4	Confident	106 Å²	106	49.3 Å²	49.3	46%	0.461	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-14.5	179.4	-66.9	-172.2	165.7	-165	0	115.1	E569 E599 G600	E569-K571 PolarHBondContact O-N 3.28Å; K571-E599 HydrophobicContact CB-CG 4.43Å; K571-E599 HydrophobicContact CD-CG 4.26Å; K571-E599 WeakPolarHBondContact CD-OE1 3.36Å; K571-E599 IonicContact NZ-OE1 3.43Å; K571-E599 PolarHBondContact NZ-OE1 3.09Å; K571-E599 CarbonylContact O-C 3.52Å; K571-E599 WeakPolarHBondContact O-CA 3.46Å; K571-G600 PolarHBondContact O-N 3.22Å
572	R	90	Very high	88.3	Confident	94 Å²	94	53.9 Å²	53.9	36%	0.355	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-12.6	179.1	-63.8	-176.9	64.3	-151	-17.1	113.1	N570 E595 S596	N570-R572 PolarHBondContact O-N 3.38Å; N570-R572 WeakPolarHBondContact OD1-CB 3.3Å; N570-R572 PolarHBondContact OD1-N 3Å; N570-R572 VanDerWaalsContact OD1-N 3.11Å; R572-E595 HydrophobicContact CB-CG 4.23Å; R572-E595 IonicContact CZ-OE1 3.56Å; R572-E595 IonicContact NH1-OE1 3.83Å; R572-E595 PolarHBondContact NH1-OE1 3.07Å; R572-E595 IonicContact NH2-OE1 3.45Å; R572-E595 PolarHBondContact NH2-OE1 3.32Å; R572-E595 VanDerWaalsContact NH2-OE1 3.14Å; R572-E595 IonicContact NH2-OE2 2.77Å; R572-E595 PolarHBondContact NH2-OE2 2.76Å; R572-E595 CarbonylContact O-C 3.52Å; R572-E595 WeakPolarHBondContact O-CA 3.39Å; R572-S596 PolarHBondContact NE-O 3.49Å; R572-S596 PolarHBondContact NH2-O 3.48Å; R572-S596 PolarHBondContact O-N 2.93Å
573	L	92.6	Very high	86.7	Confident	6 Å²	6	59 Å²	59	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.9	179	-68.1	175.3	0	0	0	111.3	L497 M515 L519 A566 H567 N570	L497-L573 HydrophobicContact CD1-CD2 3.36Å; M515-L573 HydrophobicContact CE-CB 4.27Å; M515-L573 HydrophobicContact SD-CB 4.35Å; L519-L573 HydrophobicContact CD1-CD1 3.75Å; A566-L573 WeakPolarHBondContact CA-O 3.32Å; H567-L573 HydrophobicContact CB-CB 3.67Å; H567-L573 HydrophobicContact CB-CD1 4.37Å; H567-L573 PolarHBondContact N-O 3.03Å; N570-L573 HydrophobicContact CB-CD1 3.88Å; N570-L573 HydrophobicContact CB-CG 4.12Å; N570-L573 PolarHBondContact O-N 3.35Å
574	V	95.8	Very high	85	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	145.9	176.3	64.3	0	0	0	0	109.6	A565 F594 I603	A565-V574 WeakPolarHBondContact O-CA 3.25Å; V574-F594 HydrophobicContact CG1-CB 4.03Å; V574-F594 PolarHBondContact N-O 3.29Å; V574-F594 PolarHBondContact O-N 3.33Å; V574-I603 HydrophobicContact CG1-CD1 3.94Å; V574-I603 HydrophobicContact CG2-CB 4.38Å; V574-I603 HydrophobicContact CG2-CG2 4.3Å
575	G	94.4	Very high	83.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	158	174.7	0	0	0	0	0	112.2	M515 F564 A565 Y592	M515-G575 VanDerWaalsContact CE-N 3.33Å; F564-G575 WeakPolarHBondContact CA-O 3.26Å; A565-G575 PolarHBondContact N-O 2.75Å; A565-G575 PolarHBondContact O-N 3.14Å; G575-Y592 WeakPolarHBondContact CA-O 3.34Å
576	F	95.1	Very high	81.4	Confident	1 Å²	1	69.9 Å²	69.9	0%	0.004	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	149.2	176.5	52.1	-100.6	0	0	0	111.3	L542 F556 V561 Q563 F564 I578 T591 Y592 F594	L542-F576 HydrophobicContact CD1-CE1 4.47Å; L542-F576 HydrophobicContact CD1-CE2 4.43Å; L542-F576 HydrophobicContact CD1-CZ 4.37Å; F556-F576 HydrophobicContact CD2-CE2 4.26Å; F556-F576 HydrophobicContact CE2-CE2 4.3Å; V561-F576 HydrophobicContact CG1-CB 4.07Å; Q563-F576 CarbonylContact O-C 3.21Å; Q563-F576 VanDerWaalsContact O-CA 3.25Å; Q563-F576 WeakPolarHBondContact O-CA 3.42Å; Q563-F576 WeakPolarHBondContact O-CB 3.23Å; F564-F576 HydrophobicContact CB-CB 3.8Å; F576-I578 HydrophobicContact CD2-CD1 3.53Å; F576-I578 HydrophobicContact CD2-CG1 3.79Å; F576-I578 HydrophobicContact CE2-CD1 3.76Å; F576-I578 HydrophobicContact CE2-CG1 3.89Å; F576-T591 WeakPolarHBondContact O-CA 3.32Å; F576-Y592 HydrophobicContact CE2-CD2 4.29Å; F576-Y592 HydrophobicContact CE2-CG 4.29Å; F576-Y592 PolarHBondContact N-O 3.24Å; F576-Y592 VanDerWaalsContact N-O 3.09Å; F576-Y592 PolarHBondContact O-N 2.93Å; F576-F594 HydrophobicContact CD1-CE2 4.33Å; F576-F594 AromaticContact CE1-CD2 3.85Å; F576-F594 HydrophobicContact CE1-CD2 3.85Å; F576-F594 AromaticContact CE1-CE2 3.41Å; F576-F594 HydrophobicContact CE1-CE2 3.41Å; F576-F594 VanDerWaalsContact CE1-CE2 3.41Å; F576-F594 HydrophobicContact CE1-CZ 4.32Å; F576-F594 HydrophobicContact CE2-CE2 4.28Å; F576-F594 HydrophobicContact CZ-CD2 4.29Å; F576-F594 AromaticContact CZ-CE2 3.39Å; F576-F594 HydrophobicContact CZ-CE2 3.39Å; F576-F594 AromaticContact CZ-CZ 3.97Å; F576-F594 HydrophobicContact CZ-CZ 3.97Å
577	V	93.9	Very high	80.5	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	126.6	177.8	-173.9	0	0	0	0	108.3	V502 D505 I511 V561 T562 Q563 L589 T591	V502-V577 HydrophobicContact CG2-CG1 4.07Å; D505-V577 HydrophobicContact CB-CG1 4.17Å; I511-V577 HydrophobicContact CD1-CG2 4.1Å; I511-V577 HydrophobicContact CG1-CG2 3.69Å; V561-V577 CarbonylContact C-O 3.51Å; V561-V577 WeakPolarHBondContact CA-O 3.4Å; T562-V577 PolarHBondContact N-O 3.24Å; T562-V577 WeakPolarHBondContact OG1-CG1 3.25Å; T562-V577 PolarHBondContact OG1-O 2.94Å; Q563-V577 HydrophobicContact CB-CB 4.22Å; Q563-V577 HydrophobicContact CB-CG2 3.93Å; Q563-V577 PolarHBondContact O-N 2.84Å; V577-L589 HydrophobicContact CG1-CB 4.38Å; V577-L589 HydrophobicContact CG1-CD2 4.3Å; V577-T591 HydrophobicContact CG2-CG2 4.44Å
578	I	91.4	Very high	80.1	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.005	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.3	175	-55.5	-60.2	0	0	0	108.9	F556 S560 V561 F576 L580 L589 S590 Y592	F556-I578 HydrophobicContact CB-CD1 4.02Å; F556-I578 HydrophobicContact CD1-CD1 4.34Å; F556-I578 HydrophobicContact CD1-CG1 4.06Å; F556-I578 HydrophobicContact CD1-CG2 4.01Å; F556-I578 HydrophobicContact CE1-CG1 4.37Å; F556-I578 HydrophobicContact CG-CD1 4.07Å; F556-I578 HydrophobicContact CG-CG1 4.22Å; S560-I578 WeakPolarHBondContact O-CA 3.18Å; V561-I578 HydrophobicContact CB-CD1 4.25Å; V561-I578 HydrophobicContact CG2-CD1 3.55Å; F576-I578 HydrophobicContact CD2-CD1 3.53Å; F576-I578 HydrophobicContact CD2-CG1 3.79Å; F576-I578 HydrophobicContact CE2-CD1 3.76Å; F576-I578 HydrophobicContact CE2-CG1 3.89Å; I578-L580 HydrophobicContact CG2-CD1 4.22Å; I578-L580 HydrophobicContact CG2-CG 3.95Å; I578-L589 WeakPolarHBondContact O-CA 3.46Å; I578-S590 PolarHBondContact N-O 2.92Å; I578-S590 PolarHBondContact O-N 3.16Å; I578-Y592 HydrophobicContact CB-CD2 4.4Å; I578-Y592 HydrophobicContact CB-CE2 4.05Å; I578-Y592 HydrophobicContact CG1-CD2 3.8Å; I578-Y592 HydrophobicContact CG1-CE2 3.81Å
579	R	88.7	Confident	80.5	Confident	96 Å²	96	68.1 Å²	68.1	36%	0.362	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115.6	169	-173.3	-174.9	-66	-179.2	4.7	110.2	D505 S560 T562 E587 L589	D505-R579 IonicContact OD1-NH2 3.3Å; D505-R579 IonicContact OD2-CZ 3.94Å; D505-R579 IonicContact OD2-NE 3.76Å; D505-R579 PolarHBondContact OD2-NE 3.17Å; D505-R579 IonicContact OD2-NH2 3.88Å; D505-R579 PolarHBondContact OD2-NH2 3.38Å; S560-R579 PolarHBondContact O-N 2.85Å; T562-R579 HydrophobicContact CG2-CB 3.91Å; R579-E587 VanDerWaalsContact CD-OE2 3.32Å; R579-E587 WeakPolarHBondContact CD-OE2 3.28Å; R579-E587 HydrophobicContact CG-CB 4.28Å; R579-E587 IonicContact CZ-OE2 3.67Å; R579-E587 IonicContact NE-OE2 3.55Å; R579-E587 IonicContact NH1-OE2 3.13Å; R579-L589 HydrophobicContact CB-CD2 3.75Å; R579-L589 HydrophobicContact CG-CD2 3.88Å
580	L	81.2	Confident	80.9	Confident	64 Å²	64	62.6 Å²	62.6	34%	0.335	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.3	-179.4	-76.2	145.7	0	0	0	110	I578 E582 S588	I578-L580 HydrophobicContact CG2-CD1 4.22Å; I578-L580 HydrophobicContact CG2-CG 3.95Å; L580-E582 PolarHBondContact O-N 2.91Å; L580-S588 WeakPolarHBondContact CB-OG 3.44Å; L580-S588 PolarHBondContact N-O 3.01Å; L580-S588 PolarHBondContact O-N 2.95Å; L580-S588 PolarHBondContact O-OG 3Å
581	P	71.1	Confident	81.2	Confident	119 Å²	119	59.2 Å²	59.2	77%	0.773	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	122.8	173.1	27.6	-30.5	0	0	0	110.6
582	E	69.6	Low	81.6	Confident	97 Å²	97	55.5 Å²	55.5	45%	0.453	31%	0.31	S	S	.	.			trans	-89	154.2	172	-64.3	-167.6	159.4	0	0	112.4	L580 T584 G585 E586 S588	L580-E582 PolarHBondContact O-N 2.91Å; E582-T584 PolarHBondContact O-N 2.85Å; E582-T584 PolarHBondContact OE2-OG1 2.89Å; E582-G585 PolarHBondContact O-N 3.35Å; E582-E586 VanDerWaalsContact CB-O 3.31Å; E582-E586 WeakPolarHBondContact CB-O 3.1Å; E582-E586 PolarHBondContact N-O 2.9Å; E582-S588 WeakPolarHBondContact OE1-CB 3.23Å
583	S	56.1	Low	81.8	Confident	136 Å²	136	51 Å²	51	95%	0.951	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-12.6	178.4	52.9	0	0	0	0	114.9
584	T	58.2	Low	81.9	Confident	103 Å²	103	50.8 Å²	50.8	63%	0.632	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-8.4	-178.5	46.7	0	0	0	0	113.5	E582	E582-T584 PolarHBondContact O-N 2.85Å; E582-T584 PolarHBondContact OE2-OG1 2.89Å
585	G	55	Low	81.8	Confident	73 Å²	73	52.5 Å²	52.5	75%	0.753	30%	0.3	S	S	*	.	S	Bend	trans	88.7	1.3	-177.1	0	0	0	0	0	114.9	E582	E582-G585 PolarHBondContact O-N 3.35Å
586	E	59.6	Low	81.6	Confident	148 Å²	148	52.5 Å²	52.5	69%	0.692	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-92.5	142	167.3	-68.5	-172	162.4	0	0	110.1	E582	E582-E586 VanDerWaalsContact CB-O 3.31Å; E582-E586 WeakPolarHBondContact CB-O 3.1Å; E582-E586 PolarHBondContact N-O 2.9Å
587	E	73.4	Confident	81.2	Confident	129 Å²	129	56.5 Å²	56.5	60%	0.603	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.5	175.2	-64.8	-176.8	158.7	0	0	109	R579	R579-E587 VanDerWaalsContact CD-OE2 3.32Å; R579-E587 WeakPolarHBondContact CD-OE2 3.28Å; R579-E587 HydrophobicContact CG-CB 4.28Å; R579-E587 IonicContact CZ-OE2 3.67Å; R579-E587 IonicContact NE-OE2 3.55Å; R579-E587 IonicContact NH1-OE2 3.13Å
588	S	82.6	Confident	80.6	Confident	27 Å²	27	58 Å²	58	19%	0.189	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.8	175.5	64.9	0	0	0	0	110.4	L580 E582	L580-S588 WeakPolarHBondContact CB-OG 3.44Å; L580-S588 PolarHBondContact N-O 3.01Å; L580-S588 PolarHBondContact O-N 2.95Å; L580-S588 PolarHBondContact O-OG 3Å; E582-S588 WeakPolarHBondContact OE1-CB 3.23Å
589	L	89.3	Confident	80.3	Confident	22 Å²	22	61.3 Å²	61.3	12%	0.115	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.8	175.2	-64.4	170.3	0	0	0	108.9	A501 V502 D505 V577 I578 R579	A501-L589 CarbonylContact C-O 3.54Å; A501-L589 VanDerWaalsContact CA-O 3.29Å; A501-L589 WeakPolarHBondContact CA-O 3.49Å; V502-L589 HydrophobicContact CG2-CB 3.66Å; V502-L589 PolarHBondContact N-O 3.42Å; D505-L589 HydrophobicContact CB-CD1 3.99Å; D505-L589 HydrophobicContact CB-CD2 4.09Å; V577-L589 HydrophobicContact CG1-CB 4.38Å; V577-L589 HydrophobicContact CG1-CD2 4.3Å; I578-L589 WeakPolarHBondContact O-CA 3.46Å; R579-L589 HydrophobicContact CB-CD2 3.75Å; R579-L589 HydrophobicContact CG-CD2 3.88Å
590	S	89.7	Confident	80.1	Confident	22 Å²	22	56.8 Å²	56.8	15%	0.154	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.6	177.4	-70.8	0	0	0	0	110.7	M500 I578	M500-S590 WeakPolarHBondContact O-CA 3.48Å; I578-S590 PolarHBondContact N-O 2.92Å; I578-S590 PolarHBondContact O-N 3.16Å
591	T	92.1	Very high	80.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.1	174.5	-58.1	0	0	0	0	109.8	S499 M500 V502 I511 A514 F576 V577 I593	S499-T591 WeakPolarHBondContact CA-O 3.39Å; S499-T591 WeakPolarHBondContact CB-O 3.29Å; M500-T591 PolarHBondContact N-O 3.04Å; M500-T591 PolarHBondContact O-N 3.27Å; V502-T591 WeakPolarHBondContact CG1-OG1 3.39Å; I511-T591 HydrophobicContact CG1-CG2 4.23Å; A514-T591 HydrophobicContact CB-CG2 3.79Å; F576-T591 WeakPolarHBondContact O-CA 3.32Å; V577-T591 HydrophobicContact CG2-CG2 4.44Å; T591-I593 HydrophobicContact CG2-CD1 3.6Å; T591-I593 HydrophobicContact CG2-CG1 4.4Å
592	Y	93.3	Very high	81.1	Confident	27 Å²	27	56.4 Å²	56.4	11%	0.106	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.5	177.7	-65.5	-101.3	0	0	0	109.9	I452 F496 F556 G575 F576 I578	I452-Y592 HydrophobicContact CD1-CD1 4.24Å; I452-Y592 HydrophobicContact CD1-CE1 4.49Å; F496-Y592 AromaticContact CE2-CD1 3.91Å; F496-Y592 HydrophobicContact CE2-CD1 3.91Å; F496-Y592 HydrophobicContact CZ-CD1 4.43Å; F556-Y592 HydrophobicContact CE1-CE2 4.25Å; F556-Y592 HydrophobicContact CZ-CD1 4.36Å; F556-Y592 AromaticContact CZ-CE1 3.94Å; F556-Y592 HydrophobicContact CZ-CE1 3.94Å; F556-Y592 HydrophobicContact CZ-CE2 4.26Å; F556-Y592 AromaticContact CZ-CZ 3.88Å; G575-Y592 WeakPolarHBondContact CA-O 3.34Å; F576-Y592 HydrophobicContact CE2-CD2 4.29Å; F576-Y592 HydrophobicContact CE2-CG 4.29Å; F576-Y592 PolarHBondContact N-O 3.24Å; F576-Y592 VanDerWaalsContact N-O 3.09Å; F576-Y592 PolarHBondContact O-N 2.93Å; I578-Y592 HydrophobicContact CB-CD2 4.4Å; I578-Y592 HydrophobicContact CB-CE2 4.05Å; I578-Y592 HydrophobicContact CG1-CD2 3.8Å; I578-Y592 HydrophobicContact CG1-CE2 3.81Å
593	I	94.5	Very high	82	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133.8	-175.2	-53	-55.5	0	0	0	110.5	L497 G498 I511 A514 M515 V518 T591	L497-I593 HydrophobicContact CB-CB 4.45Å; L497-I593 HydrophobicContact CB-CG2 4.19Å; L497-I593 WeakPolarHBondContact CB-O 3.37Å; L497-I593 HydrophobicContact CD1-CG2 4.04Å; L497-I593 PolarHBondContact N-O 2.98Å; G498-I593 PolarHBondContact N-O 2.89Å; G498-I593 PolarHBondContact O-N 3.26Å; I511-I593 HydrophobicContact CG2-CD1 4.12Å; A514-I593 HydrophobicContact CB-CD1 4.33Å; M515-I593 HydrophobicContact CE-CD1 4.41Å; M515-I593 HydrophobicContact CG-CD1 3.61Å; M515-I593 HydrophobicContact CG-CG1 4.21Å; M515-I593 HydrophobicContact CG-CG2 3.81Å; V518-I593 HydrophobicContact CG2-CG1 4.29Å; T591-I593 HydrophobicContact CG2-CD1 3.6Å; T591-I593 HydrophobicContact CG2-CG1 4.4Å
594	F	94.6	Very high	83.7	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151.6	-177.5	-57.8	-93.7	0	0	0	112.3	I452 V494 R495 F496 L544 V574 F576	I452-F594 HydrophobicContact CD1-CE1 4.24Å; I452-F594 HydrophobicContact CD1-CZ 4.14Å; V494-F594 HydrophobicContact CB-CB 4.19Å; V494-F594 HydrophobicContact CB-CD1 4.19Å; V494-F594 HydrophobicContact CB-CG 4.48Å; V494-F594 HydrophobicContact CG2-CD1 3.84Å; V494-F594 HydrophobicContact CG2-CE1 4.4Å; V494-F594 HydrophobicContact CG2-CG 4.49Å; R495-F594 CarbonylContact O-C 3.25Å; R495-F594 VanDerWaalsContact O-CA 3.27Å; R495-F594 WeakPolarHBondContact O-CA 3.49Å; F496-F594 HydrophobicContact CB-CD1 4.14Å; F496-F594 HydrophobicContact CB-CE1 4.01Å; F496-F594 HydrophobicContact CD2-CD1 4.05Å; F496-F594 AromaticContact CD2-CE1 3.53Å; F496-F594 HydrophobicContact CD2-CE1 3.53Å; F496-F594 AromaticContact CD2-CZ 3.8Å; F496-F594 HydrophobicContact CD2-CZ 3.8Å; F496-F594 HydrophobicContact CE2-CE1 4.48Å; F496-F594 HydrophobicContact CE2-CZ 4.34Å; F496-F594 HydrophobicContact CG-CE1 4.22Å; L544-F594 HydrophobicContact CD1-CE1 3.72Å; L544-F594 HydrophobicContact CD1-CZ 3.73Å; L544-F594 HydrophobicContact CD2-CE1 3.99Å; L544-F594 HydrophobicContact CD2-CZ 4.5Å; V574-F594 HydrophobicContact CG1-CB 4.03Å; V574-F594 PolarHBondContact N-O 3.29Å; V574-F594 PolarHBondContact O-N 3.33Å; F576-F594 HydrophobicContact CD1-CE2 4.33Å; F576-F594 AromaticContact CE1-CD2 3.85Å; F576-F594 HydrophobicContact CE1-CD2 3.85Å; F576-F594 AromaticContact CE1-CE2 3.41Å; F576-F594 HydrophobicContact CE1-CE2 3.41Å; F576-F594 VanDerWaalsContact CE1-CE2 3.41Å; F576-F594 HydrophobicContact CE1-CZ 4.32Å; F576-F594 HydrophobicContact CE2-CE2 4.28Å; F576-F594 HydrophobicContact CZ-CD2 4.29Å; F576-F594 AromaticContact CZ-CE2 3.39Å; F576-F594 HydrophobicContact CZ-CE2 3.39Å; F576-F594 AromaticContact CZ-CZ 3.97Å; F576-F594 HydrophobicContact CZ-CZ 3.97Å
595	E	93.4	Very high	85.1	Confident	36 Å²	36	45.2 Å²	45.2	17%	0.168	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	119.2	162.8	-172.1	-159.8	-144.4	0	0	109.1	V494 R495 L497 R572	V494-E595 CarbonylContact C-O 3.51Å; V494-E595 WeakPolarHBondContact CA-O 3.2Å; R495-E595 HydrophobicContact CB-CB 4.33Å; R495-E595 PolarHBondContact N-O 2.93Å; R495-E595 IonicContact NH1-OE2 3.79Å; R495-E595 PolarHBondContact NH1-OE2 3.48Å; R495-E595 PolarHBondContact O-N 3.46Å; L497-E595 HydrophobicContact CD1-CB 4.07Å; L497-E595 HydrophobicContact CD2-CB 4.2Å; L497-E595 HydrophobicContact CG-CB 4.21Å; R572-E595 HydrophobicContact CB-CG 4.23Å; R572-E595 IonicContact CZ-OE1 3.56Å; R572-E595 IonicContact NH1-OE1 3.83Å; R572-E595 PolarHBondContact NH1-OE1 3.07Å; R572-E595 IonicContact NH2-OE1 3.45Å; R572-E595 PolarHBondContact NH2-OE1 3.32Å; R572-E595 VanDerWaalsContact NH2-OE1 3.14Å; R572-E595 IonicContact NH2-OE2 2.77Å; R572-E595 PolarHBondContact NH2-OE2 2.76Å; R572-E595 CarbonylContact O-C 3.52Å; R572-E595 WeakPolarHBondContact O-CA 3.39Å
596	S	91.6	Very high	86.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	154	174.5	-172.6	0	0	0	0	112	R572 S598 I603	R572-S596 PolarHBondContact NE-O 3.49Å; R572-S596 PolarHBondContact NH2-O 3.48Å; R572-S596 PolarHBondContact O-N 2.93Å; S596-S598 VanDerWaalsContact C-N 3.33Å; S596-S598 WeakPolarHBondContact CB-O 3.2Å; S596-S598 PolarHBondContact OG-N 3.04Å; S596-S598 PolarHBondContact OG-O 2.93Å; S596-S598 PolarHBondContact OG-OG 3.23Å; S596-I603 WeakPolarHBondContact OG-CD1 3.42Å
597	N	85.3	Confident	88.1	Confident	85 Å²	85	34.7 Å²	34.7	46%	0.455	17%	0.171	S	C	.	.	S	Bend	trans	-79.1	-18.8	165.1	72.1	-23	0	0	0	112.8	I493	I493-N597 HydrophobicContact CB-CB 4.4Å; I493-N597 WeakPolarHBondContact CB-ND2 3.49Å; I493-N597 PolarHBondContact O-N 3.39Å; I493-N597 PolarHBondContact O-OD1 3.48Å; I493-N597 VanDerWaalsContact O-OD1 3.13Å
598	S	82.6	Confident	88.9	Confident	30 Å²	30	31.6 Å²	31.6	21%	0.21	16%	0.159	C	C	.	.	S	Bend	trans	-104.4	176.6	174.8	71.5	0	0	0	0	111.2	S596 G600	S596-S598 VanDerWaalsContact C-N 3.33Å; S596-S598 WeakPolarHBondContact CB-O 3.2Å; S596-S598 PolarHBondContact OG-N 3.04Å; S596-S598 PolarHBondContact OG-O 2.93Å; S596-S598 PolarHBondContact OG-OG 3.23Å; S598-G600 PolarHBondContact O-N 2.84Å
599	E	83.4	Confident	89.1	Confident	72 Å²	72	30.5 Å²	30.5	34%	0.336	15%	0.151	S	C	.	.			trans	-62.9	127.4	167.8	-62.4	-178.8	139.9	0	0	109.9	K571 E601 K602	K571-E599 HydrophobicContact CB-CG 4.43Å; K571-E599 HydrophobicContact CD-CG 4.26Å; K571-E599 WeakPolarHBondContact CD-OE1 3.36Å; K571-E599 IonicContact NZ-OE1 3.43Å; K571-E599 PolarHBondContact NZ-OE1 3.09Å; K571-E599 CarbonylContact O-C 3.52Å; K571-E599 WeakPolarHBondContact O-CA 3.46Å; E599-E601 PolarHBondContact O-N 2.98Å; E599-K602 HydrophobicContact CB-CG 4.29Å; E599-K602 WeakPolarHBondContact O-CB 3.48Å; E599-K602 PolarHBondContact O-N 3.09Å
600	G	85.5	Confident	88.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.9	-26	179.9	0	0	0	0	0	112.7	K571 S598 K602 I603 C604	K571-G600 PolarHBondContact O-N 3.22Å; S598-G600 PolarHBondContact O-N 2.84Å; G600-K602 PolarHBondContact O-N 2.93Å; G600-I603 WeakPolarHBondContact O-CB 3.26Å; G600-I603 PolarHBondContact O-N 2.97Å; G600-C604 PolarHBondContact O-N 3.24Å
601	E	87.9	Confident	88.8	Confident	113 Å²	113	30.8 Å²	30.8	53%	0.528	15%	0.148	S	C	.	.	H	α-helix	trans	-57.8	-32.8	171.8	-67.6	-177	173.1	0	0	112.2	A566 E599 I603 C604 Y605	A566-E601 HydrophobicContact CB-CG 4Å; E599-E601 PolarHBondContact O-N 2.98Å; E601-I603 VanDerWaalsContact C-N 3.31Å; E601-I603 PolarHBondContact O-N 3.27Å; E601-C604 PolarHBondContact O-N 3.27Å; E601-Y605 WeakPolarHBondContact O-CB 3.27Å; E601-Y605 PolarHBondContact O-N 3.29Å
602	K	86.2	Confident	88.5	Confident	62 Å²	62	34.1 Å²	34.1	27%	0.27	16%	0.164	S	C	.	.	H	α-helix	trans	-65.9	-35.8	175.7	-60.6	-169.3	-178.3	-163	0	111.8	F492 E599 G600 A606 L641	F492-K602 HydrophobicContact CE1-CB 4.02Å; E599-K602 HydrophobicContact CB-CG 4.29Å; E599-K602 WeakPolarHBondContact O-CB 3.48Å; E599-K602 PolarHBondContact O-N 3.09Å; G600-K602 PolarHBondContact O-N 2.93Å; K602-A606 PolarHBondContact O-N 3.5Å; K602-L641 HydrophobicContact CB-CD1 3.65Å; K602-L641 HydrophobicContact CD-CB 4.01Å; K602-L641 HydrophobicContact CD-CD1 4.15Å; K602-L641 HydrophobicContact CG-CB 4.33Å; K602-L641 HydrophobicContact CG-CD1 3.82Å; K602-L641 PolarHBondContact NZ-O 3.44Å
603	I	88.3	Confident	88.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-70.2	-45.3	175.6	-61.6	170.9	0	0	0	109.8	F492 V494 L535 V574 S596 G600 E601 Y605 A606 I607	F492-I603 HydrophobicContact CB-CD1 4.02Å; F492-I603 HydrophobicContact CB-CG1 4.07Å; F492-I603 HydrophobicContact CD1-CD1 4.3Å; F492-I603 HydrophobicContact CD1-CG1 3.61Å; F492-I603 HydrophobicContact CD2-CG1 3.81Å; F492-I603 HydrophobicContact CE1-CG1 3.9Å; F492-I603 HydrophobicContact CE2-CG1 4.08Å; F492-I603 HydrophobicContact CG-CD1 4.07Å; F492-I603 HydrophobicContact CG-CG1 3.55Å; F492-I603 HydrophobicContact CZ-CG1 4.11Å; V494-I603 HydrophobicContact CG1-CD1 3.93Å; L535-I603 HydrophobicContact CD2-CD1 4.48Å; L535-I603 HydrophobicContact CD2-CG2 3.84Å; V574-I603 HydrophobicContact CG1-CD1 3.94Å; V574-I603 HydrophobicContact CG2-CB 4.38Å; V574-I603 HydrophobicContact CG2-CG2 4.3Å; S596-I603 WeakPolarHBondContact OG-CD1 3.42Å; G600-I603 WeakPolarHBondContact O-CB 3.26Å; G600-I603 PolarHBondContact O-N 2.97Å; E601-I603 VanDerWaalsContact C-N 3.31Å; E601-I603 PolarHBondContact O-N 3.27Å; I603-Y605 VanDerWaalsContact C-N 3.31Å; I603-Y605 PolarHBondContact O-N 3.1Å; I603-A606 PolarHBondContact O-N 3.4Å; I603-I607 HydrophobicContact CG2-CD1 3.94Å; I603-I607 HydrophobicContact CG2-CG1 4.47Å; I603-I607 VanDerWaalsContact O-CG1 3.31Å; I603-I607 WeakPolarHBondContact O-CG1 3.46Å; I603-I607 PolarHBondContact O-N 3.49Å
604	C	91.4	Very high	87.6	Confident	18 Å²	18	35 Å²	35	12%	0.122	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-42.3	175.7	-66.7	0	0	0	0	112.1	F564 A565 A566 G600 E601 I607 N608	F564-C604 HydrophobicContact CD2-CB 3.87Å; F564-C604 HydrophobicContact CE2-CB 4.18Å; F564-C604 VanDerWaalsContact CE2-O 3.28Å; F564-C604 WeakPolarHBondContact CE2-O 3.37Å; A565-C604 VanDerWaalsContact C-SG 3.55Å; A566-C604 PolarHBondContact N-SG 2.86Å; A566-C604 VanDerWaalsContact N-SG 3.43Å; G600-C604 PolarHBondContact O-N 3.24Å; E601-C604 PolarHBondContact O-N 3.27Å; C604-I607 PolarHBondContact O-N 2.66Å; C604-N608 WeakPolarHBondContact O-CB 3.46Å; C604-N608 PolarHBondContact O-N 3.46Å
605	Y	87.8	Confident	87.1	Confident	83 Å²	83	42.4 Å²	42.4	33%	0.325	21%	0.205	S	C	.	.	H	α-helix	trans	-60.4	-45.9	174.8	176.9	-90.4	0	0	0	111.6	E601 I603 I607 N608 L609 V639 L641	E601-Y605 WeakPolarHBondContact O-CB 3.27Å; E601-Y605 PolarHBondContact O-N 3.29Å; I603-Y605 VanDerWaalsContact C-N 3.31Å; I603-Y605 PolarHBondContact O-N 3.1Å; Y605-I607 VanDerWaalsContact C-N 3.34Å; Y605-I607 PolarHBondContact O-N 3.37Å; Y605-N608 PolarHBondContact O-N 3.07Å; Y605-L609 HydrophobicContact CE1-CD2 4.11Å; Y605-L609 WeakPolarHBondContact O-CB 3.47Å; Y605-L609 PolarHBondContact O-N 3.43Å; Y605-V639 HydrophobicContact CE1-CG1 3.96Å; Y605-L641 HydrophobicContact CD1-CD1 4.03Å; Y605-L641 HydrophobicContact CD1-CD2 3.69Å; Y605-L641 HydrophobicContact CD1-CG 4.39Å; Y605-L641 HydrophobicContact CE1-CD2 3.81Å; Y605-L641 HydrophobicContact CG-CD2 4.14Å
606	A	87.8	Confident	86.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-41.8	177.6	0	0	0	0	0	112.3	L488 Q490 F492 V537 K602 I603 G610	L488-A606 WeakPolarHBondContact CD2-O 3.35Å; Q490-A606 HydrophobicContact CB-CB 4.38Å; F492-A606 HydrophobicContact CE2-CB 3.9Å; F492-A606 HydrophobicContact CZ-CB 4.01Å; V537-A606 HydrophobicContact CB-CB 4.26Å; V537-A606 HydrophobicContact CG1-CB 4.04Å; V537-A606 HydrophobicContact CG2-CB 4.3Å; K602-A606 PolarHBondContact O-N 3.5Å; I603-A606 PolarHBondContact O-N 3.4Å; A606-G610 PolarHBondContact O-N 3.38Å
607	I	89.5	Confident	85.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-45.7	176.3	-66.8	170.2	0	0	0	110.6	V537 L542 L558 V561 F564 I603 C604 Y605 G610 K611	V537-I607 HydrophobicContact CG1-CG1 4.32Å; L542-I607 HydrophobicContact CD1-CD1 4.24Å; L542-I607 HydrophobicContact CD1-CG1 4.44Å; L542-I607 HydrophobicContact CD2-CG1 4.05Å; L558-I607 HydrophobicContact CD1-CG2 4.01Å; V561-I607 HydrophobicContact CG1-CG2 4.45Å; F564-I607 HydrophobicContact CB-CD1 4.33Å; F564-I607 HydrophobicContact CD1-CB 4.49Å; F564-I607 HydrophobicContact CD1-CG2 3.48Å; F564-I607 VanDerWaalsContact CD1-CG2 3.48Å; F564-I607 HydrophobicContact CD2-CB 4.28Å; F564-I607 HydrophobicContact CD2-CG2 4.11Å; F564-I607 HydrophobicContact CE1-CG2 3.56Å; F564-I607 HydrophobicContact CE2-CB 4.31Å; F564-I607 HydrophobicContact CE2-CG2 4.17Å; F564-I607 HydrophobicContact CG-CB 4.37Å; F564-I607 HydrophobicContact CG-CD1 4.46Å; F564-I607 HydrophobicContact CG-CG2 3.78Å; F564-I607 HydrophobicContact CZ-CB 4.43Å; F564-I607 HydrophobicContact CZ-CG2 3.91Å; I603-I607 HydrophobicContact CG2-CD1 3.94Å; I603-I607 HydrophobicContact CG2-CG1 4.47Å; I603-I607 VanDerWaalsContact O-CG1 3.31Å; I603-I607 WeakPolarHBondContact O-CG1 3.46Å; I603-I607 PolarHBondContact O-N 3.49Å; C604-I607 PolarHBondContact O-N 2.66Å; Y605-I607 VanDerWaalsContact C-N 3.34Å; Y605-I607 PolarHBondContact O-N 3.37Å; I607-G610 PolarHBondContact O-N 3.37Å; I607-K611 PolarHBondContact O-N 3.46Å
608	N	90.2	Very high	85.4	Confident	64 Å²	64	52.5 Å²	52.5	34%	0.342	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-47	178.8	-170.8	67.6	0	0	0	111.6	F564 C604 Y605 G610 K611 E612	F564-N608 HydrophobicContact CE2-CB 4.06Å; F564-N608 HydrophobicContact CZ-CB 3.82Å; C604-N608 WeakPolarHBondContact O-CB 3.46Å; C604-N608 PolarHBondContact O-N 3.46Å; Y605-N608 PolarHBondContact O-N 3.07Å; N608-G610 VanDerWaalsContact C-N 3.29Å; N608-G610 PolarHBondContact O-N 2.84Å; N608-K611 WeakPolarHBondContact O-CB 3.48Å; N608-K611 PolarHBondContact O-N 3.19Å; N608-K611 VanDerWaalsContact O-N 3.07Å; N608-E612 PolarHBondContact ND2-OE1 2.76Å; N608-E612 PolarHBondContact O-N 3.2Å
609	L	86.1	Confident	85.3	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-40.6	176.5	178.1	60.1	0	0	0	111.6	L488 Y605 K611 E612 I613 I630 V639	L488-L609 HydrophobicContact CD1-CD2 3.82Å; L488-L609 HydrophobicContact CD1-CG 4.43Å; L488-L609 HydrophobicContact CD2-CB 4.44Å; L488-L609 HydrophobicContact CD2-CG 4.3Å; Y605-L609 HydrophobicContact CE1-CD2 4.11Å; Y605-L609 WeakPolarHBondContact O-CB 3.47Å; Y605-L609 PolarHBondContact O-N 3.43Å; L609-K611 VanDerWaalsContact C-N 3.32Å; L609-K611 PolarHBondContact O-N 3.2Å; L609-E612 PolarHBondContact O-N 2.82Å; L609-I613 HydrophobicContact CD1-CD1 4.31Å; L609-I613 HydrophobicContact CD1-CG1 4.42Å; L609-I613 HydrophobicContact CG-CD1 4.12Å; L609-I613 VanDerWaalsContact O-CG1 3.25Å; L609-I613 WeakPolarHBondContact O-CG1 3.19Å; L609-I613 PolarHBondContact O-N 3.36Å; L609-I630 HydrophobicContact CD1-CD1 3.52Å; L609-I630 HydrophobicContact CD1-CG1 4.19Å; L609-I630 HydrophobicContact CD2-CD1 4.16Å; L609-I630 HydrophobicContact CG-CD1 4.44Å; L609-V639 HydrophobicContact CD2-CG2 3.82Å
610	G	86.3	Confident	84.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.6	-40.3	174.2	0	0	0	0	0	112.6	A606 I607 N608 I613 I614	A606-G610 PolarHBondContact O-N 3.38Å; I607-G610 PolarHBondContact O-N 3.37Å; N608-G610 VanDerWaalsContact C-N 3.29Å; N608-G610 PolarHBondContact O-N 2.84Å; G610-I613 PolarHBondContact O-N 3.21Å; G610-I614 WeakPolarHBondContact O-CG1 3.47Å; G610-I614 PolarHBondContact O-N 3.4Å; G610-I614 VanDerWaalsContact O-N 3.14Å
611	K	87.3	Confident	84.4	Confident	50 Å²	50	63.7 Å²	63.7	22%	0.217	31%	0.309	C	S	.	.	H	α-helix	trans	-68.1	-43.2	175.9	-74.6	-169.6	172.6	-168.5	0	112.7	L558 V561 F564 I607 N608 L609 I613 I614 E615	L558-K611 HydrophobicContact CD2-CG 4.17Å; L558-K611 HydrophobicContact CG-CG 4.08Å; V561-K611 WeakPolarHBondContact O-CE 3.38Å; V561-K611 PolarHBondContact O-NZ 2.89Å; F564-K611 HydrophobicContact CE1-CD 4.13Å; I607-K611 PolarHBondContact O-N 3.46Å; N608-K611 WeakPolarHBondContact O-CB 3.48Å; N608-K611 PolarHBondContact O-N 3.19Å; N608-K611 VanDerWaalsContact O-N 3.07Å; L609-K611 VanDerWaalsContact C-N 3.32Å; L609-K611 PolarHBondContact O-N 3.2Å; K611-I613 VanDerWaalsContact C-N 3.28Å; K611-I613 PolarHBondContact O-N 3.26Å; K611-I614 WeakPolarHBondContact O-CB 2.84Å; K611-I614 PolarHBondContact O-N 3.39Å; K611-I614 VanDerWaalsContact O-N 3.11Å; K611-E615 PolarHBondContact O-N 3.39Å
612	E	85.8	Confident	83.9	Confident	69 Å²	69	59.8 Å²	59.8	32%	0.322	30%	0.296	S	S	.	.	H	α-helix	trans	-59.2	-42	174.3	-72.1	175.6	-173	0	0	110.8	N608 L609 I614 E615 V616 L626	N608-E612 PolarHBondContact ND2-OE1 2.76Å; N608-E612 PolarHBondContact O-N 3.2Å; L609-E612 PolarHBondContact O-N 2.82Å; E612-I614 VanDerWaalsContact C-N 3.32Å; E612-I614 PolarHBondContact O-N 3.39Å; E612-E615 PolarHBondContact O-N 3.44Å; E612-V616 WeakPolarHBondContact O-CB 3.43Å; E612-V616 WeakPolarHBondContact O-CG2 3.42Å; E612-V616 PolarHBondContact O-N 3.39Å; E612-L626 HydrophobicContact CB-CD2 3.98Å
613	I	84.4	Confident	83.5	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-58.6	-44.2	174.4	-69.5	165.7	0	0	0	110.9	L487 L488 L609 G610 K611 V616 Q617 L626 M627	L487-I613 HydrophobicContact CB-CD1 4.46Å; L487-I613 HydrophobicContact CB-CG2 4.39Å; L487-I613 HydrophobicContact CD1-CG2 4.1Å; L488-I613 HydrophobicContact CB-CD1 3.8Å; L488-I613 HydrophobicContact CD2-CD1 4.32Å; L609-I613 HydrophobicContact CD1-CD1 4.31Å; L609-I613 HydrophobicContact CD1-CG1 4.42Å; L609-I613 HydrophobicContact CG-CD1 4.12Å; L609-I613 VanDerWaalsContact O-CG1 3.25Å; L609-I613 WeakPolarHBondContact O-CG1 3.19Å; L609-I613 PolarHBondContact O-N 3.36Å; G610-I613 PolarHBondContact O-N 3.21Å; K611-I613 VanDerWaalsContact C-N 3.28Å; K611-I613 PolarHBondContact O-N 3.26Å; I613-V616 PolarHBondContact O-N 3.03Å; I613-Q617 VanDerWaalsContact O-CB 3.25Å; I613-Q617 WeakPolarHBondContact O-CB 3.46Å; I613-Q617 PolarHBondContact O-N 2.92Å; I613-L626 HydrophobicContact CG1-CD2 4.18Å; I613-M627 HydrophobicContact CD1-CE 4.01Å; I613-M627 HydrophobicContact CG1-CE 3.92Å
614	I	84.1	Confident	82.6	Confident	47 Å²	47	60.8 Å²	60.8	24%	0.241	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-43.6	177.8	-67.6	169.6	0	0	0	111.9	S539 L558 T559 G610 K611 E612	S539-I614 VanDerWaalsContact O-CD1 3.28Å; S539-I614 WeakPolarHBondContact O-CD1 3.39Å; S539-I614 WeakPolarHBondContact O-CG1 3.26Å; L558-I614 HydrophobicContact CB-CD1 3.97Å; L558-I614 HydrophobicContact CD2-CD1 3.84Å; L558-I614 HydrophobicContact CG-CD1 4.26Å; T559-I614 HydrophobicContact CG2-CD1 4.43Å; G610-I614 WeakPolarHBondContact O-CG1 3.47Å; G610-I614 PolarHBondContact O-N 3.4Å; G610-I614 VanDerWaalsContact O-N 3.14Å; K611-I614 WeakPolarHBondContact O-CB 2.84Å; K611-I614 PolarHBondContact O-N 3.39Å; K611-I614 VanDerWaalsContact O-N 3.11Å; E612-I614 VanDerWaalsContact C-N 3.32Å; E612-I614 PolarHBondContact O-N 3.39Å
615	E	83.5	Confident	82	Confident	156 Å²	156	66.9 Å²	66.9	73%	0.729	34%	0.338	S	S	*	.	H	α-helix	trans	-64.4	-42.7	-179	-73	-172.3	169.2	0	0	111.7	K611 E612	K611-E615 PolarHBondContact O-N 3.39Å; E612-E615 PolarHBondContact O-N 3.44Å
616	V	83.3	Confident	81.5	Confident	35 Å²	35	64.2 Å²	64.2	21%	0.212	33%	0.329	C	S	.	.	H	α-helix	trans	-90.7	-11.7	-172	-162.1	0	0	0	0	112	E612 I613 K618 D619 A622 L623 L626	E612-V616 WeakPolarHBondContact O-CB 3.43Å; E612-V616 WeakPolarHBondContact O-CG2 3.42Å; E612-V616 PolarHBondContact O-N 3.39Å; I613-V616 PolarHBondContact O-N 3.03Å; V616-K618 PolarHBondContact O-N 2.98Å; V616-D619 CarbonylContact O-C 3.59Å; V616-D619 PolarHBondContact O-N 2.9Å; V616-D619 VanDerWaalsContact O-O 3.04Å; V616-A622 HydrophobicContact CG1-CB 3.19Å; V616-L623 HydrophobicContact CG1-CB 4.39Å; V616-L623 VanDerWaalsContact CG1-N 3.32Å; V616-L626 HydrophobicContact CG2-CD2 4.47Å
617	Q	76.1	Confident	80.8	Confident	101 Å²	101	66.7 Å²	66.7	47%	0.472	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-23.5	179.2	-164.9	172.3	14	0	0	113.9	I613	I613-Q617 VanDerWaalsContact O-CB 3.25Å; I613-Q617 WeakPolarHBondContact O-CB 3.46Å; I613-Q617 PolarHBondContact O-N 2.92Å
618	K	75.3	Confident	79.8	Confident	197 Å²	197	73.8 Å²	73.8	86%	0.857	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-12.3	178.4	-62.5	-179.6	-175.8	172.9	0	113.7	V616	V616-K618 PolarHBondContact O-N 2.98Å
619	D	81.8	Confident	78.8	Confident	78 Å²	78	75 Å²	75	42%	0.417	39%	0.392	S	S	.	.			trans	-123.1	106.5	178.8	-177.5	-8.9	0	0	0	110.7	V616 E621 A622 L623	V616-D619 CarbonylContact O-C 3.59Å; V616-D619 PolarHBondContact O-N 2.9Å; V616-D619 VanDerWaalsContact O-O 3.04Å; D619-E621 VanDerWaalsContact C-N 3.31Å; D619-E621 PolarHBondContact O-N 3.38Å; D619-E621 PolarHBondContact OD1-N 3.47Å; D619-A622 HydrophobicContact CB-CB 4.03Å; D619-A622 PolarHBondContact O-N 2.9Å; D619-A622 PolarHBondContact OD1-N 3.49Å; D619-L623 WeakPolarHBondContact O-CB 3.42Å; D619-L623 PolarHBondContact O-N 2.92Å
620	P	74.9	Confident	77.9	Confident	105 Å²	105	75.6 Å²	75.6	68%	0.682	40%	0.395	S	S	*	.	H	α-helix	trans	-66.9	-26.7	-175.5	25.7	-32.2	0	0	0	114	A624	P620-A624 WeakPolarHBondContact O-CB 3.26Å; P620-A624 PolarHBondContact O-N 3.05Å
621	E	74.7	Confident	76.7	Confident	154 Å²	154	78.8 Å²	78.8	72%	0.72	42%	0.416	S	S	*	.	H	α-helix	trans	-75.7	-42.8	178.3	-72	-174	-179.6	0	0	111.2	D619 A624 Q625	D619-E621 VanDerWaalsContact C-N 3.31Å; D619-E621 PolarHBondContact O-N 3.38Å; D619-E621 PolarHBondContact OD1-N 3.47Å; E621-A624 PolarHBondContact O-N 3.48Å; E621-Q625 PolarHBondContact O-N 3.46Å; E621-Q625 VanDerWaalsContact O-N 3.13Å
622	A	76.5	Confident	75.3	Confident	31 Å²	31	80.4 Å²	80.4	26%	0.256	43%	0.426	S	S	.	.	H	α-helix	trans	-69.2	-35.1	177.4	0	0	0	0	0	111.7	V616 D619 Q625 L626	V616-A622 HydrophobicContact CG1-CB 3.19Å; D619-A622 HydrophobicContact CB-CB 4.03Å; D619-A622 PolarHBondContact O-N 2.9Å; D619-A622 PolarHBondContact OD1-N 3.49Å; A622-Q625 PolarHBondContact O-N 2.95Å; A622-L626 PolarHBondContact O-N 3.3Å
623	L	78	Confident	73.6	Confident	31 Å²	31	78.9 Å²	78.9	16%	0.162	42%	0.422	C	S	.	.	H	α-helix	trans	-64.3	-41.5	174.6	-177.9	63.3	0	0	0	111.2	L487 V616 D619 L626 M627	L487-L623 HydrophobicContact CD1-CD1 4.16Å; L487-L623 HydrophobicContact CD1-CD2 3.99Å; V616-L623 HydrophobicContact CG1-CB 4.39Å; V616-L623 VanDerWaalsContact CG1-N 3.32Å; D619-L623 WeakPolarHBondContact O-CB 3.42Å; D619-L623 PolarHBondContact O-N 2.92Å; L623-L626 PolarHBondContact O-N 3.43Å; L623-M627 VanDerWaalsContact O-CG 3.3Å; L623-M627 WeakPolarHBondContact O-CG 3.37Å; L623-M627 PolarHBondContact O-N 3.47Å
624	A	70.5	Confident	71.6	Confident	52 Å²	52	87.7 Å²	87.7	43%	0.43	47%	0.469	S	S	.	.	H	α-helix	trans	-64.5	-38.7	176.7	0	0	0	0	0	112.5	P620 E621 M627 L628	P620-A624 WeakPolarHBondContact O-CB 3.26Å; P620-A624 PolarHBondContact O-N 3.05Å; E621-A624 PolarHBondContact O-N 3.48Å; A624-M627 PolarHBondContact O-N 3.44Å; A624-L628 WeakPolarHBondContact O-CG 3.17Å; A624-L628 PolarHBondContact O-N 3.22Å; A624-L628 VanDerWaalsContact O-N 3.11Å
625	Q	77.3	Confident	69.7	Low	145 Å²	145	90 Å²	90	68%	0.678	48%	0.482	S	S	*	.	H	α-helix	trans	-66.4	-40.7	175.1	-74.3	-173.1	4.5	0	0	112.7	E621 A622 L628 S629	E621-Q625 PolarHBondContact O-N 3.46Å; E621-Q625 VanDerWaalsContact O-N 3.13Å; A622-Q625 PolarHBondContact O-N 2.95Å; Q625-L628 PolarHBondContact O-N 3.22Å; Q625-S629 PolarHBondContact O-N 3.44Å
626	L	78.6	Confident	68	Low	28 Å²	28	84.8 Å²	84.8	15%	0.147	47%	0.47	C	S	.	.	H	α-helix	trans	-63.2	-42.5	174.9	-177	63.9	0	0	0	111.1	E612 I613 V616 A622 L623 L628 S629 I630	E612-L626 HydrophobicContact CB-CD2 3.98Å; I613-L626 HydrophobicContact CG1-CD2 4.18Å; V616-L626 HydrophobicContact CG2-CD2 4.47Å; A622-L626 PolarHBondContact O-N 3.3Å; L623-L626 PolarHBondContact O-N 3.43Å; L626-L628 VanDerWaalsContact C-N 3.29Å; L626-L628 PolarHBondContact O-N 3.06Å; L626-S629 PolarHBondContact O-N 2.94Å; L626-S629 PolarHBondContact O-OG 3.22Å; L626-I630 HydrophobicContact CG-CD1 4.33Å; L626-I630 VanDerWaalsContact O-CD1 3.29Å; L626-I630 WeakPolarHBondContact O-CD1 3.26Å; L626-I630 VanDerWaalsContact O-CG1 3.27Å; L626-I630 WeakPolarHBondContact O-CG1 3.47Å
627	M	72.3	Confident	66.1	Low	52 Å²	52	89.9 Å²	89.9	26%	0.256	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-29.4	177.3	-68.4	-62.2	101.1	0	0	113.3	I613 L623 A624 I630	I613-M627 HydrophobicContact CD1-CE 4.01Å; I613-M627 HydrophobicContact CG1-CE 3.92Å; L623-M627 VanDerWaalsContact O-CG 3.3Å; L623-M627 WeakPolarHBondContact O-CG 3.37Å; L623-M627 PolarHBondContact O-N 3.47Å; A624-M627 PolarHBondContact O-N 3.44Å; M627-I630 HydrophobicContact CE-CD1 3.36Å; M627-I630 HydrophobicContact SD-CD1 4.31Å
628	L	69.3	Low	64.8	Low	149 Å²	149	90.1 Å²	90.1	78%	0.78	49%	0.487	S	S	*	.	H	α-helix	trans	-74.7	-23.3	176.8	-77.2	168.1	0	0	0	114	A624 Q625 L626	A624-L628 WeakPolarHBondContact O-CG 3.17Å; A624-L628 PolarHBondContact O-N 3.22Å; A624-L628 VanDerWaalsContact O-N 3.11Å; Q625-L628 PolarHBondContact O-N 3.22Å; L626-L628 VanDerWaalsContact C-N 3.29Å; L626-L628 PolarHBondContact O-N 3.06Å
629	S	68.5	Low	63.9	Low	89 Å²	89	81.8 Å²	81.8	62%	0.622	45%	0.452	S	S	*	.	H	α-helix	trans	-89.4	-8.8	-177.7	66.4	0	0	0	0	113.7	Q625 L626	Q625-S629 PolarHBondContact O-N 3.44Å; L626-S629 PolarHBondContact O-N 2.94Å; L626-S629 PolarHBondContact O-OG 3.22Å
630	I	68.5	Low	62.5	Low	17 Å²	17	81.7 Å²	81.7	9%	0.087	45%	0.451	C	S	.	.	S	Bend	trans	-90.3	128.4	-176.2	-63.7	161.7	0	0	0	110.3	L609 L626 M627 L632 V639	L609-I630 HydrophobicContact CD1-CD1 3.52Å; L609-I630 HydrophobicContact CD1-CG1 4.19Å; L609-I630 HydrophobicContact CD2-CD1 4.16Å; L609-I630 HydrophobicContact CG-CD1 4.44Å; L626-I630 HydrophobicContact CG-CD1 4.33Å; L626-I630 VanDerWaalsContact O-CD1 3.29Å; L626-I630 WeakPolarHBondContact O-CD1 3.26Å; L626-I630 VanDerWaalsContact O-CG1 3.27Å; L626-I630 WeakPolarHBondContact O-CG1 3.47Å; M627-I630 HydrophobicContact CE-CD1 3.36Å; M627-I630 HydrophobicContact SD-CD1 4.31Å; I630-L632 HydrophobicContact CG2-CD2 4.45Å; I630-L632 PolarHBondContact O-N 3.03Å; I630-V639 HydrophobicContact CG2-CB 4.03Å; I630-V639 HydrophobicContact CG2-CG1 3.6Å; I630-V639 HydrophobicContact CG2-CG2 3.35Å
631	P	59.8	Low	61.1	Low	68 Å²	68	79 Å²	79	44%	0.442	43%	0.431	S	S	.	.			trans	-71.2	111.7	175.2	27.2	-31.2	0	0	0	110.1	V639 L640	P631-V639 HydrophobicContact CG-CG1 4.14Å; P631-V639 CarbonylContact O-C 3.53Å; P631-V639 VanDerWaalsContact O-CA 3.25Å; P631-V639 WeakPolarHBondContact O-CA 3.31Å; P631-V639 WeakPolarHBondContact O-CG1 3.37Å; P631-L640 HydrophobicContact CB-CB 4.49Å; P631-L640 PolarHBondContact O-N 3.17Å
632	L	57.1	Low	59.4	Low	84 Å²	84	78.2 Å²	78.2	44%	0.44	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-98.6	152.7	-179.7	-67.9	164.6	0	0	0	112.2	I630 Y638	I630-L632 HydrophobicContact CG2-CD2 4.45Å; I630-L632 PolarHBondContact O-N 3.03Å; L632-Y638 CarbonylContact C-O 3.47Å; L632-Y638 WeakPolarHBondContact CA-O 3.44Å
633	T	52	Low	57.4	Low	37 Å²	37	84.1 Å²	84.1	23%	0.227	46%	0.459	C	S	.	.			trans	-66.6	159.3	165.7	37.7	0	0	0	0	111.1	D635 G636 Y638 L640	T633-D635 WeakPolarHBondContact CB-OD1 3.48Å; T633-D635 PolarHBondContact O-N 3.37Å; T633-D635 PolarHBondContact OG1-OD1 3.41Å; T633-G636 PolarHBondContact O-N 3.22Å; T633-Y638 PolarHBondContact N-O 3.45Å; T633-Y638 WeakPolarHBondContact OG1-CA 3.31Å; T633-Y638 WeakPolarHBondContact OG1-CB 3.18Å; T633-Y638 PolarHBondContact OG1-N 2.98Å; T633-Y638 PolarHBondContact OG1-O 3.41Å; T633-L640 HydrophobicContact CG2-CD1 3.67Å; T633-L640 HydrophobicContact CG2-CG 3.95Å
634	N	42	Very low	55	Low	186 Å²	186	91 Å²	91	100%	0.995	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.2	-174.6	-73.8	-24.3	0	0	0	114.6
635	D	43.6	Very low	53.4	Low	94 Å²	94	94.1 Å²	94.1	50%	0.503	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	0.2	175	63.7	-13.3	0	0	0	113.4	T633 K637	T633-D635 WeakPolarHBondContact CB-OD1 3.48Å; T633-D635 PolarHBondContact O-N 3.37Å; T633-D635 PolarHBondContact OG1-OD1 3.41Å; D635-K637 PolarHBondContact O-N 3.46Å; D635-K637 PolarHBondContact OD1-N 2.9Å
636	G	47.6	Very low	51.1	Low	47 Å²	47	94.5 Å²	94.5	49%	0.485	51%	0.513	S	S	.	.	S	Bend	trans	71.4	9.4	176.8	0	0	0	0	0	114.7	T633	T633-G636 PolarHBondContact O-N 3.22Å
637	K	42.8	Very low	49	Very low	142 Å²	142	101.2 Å²	101.2	62%	0.617	55%	0.549	S	S	*	.	S	Bend	trans	-100.1	-24.4	-169.8	-71	-177.9	179.3	-173.8	0	114.6	D635	D635-K637 PolarHBondContact O-N 3.46Å; D635-K637 PolarHBondContact OD1-N 2.9Å
638	Y	50.7	Low	47	Very low	107 Å²	107	104.7 Å²	104.7	42%	0.42	57%	0.573	S	S	.	*	S	Bend	trans	-135	148.9	-173.2	-53.3	-79.3	0	0	0	112.9	Q489 L632 T633	Q489-Y638 VanDerWaalsContact O-CD1 3.3Å; Q489-Y638 WeakPolarHBondContact O-CD1 3.38Å; Q489-Y638 WeakPolarHBondContact O-CE1 3.39Å; L632-Y638 CarbonylContact C-O 3.47Å; L632-Y638 WeakPolarHBondContact CA-O 3.44Å; T633-Y638 PolarHBondContact N-O 3.45Å; T633-Y638 WeakPolarHBondContact OG1-CA 3.31Å; T633-Y638 WeakPolarHBondContact OG1-CB 3.18Å; T633-Y638 PolarHBondContact OG1-N 2.98Å; T633-Y638 PolarHBondContact OG1-O 3.41Å
639	V	55.5	Low	45.2	Very low	21 Å²	21	101.3 Å²	101.3	13%	0.127	58%	0.575	C	S	.	*	B	Isolated β-bridge	trans	-81.8	129.2	175	-173.7	0	0	0	0	110.7	Y605 L609 I630 P631	Y605-V639 HydrophobicContact CE1-CG1 3.96Å; L609-V639 HydrophobicContact CD2-CG2 3.82Å; I630-V639 HydrophobicContact CG2-CB 4.03Å; I630-V639 HydrophobicContact CG2-CG1 3.6Å; I630-V639 HydrophobicContact CG2-CG2 3.35Å; P631-V639 HydrophobicContact CG-CG1 4.14Å; P631-V639 CarbonylContact O-C 3.53Å; P631-V639 VanDerWaalsContact O-CA 3.25Å; P631-V639 WeakPolarHBondContact O-CA 3.31Å; P631-V639 WeakPolarHBondContact O-CG1 3.37Å
640	L	51.3	Low	43.2	Very low	76 Å²	76	100.6 Å²	100.6	40%	0.398	58%	0.581	S	S	.	*			trans	-83.6	112.2	176.1	-109.5	140.3	0	0	0	110.3	P631 T633 N642	P631-L640 HydrophobicContact CB-CB 4.49Å; P631-L640 PolarHBondContact O-N 3.17Å; T633-L640 HydrophobicContact CG2-CD1 3.67Å; T633-L640 HydrophobicContact CG2-CG 3.95Å; L640-N642 PolarHBondContact O-N 3.46Å
641	L	47.3	Very low	41.4	Very low	48 Å²	48	105.2 Å²	105.2	25%	0.251	62%	0.615	S	S	.	*			trans	-101	75.8	172.8	-66	171.1	0	0	0	110	K602 Y605	K602-L641 HydrophobicContact CB-CD1 3.65Å; K602-L641 HydrophobicContact CD-CB 4.01Å; K602-L641 HydrophobicContact CD-CD1 4.15Å; K602-L641 HydrophobicContact CG-CB 4.33Å; K602-L641 HydrophobicContact CG-CD1 3.82Å; K602-L641 PolarHBondContact NZ-O 3.44Å; Y605-L641 HydrophobicContact CD1-CD1 4.03Å; Y605-L641 HydrophobicContact CD1-CD2 3.69Å; Y605-L641 HydrophobicContact CD1-CG 4.39Å; Y605-L641 HydrophobicContact CE1-CD2 3.81Å; Y605-L641 HydrophobicContact CG-CD2 4.14Å
642	N	38.3	Very low	40.1	Very low	139 Å²	139	108.1 Å²	108.1	74%	0.743	63%	0.634	S	S	*	*			trans	55.6	121.8	170.8	-76.1	-8.8	0	0	0	120.3	L640	L640-N642 PolarHBondContact O-N 3.46Å
643	D	33.6	Very low	38.8	Very low	154 Å²	154	109.2 Å²	109.2	82%	0.824	65%	0.649	S	S	*	*			trans	-115.2	111.1	142	-90.6	-22.9	0	0	0	107.2
644	Q	28.9	Very low	37.8	Very low	175 Å²	175	115.2 Å²	115.2	82%	0.818	68%	0.679	S	S	*	*			trans	-101.9	130	157.3	-97.1	-169.2	-17.7	0	0	107.4
645	P	36.6	Very low	37.3	Very low	119 Å²	119	114.1 Å²	114.1	77%	0.773	67%	0.673	S	S	*	*			trans	-75	139.9	177.4	31.1	-31.3	0	0	0	110	D647	P645-D647 PolarHBondContact O-N 2.88Å; P645-D647 VanDerWaalsContact O-N 3.09Å
646	D	29.2	Very low	36.7	Very low	153 Å²	153	121.5 Å²	121.5	82%	0.818	69%	0.694	S	S	*	*			trans	-51.1	111.4	172.4	-73.2	-46.5	0	0	0	111.1	T648	D646-T648 VanDerWaalsContact C-N 3.29Å; D646-T648 PolarHBondContact O-N 2.97Å
647	D	33.4	Very low	35.9	Very low	168 Å²	168	122.9 Å²	122.9	90%	0.898	71%	0.708	S	S	*	*			trans	-78.2	82.7	172.8	-149.9	1.3	0	0	0	108.7	P645	P645-D647 PolarHBondContact O-N 2.88Å; P645-D647 VanDerWaalsContact O-N 3.09Å
648	T	32.1	Very low	35.3	Very low	125 Å²	125	120.8 Å²	120.8	77%	0.767	72%	0.717	S	S	*	*			trans	-120.9	94.6	168.6	39.5	0	0	0	0	110.7	D646	D646-T648 VanDerWaalsContact C-N 3.29Å; D646-T648 PolarHBondContact O-N 2.97Å
649	G	30.4	Very low	34.4	Very low	79 Å²	79	124.7 Å²	124.7	81%	0.814	74%	0.739	S	S	*	*			trans	76	107.5	140.3	0	0	0	0	0	118.5
650	G	27.7	Very low	33.2	Very low	73 Å²	73	128.5 Å²	128.5	75%	0.753	77%	0.767	S	S	*	*			trans	161.9	86.4	155.3	0	0	0	0	0	114.5
651	S	29.2	Very low	32.3	Very low	114 Å²	114	133.6 Å²	133.6	80%	0.797	79%	0.789	S	S	*	*			trans	-56.5	131.5	164	51.2	0	0	0	0	111.3	S653	S651-S653 PolarHBondContact O-N 3.45Å
652	P	32.8	Very low	31.7	Very low	130 Å²	130	140 Å²	140	84%	0.844	85%	0.848	S	S	*	*			trans	-88	104.4	169	30	-22.3	0	0	0	108.9
653	S	30.1	Very low	31.4	Very low	107 Å²	107	140.1 Å²	140.1	75%	0.748	85%	0.854	S	S	*	*			trans	-71.4	129.7	160.9	54.7	0	0	0	0	109.2	S651 N655	S651-S653 PolarHBondContact O-N 3.45Å; S653-N655 PolarHBondContact O-N 3.22Å
654	D	31.9	Very low	31.3	Very low	163 Å²	163	139.3 Å²	139.3	87%	0.872	86%	0.855	S	S	*	*			trans	-34.4	122.5	163	-82.4	-46.7	0	0	0	112.4
655	N	29.9	Very low	31.4	Very low	162 Å²	162	137.3 Å²	137.3	87%	0.866	86%	0.857	S	S	*	*			trans	-146.2	113.3	148.5	-123.5	-4.9	0	0	0	111.4	S653	S653-N655 PolarHBondContact O-N 3.22Å
656	R	32.5	Very low	31.1	Very low	250 Å²	250	138.4 Å²	138.4	94%	0.943	86%	0.862	S	S	*	*			trans	-56.8	130.8	161.9	-73	173.3	173.3	-179.1	-2.6	109.1
657	G	29.2	Very low	31.3	Very low	76 Å²	76	137.5 Å²	137.5	78%	0.784	87%	0.865	S	S	*	*			trans	-160.5	98.3	166.6	0	0	0	0	0	109
658	A	32	Very low	31.1	Very low	97 Å²	97	135.5 Å²	135.5	80%	0.802	86%	0.863	S	S	*	*			trans	-73.2	141.7	167	0	0	0	0	0	109.7
659	E	30.5	Very low	31.1	Very low	190 Å²	190	136.2 Å²	136.2	89%	0.888	87%	0.87	S	S	*	*			trans	170.3	106.2	145.9	-95.7	168.3	-164.8	0	0	106.3
660	S	30.3	Very low	31.1	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	87%	0.874	S	S	*	*				75.2	112.5	81.5	-163.2	0	0	0	0	113.6
661	E	33.3	Very low	31.4	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	88%	0.884	S	S	*	*			trans	48.1	106.7	145.4	-62.3	-177.9	165.5	0	0	119.7
662	A	35.1	Very low	31.6	Very low	182 Å²	182	149.2 Å²	149.2	100%	1.504	89%	0.892	S	S	*	*				-170.1	0	115.8	0	0	0	0	0	110.3

Retrieved 662 of 662 residues in 207.7 ms (Link to these results)

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