A0A5K4F379_SCHMA Loading...

Coiled-coil domain-containing protein 60

AlphaFold DB , UniProt , Accession A0A5K4F379, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 734 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	34.8	Very low	38.1	Very low	232 Å²	232	152.3 Å²	152.3	100%	1.143	79%	0.787	S	S	*	*				0	140.8	0	-69.9	-72.2	-172.7	0	0	106.3
2	D	36.7	Very low	38.6	Very low	162 Å²	162	157.2 Å²	157.2	87%	0.866	80%	0.799	S	S	*	*			trans	84.6	86	177.2	-48.7	-27.3	0	0	0	117.3
3	C	38.7	Very low	38.9	Very low	124 Å²	124	157.6 Å²	157.6	84%	0.838	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-97.2	126.4	159	-159.1	0	0	0	0	107.8
4	P	36.7	Very low	39.1	Very low	116 Å²	116	157.6 Å²	157.6	75%	0.753	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-77	135	-176.2	15.6	-7.8	0	0	0	111.6	K6	P4-K6 PolarHBondContact O-N 3.16Å
5	I	35.9	Very low	39	Very low	156 Å²	156	153.3 Å²	153.3	80%	0.8	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-63.4	121.7	177	-65.6	165	0	0	0	109.7	V7	I5-V7 HydrophobicContact CG2-CG2 4.26Å; I5-V7 PolarHBondContact O-N 3.32Å
6	K	32.3	Very low	39.1	Very low	209 Å²	209	148.8 Å²	148.8	91%	0.909	77%	0.769	S	S	*	*			trans	-76.5	112	170.5	-79.7	-179.8	176.2	177	0	109.9	P4	P4-K6 PolarHBondContact O-N 3.16Å
7	V	35.6	Very low	39.6	Very low	110 Å²	110	152.9 Å²	152.9	67%	0.667	78%	0.781	S	S	*	*			trans	-95.6	120.1	170.5	-179.7	0	0	0	0	109.1	I5 T9	I5-V7 HydrophobicContact CG2-CG2 4.26Å; I5-V7 PolarHBondContact O-N 3.32Å; V7-T9 HydrophobicContact CG1-CG2 4.38Å
8	Q	36.6	Very low	40.8	Very low	174 Å²	174	150.1 Å²	150.1	81%	0.813	77%	0.772	S	S	*	*			trans	-93.1	111.6	169.9	-102.6	179.2	-7.4	0	0	109
9	T	41.6	Very low	42.2	Very low	103 Å²	103	148.4 Å²	148.4	63%	0.632	77%	0.771	S	S	*	*			trans	-85.1	140.4	172.5	50.6	0	0	0	0	110.3	V7	V7-T9 HydrophobicContact CG1-CG2 4.38Å
10	R	45.7	Very low	43.8	Very low	195 Å²	195	144.9 Å²	144.9	74%	0.736	76%	0.758	S	S	*	*	S	Bend	trans	-116.8	18.6	-176.4	-67.1	-175.2	176.1	177	-0.6	113.4
11	N	44.4	Very low	45.5	Very low	94 Å²	94	140.3 Å²	140.3	50%	0.503	74%	0.738	S	S	.	*	S	Bend	trans	-177	149.8	169.7	-100.6	-9.7	0	0	0	110	E13 E52	N11-E13 PolarHBondContact O-N 3.23Å; N11-E52 PolarHBondContact OD1-OE1 3.48Å; N11-E52 VanDerWaalsContact OD1-OE1 3.13Å
12	F	44	Very low	47.4	Very low	211 Å²	211	139.1 Å²	139.1	93%	0.925	72%	0.721	S	S	*	*	S	Bend	trans	-82.6	-1.6	-171.6	-138	-93.3	0	0	0	115.4
13	E	43	Very low	49.2	Very low	163 Å²	163	134.6 Å²	134.6	76%	0.762	70%	0.703	S	S	*	*	S	Bend	trans	-126.6	111.8	-174.7	-66.5	-178.6	169.4	0	0	109.8	N11	N11-E13 PolarHBondContact O-N 3.23Å
14	I	41.2	Very low	50.9	Low	157 Å²	157	133 Å²	133	81%	0.805	68%	0.682	S	S	*	*			trans	77.4	112	172.4	-47.7	165.3	0	0	0	113.6	P16	I14-P16 WeakPolarHBondContact O-CD 3.44Å
15	C	37.5	Very low	52.5	Low	94 Å²	94	130.3 Å²	130.3	64%	0.635	66%	0.664	S	S	*	*			trans	-94.1	92	169.4	-153.8	0	0	0	0	107.8	F17	C15-F17 PolarHBondContact O-N 3.41Å
16	P	40.9	Very low	54.2	Low	80 Å²	80	131 Å²	131	52%	0.519	66%	0.656	S	S	.	*			trans	-65.9	131.8	174.8	26.7	-32.5	0	0	0	109.1	I14 T18	I14-P16 WeakPolarHBondContact O-CD 3.44Å; P16-T18 PolarHBondContact O-N 2.71Å
17	F	47.3	Very low	56.3	Low	220 Å²	220	128.2 Å²	128.2	97%	0.965	64%	0.64	S	S	*	*	S	Bend	trans	-64.6	-4.5	176.6	-78.5	-86.5	0	0	0	113.6	C15	C15-F17 PolarHBondContact O-N 3.41Å
18	T	61.6	Low	58.1	Low	102 Å²	102	126.7 Å²	126.7	63%	0.626	63%	0.628	S	S	*	*	S	Bend	trans	-116.4	133.2	176.2	36.7	0	0	0	0	110.6	P16	P16-T18 PolarHBondContact O-N 2.71Å
19	P	67.3	Low	59.8	Low	117 Å²	117	120.7 Å²	120.7	76%	0.76	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-60.3	136.9	172.2	24.6	-31.1	0	0	0	109.3
20	P	75.1	Confident	61.4	Low	79 Å²	79	123.7 Å²	123.7	51%	0.513	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-60.8	142.9	-177.2	25.1	-34.3	0	0	0	110.8	E24 V25	P20-E24 HydrophobicContact CB-CB 4.45Å; P20-V25 HydrophobicContact CB-CG2 3.96Å; P20-V25 HydrophobicContact CG-CG2 3.78Å
21	S	79	Confident	62.8	Low	48 Å²	48	119.6 Å²	119.6	34%	0.336	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-62.5	152.1	176	64.3	0	0	0	0	111.1	S23 E24 V25	S21-S23 PolarHBondContact O-N 3.48Å; S21-S23 VanDerWaalsContact O-N 3.14Å; S21-S23 PolarHBondContact OG-OG 3.19Å; S21-E24 WeakPolarHBondContact CB-OE2 3.36Å; S21-E24 PolarHBondContact N-OE2 3Å; S21-E24 PolarHBondContact O-N 2.95Å; S21-E24 WeakPolarHBondContact OG-CB 3.35Å; S21-E24 WeakPolarHBondContact OG-CG 3.48Å; S21-E24 PolarHBondContact OG-N 3.38Å; S21-E24 PolarHBondContact OG-OE2 3.21Å; S21-V25 WeakPolarHBondContact O-CG2 3.34Å; S21-V25 PolarHBondContact O-N 2.82Å
22	R	73.6	Confident	63.8	Low	207 Å²	207	119.5 Å²	119.5	78%	0.781	59%	0.585	S	S	*	*	H	α-helix	trans	-56.9	-31.6	177.9	-172.8	174.7	-177.7	164.2	0.7	112.4	R26	R22-R26 WeakPolarHBondContact O-CB 3.43Å; R22-R26 PolarHBondContact O-N 3.06Å
23	S	75.5	Confident	65	Low	68 Å²	68	116.3 Å²	116.3	48%	0.476	57%	0.566	S	S	.	*	H	α-helix	trans	-68.4	-43.7	174.9	37.6	0	0	0	0	112.3	S21 R26 R27	S21-S23 PolarHBondContact O-N 3.48Å; S21-S23 VanDerWaalsContact O-N 3.14Å; S21-S23 PolarHBondContact OG-OG 3.19Å; S23-R26 PolarHBondContact O-N 3.15Å; S23-R27 WeakPolarHBondContact O-CB 3.48Å; S23-R27 PolarHBondContact O-N 3.47Å
24	E	74.2	Confident	66.3	Low	89 Å²	89	110.6 Å²	110.6	42%	0.416	54%	0.544	S	S	.	.	H	α-helix	trans	-65.1	-43.4	174.9	-75.3	164	148.1	0	0	112.1	P20 S21 R26 R27 N28	P20-E24 HydrophobicContact CB-CB 4.45Å; S21-E24 WeakPolarHBondContact CB-OE2 3.36Å; S21-E24 PolarHBondContact N-OE2 3Å; S21-E24 PolarHBondContact O-N 2.95Å; S21-E24 WeakPolarHBondContact OG-CB 3.35Å; S21-E24 WeakPolarHBondContact OG-CG 3.48Å; S21-E24 PolarHBondContact OG-N 3.38Å; S21-E24 PolarHBondContact OG-OE2 3.21Å; E24-R26 VanDerWaalsContact C-N 3.29Å; E24-R26 PolarHBondContact O-N 3.35Å; E24-R27 PolarHBondContact O-N 3.07Å; E24-N28 WeakPolarHBondContact O-CB 3.41Å; E24-N28 PolarHBondContact O-N 3.46Å
25	V	70.4	Confident	67.7	Low	61 Å²	61	106 Å²	106	37%	0.37	53%	0.526	S	S	.	.	H	α-helix	trans	-59.3	-43	175.1	176.2	0	0	0	0	110.6	P20 S21 N29	P20-V25 HydrophobicContact CB-CG2 3.96Å; P20-V25 HydrophobicContact CG-CG2 3.78Å; S21-V25 WeakPolarHBondContact O-CG2 3.34Å; S21-V25 PolarHBondContact O-N 2.82Å; V25-N29 VanDerWaalsContact O-CB 3.32Å; V25-N29 WeakPolarHBondContact O-CB 3.31Å; V25-N29 PolarHBondContact O-N 3.41Å
26	R	72.1	Confident	69	Low	169 Å²	169	104.5 Å²	104.5	64%	0.638	51%	0.509	S	S	*	.	H	α-helix	trans	-62.8	-44.8	176.2	-178.2	-177	-86	136.8	-11.7	111.7	R22 S23 E24 Y30	R22-R26 WeakPolarHBondContact O-CB 3.43Å; R22-R26 PolarHBondContact O-N 3.06Å; S23-R26 PolarHBondContact O-N 3.15Å; E24-R26 VanDerWaalsContact C-N 3.29Å; E24-R26 PolarHBondContact O-N 3.35Å; R26-Y30 WeakPolarHBondContact O-CB 3.38Å; R26-Y30 PolarHBondContact O-N 3.19Å
27	R	76.1	Confident	70.3	Confident	152 Å²	152	108.6 Å²	108.6	57%	0.574	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-47.2	179.5	-171.6	-174.3	-65.7	136.2	-3.8	111.8	S23 E24 Y30 Q31	S23-R27 WeakPolarHBondContact O-CB 3.48Å; S23-R27 PolarHBondContact O-N 3.47Å; E24-R27 PolarHBondContact O-N 3.07Å; R27-Y30 WeakPolarHBondContact O-CB 3.4Å; R27-Y30 PolarHBondContact O-N 2.78Å; R27-Q31 PolarHBondContact O-N 3.09Å
28	N	72.6	Confident	71.5	Confident	77 Å²	77	105.4 Å²	105.4	41%	0.412	51%	0.507	S	S	.	.	H	α-helix	trans	-64	-41.6	178.2	-76.3	-11.9	0	0	0	111.8	E24 Y30 Q31 R32	E24-N28 WeakPolarHBondContact O-CB 3.41Å; E24-N28 PolarHBondContact O-N 3.46Å; N28-Y30 VanDerWaalsContact C-N 3.33Å; N28-Y30 PolarHBondContact O-N 3.17Å; N28-Q31 PolarHBondContact O-N 3.42Å; N28-R32 WeakPolarHBondContact O-CB 3.48Å; N28-R32 VanDerWaalsContact O-CG 3.31Å; N28-R32 WeakPolarHBondContact O-CG 3.45Å; N28-R32 PolarHBondContact O-N 2.85Å
29	N	72.9	Confident	71.7	Confident	49 Å²	49	108.6 Å²	108.6	26%	0.262	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-37.7	174.3	-88	-21.4	0	0	0	112.8	V25 R33 Y50	V25-N29 VanDerWaalsContact O-CB 3.32Å; V25-N29 WeakPolarHBondContact O-CB 3.31Å; V25-N29 PolarHBondContact O-N 3.41Å; N29-R33 WeakPolarHBondContact O-CB 3.49Å; N29-R33 PolarHBondContact O-N 3.44Å; N29-Y50 VanDerWaalsContact OD1-CZ 3.24Å; N29-Y50 PolarHBondContact OD1-OH 3.24Å; N29-Y50 VanDerWaalsContact OD1-OH 3.08Å
30	Y	76.2	Confident	71.4	Confident	165 Å²	165	106.8 Å²	106.8	65%	0.647	49%	0.494	S	S	*	.	H	α-helix	trans	-64.1	-49.1	175.8	-179.4	-99.6	0	0	0	111.4	R26 R27 N28 R32 R33 C34	R26-Y30 WeakPolarHBondContact O-CB 3.38Å; R26-Y30 PolarHBondContact O-N 3.19Å; R27-Y30 WeakPolarHBondContact O-CB 3.4Å; R27-Y30 PolarHBondContact O-N 2.78Å; N28-Y30 VanDerWaalsContact C-N 3.33Å; N28-Y30 PolarHBondContact O-N 3.17Å; Y30-R32 PolarHBondContact O-N 3.34Å; Y30-R33 PolarHBondContact O-N 2.93Å; Y30-C34 PolarHBondContact O-N 3.36Å; Y30-C34 PolarHBondContact O-SG 3.48Å; Y30-C34 VanDerWaalsContact O-SG 3.39Å
31	Q	74.9	Confident	70.8	Confident	110 Å²	110	104.8 Å²	104.8	51%	0.514	49%	0.487	S	S	.	.	H	α-helix	trans	-60.4	-45	177.2	-76.1	178.9	-19.1	0	0	112.2	R27 N28 R33 C34 C35	R27-Q31 PolarHBondContact O-N 3.09Å; N28-Q31 PolarHBondContact O-N 3.42Å; Q31-R33 VanDerWaalsContact C-N 3.35Å; Q31-R33 PolarHBondContact O-N 2.86Å; Q31-C34 WeakPolarHBondContact O-CB 3.47Å; Q31-C34 PolarHBondContact O-N 3.24Å; Q31-C34 VanDerWaalsContact O-N 3.15Å; Q31-C35 PolarHBondContact O-N 2.98Å; Q31-C35 PolarHBondContact O-SG 2.99Å; Q31-C35 VanDerWaalsContact O-SG 3.41Å
32	R	65.6	Low	69.7	Low	92 Å²	92	111 Å²	111	35%	0.347	52%	0.516	S	S	.	.	H	α-helix	trans	-59.1	-43.4	175.4	-72.7	178.9	-164.5	-156.9	0	112.1	N28 Y30 C34 C35 Q36	N28-R32 WeakPolarHBondContact O-CB 3.48Å; N28-R32 VanDerWaalsContact O-CG 3.31Å; N28-R32 WeakPolarHBondContact O-CG 3.45Å; N28-R32 PolarHBondContact O-N 2.85Å; Y30-R32 PolarHBondContact O-N 3.34Å; R32-C34 VanDerWaalsContact C-N 3.35Å; R32-C34 PolarHBondContact O-N 3.41Å; R32-C35 PolarHBondContact O-N 3.23Å; R32-Q36 WeakPolarHBondContact O-CB 3.41Å; R32-Q36 PolarHBondContact O-N 2.65Å
33	R	67.2	Low	68.7	Low	143 Å²	143	111.4 Å²	111.4	54%	0.54	52%	0.519	S	S	.	.	H	α-helix	trans	-63.3	-38.1	174.8	-85.4	-176.3	167.4	-175.8	-2.5	112.7	N29 Y30 Q31 K37	N29-R33 WeakPolarHBondContact O-CB 3.49Å; N29-R33 PolarHBondContact O-N 3.44Å; Y30-R33 PolarHBondContact O-N 2.93Å; Q31-R33 VanDerWaalsContact C-N 3.35Å; Q31-R33 PolarHBondContact O-N 2.86Å; R33-K37 WeakPolarHBondContact O-CB 3.49Å; R33-K37 WeakPolarHBondContact O-CG 3.35Å; R33-K37 PolarHBondContact O-N 3.03Å
34	C	71.9	Confident	67.8	Low	44 Å²	44	109.6 Å²	109.6	30%	0.297	51%	0.508	S	S	.	.	H	α-helix	trans	-63.8	-46.5	174.6	-72.2	0	0	0	0	111.2	Y30 Q31 R32 K37 Q38	Y30-C34 PolarHBondContact O-N 3.36Å; Y30-C34 PolarHBondContact O-SG 3.48Å; Y30-C34 VanDerWaalsContact O-SG 3.39Å; Q31-C34 WeakPolarHBondContact O-CB 3.47Å; Q31-C34 PolarHBondContact O-N 3.24Å; Q31-C34 VanDerWaalsContact O-N 3.15Å; R32-C34 VanDerWaalsContact C-N 3.35Å; R32-C34 PolarHBondContact O-N 3.41Å; C34-K37 PolarHBondContact O-N 3.36Å; C34-Q38 WeakPolarHBondContact O-CG 3.18Å; C34-Q38 PolarHBondContact O-N 2.97Å
35	C	70.8	Confident	66.9	Low	61 Å²	61	109.7 Å²	109.7	41%	0.412	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-45.7	175	-65.8	0	0	0	0	111.6	Q31 R32 K37 Q38 F39	Q31-C35 PolarHBondContact O-N 2.98Å; Q31-C35 PolarHBondContact O-SG 2.99Å; Q31-C35 VanDerWaalsContact O-SG 3.41Å; R32-C35 PolarHBondContact O-N 3.23Å; C35-K37 PolarHBondContact O-N 2.95Å; C35-Q38 WeakPolarHBondContact O-CB 3.35Å; C35-Q38 PolarHBondContact O-N 3.19Å; C35-F39 HydrophobicContact CB-CD2 4.26Å; C35-F39 HydrophobicContact CB-CE2 4.43Å; C35-F39 WeakPolarHBondContact O-CD2 3.5Å; C35-F39 PolarHBondContact O-N 3.25Å
36	Q	63.6	Low	66.2	Low	61 Å²	61	112.5 Å²	112.5	29%	0.285	53%	0.534	S	S	.	.	H	α-helix	trans	-61.8	-42.7	179.6	-163.2	175.1	12.9	0	0	112.1	R32 Q38 F39 E40 A44	R32-Q36 WeakPolarHBondContact O-CB 3.41Å; R32-Q36 PolarHBondContact O-N 2.65Å; Q36-Q38 VanDerWaalsContact C-N 3.26Å; Q36-Q38 PolarHBondContact O-N 2.72Å; Q36-F39 PolarHBondContact O-N 2.94Å; Q36-E40 HydrophobicContact CG-CB 4.24Å; Q36-E40 HydrophobicContact CG-CG 4.18Å; Q36-E40 WeakPolarHBondContact CG-OE2 3.47Å; Q36-E40 PolarHBondContact NE2-OE2 2.88Å; Q36-E40 WeakPolarHBondContact O-CA 3.35Å; Q36-E40 WeakPolarHBondContact O-CB 3.4Å; Q36-E40 PolarHBondContact O-N 3.33Å; Q36-A44 HydrophobicContact CG-CB 3.99Å
37	K	69.4	Low	65.5	Low	167 Å²	167	111.8 Å²	111.8	73%	0.726	54%	0.543	S	S	*	.	H	α-helix	trans	-61.7	-33.6	173	-79.8	-174.9	174.8	-172.7	0	112.9	R33 C34 C35	R33-K37 WeakPolarHBondContact O-CB 3.49Å; R33-K37 WeakPolarHBondContact O-CG 3.35Å; R33-K37 PolarHBondContact O-N 3.03Å; C34-K37 PolarHBondContact O-N 3.36Å; C35-K37 PolarHBondContact O-N 2.95Å
38	Q	71.7	Confident	64.3	Low	153 Å²	153	110.5 Å²	110.5	72%	0.715	55%	0.546	S	S	*	.	H	α-helix	trans	-76.5	-38.9	178.7	-76.4	175.9	-20.3	0	0	112.9	C34 C35 Q36	C34-Q38 WeakPolarHBondContact O-CG 3.18Å; C34-Q38 PolarHBondContact O-N 2.97Å; C35-Q38 WeakPolarHBondContact O-CB 3.35Å; C35-Q38 PolarHBondContact O-N 3.19Å; Q36-Q38 VanDerWaalsContact C-N 3.26Å; Q36-Q38 PolarHBondContact O-N 2.72Å
39	F	65.6	Low	63.1	Low	169 Å²	169	111.3 Å²	111.3	74%	0.741	56%	0.564	S	S	*	*	H	α-helix	trans	-97.3	-34	-173.7	-69.5	-70.9	0	0	0	114.6	C35 Q36	C35-F39 HydrophobicContact CB-CD2 4.26Å; C35-F39 HydrophobicContact CB-CE2 4.43Å; C35-F39 WeakPolarHBondContact O-CD2 3.5Å; C35-F39 PolarHBondContact O-N 3.25Å; Q36-F39 PolarHBondContact O-N 2.94Å
40	E	61.8	Low	61.7	Low	79 Å²	79	114.6 Å²	114.6	37%	0.369	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.6	-4.5	-175.7	-61.3	-179.4	-179.1	0	0	113.4	Q36	Q36-E40 HydrophobicContact CG-CB 4.24Å; Q36-E40 HydrophobicContact CG-CG 4.18Å; Q36-E40 WeakPolarHBondContact CG-OE2 3.47Å; Q36-E40 PolarHBondContact NE2-OE2 2.88Å; Q36-E40 WeakPolarHBondContact O-CA 3.35Å; Q36-E40 WeakPolarHBondContact O-CB 3.4Å; Q36-E40 PolarHBondContact O-N 3.33Å
41	G	61.5	Low	60.5	Low	36 Å²	36	117.9 Å²	117.9	37%	0.371	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	65.4	-161.3	-179	0	0	0	0	0	114	Y43	G41-Y43 PolarHBondContact O-N 2.82Å
42	L	55	Low	59	Low	180 Å²	180	118.4 Å²	118.4	94%	0.942	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-68.9	3.1	-178.2	-75.3	162.6	0	0	0	114.4
43	Y	54.2	Low	57.6	Low	214 Å²	214	120.6 Å²	120.6	84%	0.839	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-96.8	6	-172.6	-76.4	-80.9	0	0	0	114.7	G41 P45	G41-Y43 PolarHBondContact O-N 2.82Å; Y43-P45 VanDerWaalsContact O-CD 3.24Å; Y43-P45 WeakPolarHBondContact O-CD 3.39Å
44	A	55.2	Low	56.2	Low	31 Å²	31	117.3 Å²	117.3	26%	0.256	62%	0.616	S	S	.	*			trans	-68.4	115.9	174.5	0	0	0	0	0	111.5	Q36 T46	Q36-A44 HydrophobicContact CG-CB 3.99Å; A44-T46 PolarHBondContact O-N 3.23Å
45	P	55.8	Low	54.5	Low	90 Å²	90	123.6 Å²	123.6	58%	0.584	64%	0.641	S	S	*	*			trans	-63.3	132.5	178.2	-17.9	31	0	0	0	110.8	Y43 N47 L48	Y43-P45 VanDerWaalsContact O-CD 3.24Å; Y43-P45 WeakPolarHBondContact O-CD 3.39Å; P45-N47 PolarHBondContact O-N 2.9Å; P45-N47 VanDerWaalsContact O-N 3.11Å; P45-L48 HydrophobicContact CB-CD1 4.39Å; P45-L48 HydrophobicContact CG-CD1 4.47Å
46	T	55.5	Low	53.3	Low	120 Å²	120	126 Å²	126	74%	0.736	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-9.2	-166.5	-10.9	0	0	0	0	114.5	A44	A44-T46 PolarHBondContact O-N 3.23Å
47	N	57	Low	52.1	Low	155 Å²	155	130.9 Å²	130.9	83%	0.829	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	15.6	-160.2	-62.7	-18.6	0	0	0	116.2	P45	P45-N47 PolarHBondContact O-N 2.9Å; P45-N47 VanDerWaalsContact O-N 3.11Å
48	L	51.8	Low	50.7	Low	124 Å²	124	126.6 Å²	126.6	65%	0.649	67%	0.667	S	S	*	*	S	Bend	trans	-103.7	153	177.6	-73.6	172.6	0	0	0	113.2	P45	P45-L48 HydrophobicContact CB-CD1 4.39Å; P45-L48 HydrophobicContact CG-CD1 4.47Å
49	A	47.6	Very low	49.5	Very low	95 Å²	95	125.3 Å²	125.3	79%	0.785	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-63.1	138.3	169.1	0	0	0	0	0	110.4	R51	A49-R51 PolarHBondContact O-N 3.38Å
50	Y	44.2	Very low	48.8	Very low	117 Å²	117	120.4 Å²	120.4	46%	0.459	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-53.3	124.7	-174.5	-57.2	-83.4	0	0	0	112.6	N29	N29-Y50 VanDerWaalsContact OD1-CZ 3.24Å; N29-Y50 PolarHBondContact OD1-OH 3.24Å; N29-Y50 VanDerWaalsContact OD1-OH 3.08Å
51	R	50.8	Low	48.5	Very low	234 Å²	234	120.3 Å²	120.3	88%	0.883	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-93.5	120.3	172.3	-155.5	177.2	-160.5	-178.2	5	108.8	A49 L53	A49-R51 PolarHBondContact O-N 3.38Å; R51-L53 PolarHBondContact O-N 2.83Å
52	E	43.2	Very low	48.6	Very low	121 Å²	121	122.6 Å²	122.6	57%	0.565	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-66.1	118.8	167.4	-73.7	177.4	-166.5	0	0	108.1	N11 G54	N11-E52 PolarHBondContact OD1-OE1 3.48Å; N11-E52 VanDerWaalsContact OD1-OE1 3.13Å; E52-G54 PolarHBondContact O-N 3.12Å
53	L	36	Very low	48.9	Very low	138 Å²	138	118 Å²	118	72%	0.723	64%	0.64	S	S	*	*			trans	-66.2	115.7	169.6	-80.1	164.5	0	0	0	107.8	R51	R51-L53 PolarHBondContact O-N 2.83Å
54	G	37	Very low	49	Very low	75 Å²	75	111.9 Å²	111.9	77%	0.773	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-53.5	136.5	-179	0	0	0	0	0	112.5	E52	E52-G54 PolarHBondContact O-N 3.12Å
55	H	37.9	Very low	49.4	Very low	176 Å²	176	115 Å²	115	82%	0.815	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-51.2	152.7	174	-81.9	-57.3	0	0	0	113.1	L57	H55-L57 PolarHBondContact O-N 3.06Å
56	P	44.4	Very low	49.8	Very low	111 Å²	111	116.4 Å²	116.4	72%	0.721	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-56.2	129	178.5	22.3	-32.4	0	0	0	111.2	I58	P56-I58 PolarHBondContact O-N 2.94Å; P56-I58 VanDerWaalsContact O-N 3.09Å
57	L	38.5	Very low	49.8	Very low	163 Å²	163	112.8 Å²	112.8	85%	0.853	61%	0.609	S	S	*	*			trans	-54.3	112.1	167.1	-94	142.6	0	0	0	109.1	H55 V59	H55-L57 PolarHBondContact O-N 3.06Å; L57-V59 HydrophobicContact CB-CG2 4.36Å; L57-V59 PolarHBondContact O-N 3.24Å
58	I	41.1	Very low	49.8	Very low	77 Å²	77	110.3 Å²	110.3	40%	0.395	60%	0.6	S	S	.	*			trans	-77.4	98.7	171.3	-58.8	174.2	0	0	0	106.8	P56 D60 L63 L64	P56-I58 PolarHBondContact O-N 2.94Å; P56-I58 VanDerWaalsContact O-N 3.09Å; I58-D60 VanDerWaalsContact C-N 3.28Å; I58-L63 HydrophobicContact CG2-CB 3.56Å; I58-L64 HydrophobicContact CG2-CB 4.42Å
59	V	45.4	Very low	50.4	Low	126 Å²	126	109.4 Å²	109.4	76%	0.764	60%	0.595	S	S	*	*			trans	-82.8	-5.9	-178.4	-169.3	0	0	0	0	112.3	L57	L57-V59 HydrophobicContact CB-CG2 4.36Å; L57-V59 PolarHBondContact O-N 3.24Å
60	D	51.8	Low	50.5	Low	66 Å²	66	108 Å²	108	35%	0.353	59%	0.59	S	S	.	*			trans	-99.7	115.2	178.6	-177.1	-4.2	0	0	0	111.2	I58 T62 L63 L64	I58-D60 VanDerWaalsContact C-N 3.28Å; D60-T62 PolarHBondContact O-N 3.01Å; D60-T62 VanDerWaalsContact O-N 3.15Å; D60-T62 WeakPolarHBondContact OD1-CB 3.37Å; D60-T62 PolarHBondContact OD1-N 3.19Å; D60-T62 PolarHBondContact OD1-OG1 2.95Å; D60-L63 HydrophobicContact CB-CB 4.19Å; D60-L63 HydrophobicContact CB-CD1 4.09Å; D60-L63 HydrophobicContact CB-CG 4.46Å; D60-L63 PolarHBondContact O-N 3.4Å; D60-L64 PolarHBondContact O-N 3Å
61	P	54.5	Low	50.8	Low	77 Å²	77	110.8 Å²	110.8	50%	0.5	60%	0.601	S	S	.	*	H	α-helix	trans	-59.1	-26.6	179.4	23.2	-32.4	0	0	0	112.9	L64 I65	P61-L64 PolarHBondContact O-N 3.45Å; P61-I65 WeakPolarHBondContact O-CD1 3.4Å; P61-I65 VanDerWaalsContact O-CG1 3.22Å; P61-I65 WeakPolarHBondContact O-CG1 3.34Å; P61-I65 PolarHBondContact O-N 3.37Å
62	T	63.6	Low	50.4	Low	85 Å²	85	104.4 Å²	104.4	52%	0.521	58%	0.583	S	S	.	*	H	α-helix	trans	-71.7	-35.2	177.6	-14.8	0	0	0	0	112.3	D60 K66	D60-T62 PolarHBondContact O-N 3.01Å; D60-T62 VanDerWaalsContact O-N 3.15Å; D60-T62 WeakPolarHBondContact OD1-CB 3.37Å; D60-T62 PolarHBondContact OD1-N 3.19Å; D60-T62 PolarHBondContact OD1-OG1 2.95Å; T62-K66 WeakPolarHBondContact O-CG 3.37Å; T62-K66 PolarHBondContact O-N 3.36Å; T62-K66 VanDerWaalsContact O-N 3.14Å
63	L	61.7	Low	50.2	Low	82 Å²	82	104.2 Å²	104.2	43%	0.429	59%	0.593	S	S	.	*	H	α-helix	trans	-79.1	-30.8	175.1	-82	164.3	0	0	0	112	I58 D60 K66 S67	I58-L63 HydrophobicContact CG2-CB 3.56Å; D60-L63 HydrophobicContact CB-CB 4.19Å; D60-L63 HydrophobicContact CB-CD1 4.09Å; D60-L63 HydrophobicContact CB-CG 4.46Å; D60-L63 PolarHBondContact O-N 3.4Å; L63-K66 PolarHBondContact O-N 3.4Å; L63-S67 WeakPolarHBondContact O-CB 3.22Å; L63-S67 PolarHBondContact O-N 2.94Å
64	L	55.8	Low	50.2	Low	87 Å²	87	107 Å²	107	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-63	-47.1	170	-173.6	70.2	0	0	0	110.6	I58 D60 P61 K66 S67 T68	I58-L64 HydrophobicContact CG2-CB 4.42Å; D60-L64 PolarHBondContact O-N 3Å; P61-L64 PolarHBondContact O-N 3.45Å; L64-K66 VanDerWaalsContact C-N 3.35Å; L64-K66 PolarHBondContact O-N 2.91Å; L64-S67 PolarHBondContact O-N 2.94Å; L64-S67 PolarHBondContact O-OG 3.19Å; L64-S67 VanDerWaalsContact O-OG 3.05Å; L64-T68 WeakPolarHBondContact O-CG2 3.41Å; L64-T68 PolarHBondContact O-N 3.12Å; L64-T68 PolarHBondContact O-OG1 2.63Å
65	I	64.6	Low	50	Low	96 Å²	96	114.4 Å²	114.4	49%	0.492	61%	0.607	S	S	.	*	H	α-helix	trans	-61.4	-43.7	176.5	-68.5	164.5	0	0	0	110.5	P61 S67 T68 L69	P61-I65 WeakPolarHBondContact O-CD1 3.4Å; P61-I65 VanDerWaalsContact O-CG1 3.22Å; P61-I65 WeakPolarHBondContact O-CG1 3.34Å; P61-I65 PolarHBondContact O-N 3.37Å; I65-S67 PolarHBondContact O-N 3.37Å; I65-T68 WeakPolarHBondContact CA-OG1 3.19Å; I65-T68 PolarHBondContact O-N 3.46Å; I65-T68 PolarHBondContact O-OG1 2.79Å; I65-L69 HydrophobicContact CG2-CD1 3.63Å; I65-L69 HydrophobicContact CG2-CG 4.34Å; I65-L69 WeakPolarHBondContact O-CB 3.14Å; I65-L69 VanDerWaalsContact O-CG 3.23Å; I65-L69 WeakPolarHBondContact O-CG 3.42Å; I65-L69 PolarHBondContact O-N 2.9Å
66	K	63.7	Low	49.7	Very low	119 Å²	119	112.3 Å²	112.3	52%	0.517	61%	0.609	S	S	.	*	H	α-helix	trans	-66.1	-33.3	176.3	-76.1	179.4	178	-179.1	0	114.2	T62 L63 L64 G70 Y71	T62-K66 WeakPolarHBondContact O-CG 3.37Å; T62-K66 PolarHBondContact O-N 3.36Å; T62-K66 VanDerWaalsContact O-N 3.14Å; L63-K66 PolarHBondContact O-N 3.4Å; L64-K66 VanDerWaalsContact C-N 3.35Å; L64-K66 PolarHBondContact O-N 2.91Å; K66-G70 PolarHBondContact O-N 3.13Å; K66-Y71 PolarHBondContact O-N 2.93Å
67	S	54.6	Low	49.1	Very low	44 Å²	44	114.3 Å²	114.3	31%	0.308	61%	0.613	S	S	.	*	H	α-helix	trans	-72.3	-42.1	174.7	83.1	0	0	0	0	111.4	L63 L64 I65 L69 G70	L63-S67 WeakPolarHBondContact O-CB 3.22Å; L63-S67 PolarHBondContact O-N 2.94Å; L64-S67 PolarHBondContact O-N 2.94Å; L64-S67 PolarHBondContact O-OG 3.19Å; L64-S67 VanDerWaalsContact O-OG 3.05Å; I65-S67 PolarHBondContact O-N 3.37Å; S67-L69 VanDerWaalsContact C-N 3.27Å; S67-L69 PolarHBondContact O-N 2.66Å; S67-G70 PolarHBondContact O-N 3.43Å; S67-G70 VanDerWaalsContact O-N 3.15Å
68	T	58	Low	48.9	Very low	103 Å²	103	115.4 Å²	115.4	63%	0.632	62%	0.616	S	S	*	*	H	α-helix	trans	-66.4	-27.9	176.3	55.1	0	0	0	0	113.2	L64 I65 G70	L64-T68 WeakPolarHBondContact O-CG2 3.41Å; L64-T68 PolarHBondContact O-N 3.12Å; L64-T68 PolarHBondContact O-OG1 2.63Å; I65-T68 WeakPolarHBondContact CA-OG1 3.19Å; I65-T68 PolarHBondContact O-N 3.46Å; I65-T68 PolarHBondContact O-OG1 2.79Å; T68-G70 VanDerWaalsContact C-N 3.34Å
69	L	64.4	Low	48.5	Very low	106 Å²	106	120.2 Å²	120.2	56%	0.555	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	5.4	175.9	-67.6	172.4	0	0	0	113.6	I65 S67 Y71	I65-L69 HydrophobicContact CG2-CD1 3.63Å; I65-L69 HydrophobicContact CG2-CG 4.34Å; I65-L69 WeakPolarHBondContact O-CB 3.14Å; I65-L69 VanDerWaalsContact O-CG 3.23Å; I65-L69 WeakPolarHBondContact O-CG 3.42Å; I65-L69 PolarHBondContact O-N 2.9Å; S67-L69 VanDerWaalsContact C-N 3.27Å; S67-L69 PolarHBondContact O-N 2.66Å; L69-Y71 VanDerWaalsContact C-N 3.3Å; L69-Y71 HydrophobicContact CB-CD2 3.42Å; L69-Y71 VanDerWaalsContact CB-CD2 3.42Å; L69-Y71 HydrophobicContact CB-CE2 3.71Å; L69-Y71 HydrophobicContact CD1-CD2 4.45Å; L69-Y71 HydrophobicContact CD1-CE2 4.45Å; L69-Y71 VanDerWaalsContact O-CD2 3.25Å; L69-Y71 WeakPolarHBondContact O-CD2 3.03Å; L69-Y71 WeakPolarHBondContact O-CE2 3.18Å; L69-Y71 PolarHBondContact O-N 3.46Å
70	G	49.5	Very low	47.7	Very low	66 Å²	66	122.5 Å²	122.5	68%	0.68	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.7	16.3	174.8	0	0	0	0	0	115.5	K66 S67 T68 I72	K66-G70 PolarHBondContact O-N 3.13Å; S67-G70 PolarHBondContact O-N 3.43Å; S67-G70 VanDerWaalsContact O-N 3.15Å; T68-G70 VanDerWaalsContact C-N 3.34Å; G70-I72 PolarHBondContact O-N 3.15Å
71	Y	49.8	Very low	46.8	Very low	175 Å²	175	123.2 Å²	123.2	69%	0.686	67%	0.666	S	S	*	*			trans	-93.8	24.4	-171.1	-74.2	-67.5	0	0	0	115.1	K66 L69 P73	K66-Y71 PolarHBondContact O-N 2.93Å; L69-Y71 VanDerWaalsContact C-N 3.3Å; L69-Y71 HydrophobicContact CB-CD2 3.42Å; L69-Y71 VanDerWaalsContact CB-CD2 3.42Å; L69-Y71 HydrophobicContact CB-CE2 3.71Å; L69-Y71 HydrophobicContact CD1-CD2 4.45Å; L69-Y71 HydrophobicContact CD1-CE2 4.45Å; L69-Y71 VanDerWaalsContact O-CD2 3.25Å; L69-Y71 WeakPolarHBondContact O-CD2 3.03Å; L69-Y71 WeakPolarHBondContact O-CE2 3.18Å; L69-Y71 PolarHBondContact O-N 3.46Å; Y71-P73 WeakPolarHBondContact O-CD 3.34Å
72	I	42.4	Very low	45.7	Very low	100 Å²	100	126.8 Å²	126.8	51%	0.513	68%	0.676	S	S	.	*			trans	-99.4	115	178.8	-57.4	179.6	0	0	0	110.6	G70	G70-I72 PolarHBondContact O-N 3.15Å
73	P	38.8	Very low	44.3	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	70%	0.696	S	S	*	*			trans	-66.3	140	179	-16.5	29.9	0	0	0	112.7	Y71	Y71-P73 WeakPolarHBondContact O-CD 3.34Å
74	Q	35.6	Very low	43.2	Very low	195 Å²	195	132.9 Å²	132.9	91%	0.911	71%	0.707	S	S	*	*			trans	-63.4	128.6	171.8	-68.2	176.2	-1.6	0	0	111.1
75	R	32.9	Very low	42.1	Very low	232 Å²	232	133.9 Å²	133.9	88%	0.875	72%	0.721	S	S	*	*			trans	20.7	130.8	163.7	-67	-175.3	-178.3	166.6	2.9	119.8
76	P	32.1	Very low	40.7	Very low	132 Å²	132	137.8 Å²	137.8	86%	0.857	74%	0.737	S	S	*	*			trans	-89.1	110.4	149.7	6.7	12.7	0	0	0	111.6
77	N	31.8	Very low	39.2	Very low	152 Å²	152	137.1 Å²	137.1	81%	0.813	75%	0.747	S	S	*	*			trans	33.9	103.4	143.8	-63.3	-19.2	0	0	0	120.5
78	M	33.6	Very low	38.4	Very low	187 Å²	187	140.7 Å²	140.7	92%	0.921	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-84.8	128.9	144.5	-75.5	-93.1	-71.6	0	0	108.5
79	L	33.4	Very low	37.3	Very low	177 Å²	177	144.9 Å²	144.9	93%	0.927	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-49.7	139	-178.4	-79.4	146.6	0	0	0	113.8
80	H	29.5	Very low	35.9	Very low	175 Å²	175	143 Å²	143	81%	0.81	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-65.5	137.8	175.6	-80.2	43.4	0	0	0	112.5
81	G	31.7	Very low	35.5	Very low	80 Å²	80	146.1 Å²	146.1	83%	0.825	79%	0.791	S	S	*	*			trans	-131.2	102	155.3	0	0	0	0	0	107
82	H	31.1	Very low	34.9	Very low	152 Å²	152	146.9 Å²	146.9	70%	0.704	80%	0.801	S	S	*	*			trans	-68.2	139.8	-173.1	-142	-88.3	0	0	0	110.9
83	E	34.7	Very low	34.7	Very low	200 Å²	200	145.6 Å²	145.6	94%	0.935	81%	0.812	S	S	*	*			trans	-168.8	108.7	142.3	-106.6	167.3	-145.3	0	0	109.2
84	S	39.3	Very low	34.7	Very low	96 Å²	96	150 Å²	150	67%	0.671	82%	0.82	S	S	*	*			trans	-90	138.5	174.4	41.8	0	0	0	0	110.4
85	S	33.1	Very low	34.8	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	81%	0.812	S	S	*	*			trans	-36.5	148	169.4	55.6	0	0	0	0	116.8
86	E	35.7	Very low	34.8	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	80%	0.803	S	S	*	*				-167.4	135.9	110.8	-140.5	155.6	-169.3	0	0	112
87	C	30.7	Very low	35.1	Very low	106 Å²	106	140.9 Å²	140.9	72%	0.716	80%	0.802	S	S	*	*			trans	38.1	137.9	143.6	-62.9	0	0	0	0	120.5
88	T	38	Very low	35.2	Very low	118 Å²	118	142.3 Å²	142.3	72%	0.724	80%	0.804	S	S	*	*			cis	-177.6	148.6	32.5	5.2	0	0	0	0	109
89	E	34.5	Very low	35.4	Very low	191 Å²	191	143.1 Å²	143.1	89%	0.893	81%	0.806	S	S	*	*			trans	40.6	130.3	144.9	-68.5	179.9	154.6	0	0	123.6
90	G	36	Very low	35.4	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	80%	0.799	S	S	*	*				124.8	96.1	129	0	0	0	0	0	116
91	V	40.7	Very low	35.3	Very low	130 Å²	130	142.6 Å²	142.6	79%	0.788	80%	0.796	S	S	*	*				98.3	110.4	103.1	173.9	0	0	0	0	113.3
92	E	37.6	Very low	35.4	Very low	191 Å²	191	144.6 Å²	144.6	89%	0.893	79%	0.793	S	S	*	*			trans	52.9	132.4	141.4	-62.6	-179.5	168.3	0	0	123.2
93	G	37.8	Very low	35.3	Very low	73 Å²	73	147 Å²	147	75%	0.753	80%	0.802	S	S	*	*			trans	149.1	98.3	140	0	0	0	0	0	116.3
94	K	39.1	Very low	35.3	Very low	211 Å²	211	144.9 Å²	144.9	92%	0.917	80%	0.797	S	S	*	*			trans	7	143.1	140	-65.3	166.8	178.1	172.5	0	116.7
95	S	37.2	Very low	34.9	Very low	107 Å²	107	149.5 Å²	149.5	75%	0.748	81%	0.805	S	S	*	*			cis	-170.9	170.5	27.8	51.2	0	0	0	0	109.8
96	C	33	Very low	34.9	Very low	103 Å²	103	150.5 Å²	150.5	70%	0.696	81%	0.807	S	S	*	*			trans	-9.4	137.5	151.3	-57.4	0	0	0	0	116.3
97	D	39.4	Very low	34.6	Very low	156 Å²	156	146.9 Å²	146.9	83%	0.834	80%	0.801	S	S	*	*				-161.5	166.4	67.6	-81.8	-48.5	0	0	0	113.6
98	E	34.1	Very low	34.7	Very low	183 Å²	183	149.8 Å²	149.8	86%	0.855	81%	0.808	S	S	*	*			trans	-50.5	138.4	175	-57.3	176.8	149.2	0	0	113.6
99	E	37.5	Very low	34.5	Very low	203 Å²	203	149.6 Å²	149.6	95%	0.949	81%	0.807	S	S	*	*			trans	-164.4	154.4	135.2	-111.3	175.8	-159.5	0	0	112.7
100	Q	32.4	Very low	34.6	Very low	166 Å²	166	146.1 Å²	146.1	78%	0.776	80%	0.804	S	S	*	*			trans	-101.5	167.4	-155.6	-147.5	173.9	69.4	0	0	109.6
101	F	28.6	Very low	34.8	Very low	175 Å²	175	150.6 Å²	150.6	77%	0.768	81%	0.807	S	S	*	*			trans	73.7	117.5	169.2	-79.6	-98.6	0	0	0	116.7
102	T	33.6	Very low	34.9	Very low	123 Å²	123	149.8 Å²	149.8	76%	0.755	81%	0.807	S	S	*	*				-173.5	144.1	69.2	24.8	0	0	0	0	110.9
103	F	28.4	Very low	35	Very low	203 Å²	203	147.8 Å²	147.8	89%	0.89	80%	0.801	S	S	*	*			trans	-61.1	126.8	172	-103.4	-103.8	0	0	0	111.9
104	N	35.4	Very low	35.2	Very low	155 Å²	155	151 Å²	151	83%	0.829	80%	0.796	S	S	*	*			trans	-116.8	106.1	155.4	-85.8	-29.8	0	0	0	110.7	T106	N104-T106 PolarHBondContact O-N 2.86Å
105	K	30.6	Very low	35.3	Very low	192 Å²	192	150.6 Å²	150.6	84%	0.835	79%	0.794	S	S	*	*			trans	-61.7	107.7	170.1	175.9	-177.7	-179.4	-178.7	0	109.8
106	T	32.4	Very low	35.4	Very low	130 Å²	130	150.7 Å²	150.7	80%	0.798	80%	0.795	S	S	*	*			trans	-107.7	102.3	160.4	35.2	0	0	0	0	109.2	N104 L108	N104-T106 PolarHBondContact O-N 2.86Å; T106-L108 PolarHBondContact O-N 3.34Å
107	S	29.1	Very low	35.4	Very low	100 Å²	100	151.1 Å²	151.1	70%	0.699	80%	0.798	S	S	*	*			trans	-60.2	117.9	166.4	48.9	0	0	0	0	109.9
108	L	32.4	Very low	35.4	Very low	168 Å²	168	151.6 Å²	151.6	88%	0.88	80%	0.795	S	S	*	*			trans	-105.3	120.7	163.3	-82.2	161.9	0	0	0	108.6	T106	T106-L108 PolarHBondContact O-N 3.34Å
109	T	34.6	Very low	35.6	Very low	114 Å²	114	148.2 Å²	148.2	70%	0.699	79%	0.789	S	S	*	*			trans	-69.9	151.1	-169.9	42.2	0	0	0	0	112.7	E111	T109-E111 PolarHBondContact O-N 2.77Å
110	S	36.8	Very low	35.4	Very low	117 Å²	117	147 Å²	147	82%	0.818	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	25.4	-168.2	49.5	0	0	0	0	116.3
111	E	40	Very low	35.6	Very low	163 Å²	163	150.2 Å²	150.2	76%	0.762	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	-5	-167.9	-117.3	175.9	168.9	0	0	115.4	T109	T109-E111 PolarHBondContact O-N 2.77Å
112	S	43.4	Very low	36	Very low	113 Å²	113	147.9 Å²	147.9	79%	0.79	80%	0.796	S	S	*	*	S	Bend	trans	-103.3	0.1	-177.5	-88.2	0	0	0	0	116.1
113	I	39.8	Very low	36.3	Very low	149 Å²	149	151 Å²	151	76%	0.764	80%	0.799	S	S	*	*	S	Bend	trans	-97.9	-10.9	180	-63.4	174.4	0	0	0	112.3	K115	I113-K115 PolarHBondContact O-N 3.25Å
114	E	40.9	Very low	36.6	Very low	140 Å²	140	147.7 Å²	147.7	65%	0.654	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-2.6	-177.2	-75.6	-163.5	139.6	0	0	115.9	K155	E114-K155 IonicContact OE1-NZ 3.76Å
115	K	42.5	Very low	36.8	Very low	203 Å²	203	147 Å²	147	88%	0.883	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-1.3	-178.7	-75.5	-179.7	178.5	173.7	0	115.9	I113	I113-K115 PolarHBondContact O-N 3.25Å
116	S	38.2	Very low	37	Very low	108 Å²	108	140.8 Å²	140.8	76%	0.755	79%	0.789	S	S	*	*	S	Bend	trans	-105.5	-3.1	-174.8	-176.2	0	0	0	0	115.3
117	C	33.4	Very low	37.1	Very low	113 Å²	113	142.8 Å²	142.8	76%	0.764	79%	0.791	S	S	*	*			trans	-125.9	33.2	-171.7	-67.2	0	0	0	0	114.1
118	Q	38.8	Very low	37.4	Very low	165 Å²	165	144.3 Å²	144.3	77%	0.771	79%	0.792	S	S	*	*			trans	-96.8	125.4	171.9	-70.8	-136.7	-10.8	0	0	111.4	L120	Q118-L120 PolarHBondContact O-N 3.41Å
119	P	38.2	Very low	37.7	Very low	112 Å²	112	143.8 Å²	143.8	73%	0.727	79%	0.79	S	S	*	*			trans	-65	125.9	165.7	-3.5	18.3	0	0	0	108.2	R121	P119-R121 PolarHBondContact O-N 3.45Å
120	L	34.1	Very low	37.7	Very low	179 Å²	179	148.4 Å²	148.4	94%	0.937	80%	0.8	S	S	*	*			trans	-56.3	96.6	175.4	-69.7	164.9	0	0	0	110.2	Q118	Q118-L120 PolarHBondContact O-N 3.41Å
121	R	36.7	Very low	37.6	Very low	233 Å²	233	148 Å²	148	88%	0.879	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78.8	132.3	162.1	-75.9	-172.3	-178.7	175.6	1.6	108.7	P119 K123	P119-R121 PolarHBondContact O-N 3.45Å; R121-K123 PolarHBondContact O-N 3.17Å
122	P	37.5	Very low	37.3	Very low	126 Å²	126	151.2 Å²	151.2	82%	0.818	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.5	133.8	166.4	-15.4	29	0	0	0	109.8
123	K	40.1	Very low	37	Very low	189 Å²	189	151.9 Å²	151.9	82%	0.822	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.9	141.8	174.5	-76.1	175.6	174	175.8	0	110.6	R121 V125	R121-K123 PolarHBondContact O-N 3.17Å; K123-V125 PolarHBondContact O-N 3.42Å
124	P	34.4	Very low	36.6	Very low	132 Å²	132	154.4 Å²	154.4	86%	0.857	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.7	117.9	169.2	31.4	-28.3	0	0	0	108.4
125	V	38.7	Very low	36.6	Very low	140 Å²	140	152.3 Å²	152.3	85%	0.848	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-95	131	164.5	178.6	0	0	0	0	107	K123	K123-V125 PolarHBondContact O-N 3.42Å
126	G	35.3	Very low	36.5	Very low	63 Å²	63	147.7 Å²	147.7	65%	0.649	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78	160.1	-168.3	0	0	0	0	0	115.6
127	M	34.8	Very low	37	Very low	171 Å²	171	148.9 Å²	148.9	84%	0.842	79%	0.789	S	S	*	*			trans	62.7	121.1	147.9	-65.1	-73.2	159.9	0	0	119
128	N	35	Very low	37.8	Very low	133 Å²	133	144 Å²	144	71%	0.711	76%	0.756	S	S	*	*			trans	75.9	93.6	151.4	-55.9	-14.6	0	0	0	117.4
129	D	38.2	Very low	38.1	Very low	156 Å²	156	138.5 Å²	138.5	83%	0.834	74%	0.743	S	S	*	*				168.9	131.2	108.7	-81.9	-27.4	0	0	0	110.3
130	K	35.6	Very low	39	Very low	211 Å²	211	135.7 Å²	135.7	92%	0.917	73%	0.726	S	S	*	*			trans	-66.8	139.5	176.2	-72.3	175.3	177.8	173.6	0	109.4
131	P	34.1	Very low	40	Very low	110 Å²	110	129 Å²	129	71%	0.714	70%	0.697	S	S	*	*				-136.9	150.5	115.3	23.9	-5.3	0	0	0	113.8	T133	P131-T133 PolarHBondContact O-N 2.87Å
132	R	34	Very low	40.5	Very low	229 Å²	229	121.6 Å²	121.6	86%	0.864	67%	0.669	S	S	*	*			trans	-51.5	122	168.5	-82.8	171.9	164.2	-171.8	-5.1	110.7
133	T	35.9	Very low	41.2	Very low	128 Å²	128	118.5 Å²	118.5	79%	0.785	65%	0.645	S	S	*	*			trans	-143.7	113.5	160.5	-13.2	0	0	0	0	109.8	P131 S135	P131-T133 PolarHBondContact O-N 2.87Å; T133-S135 PolarHBondContact O-N 3.13Å
134	Y	32	Very low	41.8	Very low	202 Å²	202	114 Å²	114	79%	0.792	63%	0.626	S	S	*	*			trans	-64.4	118.9	173.7	-75.7	-95	0	0	0	109.4
135	S	41.2	Very low	42.7	Very low	95 Å²	95	114.5 Å²	114.5	66%	0.664	61%	0.611	S	S	*	*			trans	-113	123.2	172.6	70.5	0	0	0	0	111.3	T133 Q137	T133-S135 PolarHBondContact O-N 3.13Å; S135-Q137 PolarHBondContact O-N 3.04Å
136	S	39.3	Very low	43.3	Very low	106 Å²	106	115.8 Å²	115.8	74%	0.741	60%	0.601	S	S	*	*			trans	-49	110.5	175.5	-58.2	0	0	0	0	113.8
137	Q	49	Very low	44.1	Very low	134 Å²	134	119 Å²	119	63%	0.626	59%	0.593	S	S	*	*			trans	-148.4	92.5	171	-74.3	-176.2	-13.1	0	0	108.9	S135	S135-Q137 PolarHBondContact O-N 3.04Å
138	S	50.1	Low	44.7	Very low	10 Å²	10	118.9 Å²	118.9	7%	0.07	59%	0.588	C	S	.	*	S	Bend	trans	-125.8	-38.8	164.4	-159.7	0	0	0	0	112.3	S140 A141 D715	S138-S140 PolarHBondContact O-N 3.05Å; S138-A141 PolarHBondContact O-N 3.2Å; S138-D715 WeakPolarHBondContact OG-CB 3.4Å; S138-D715 PolarHBondContact OG-OD2 3.05Å
139	G	46.5	Very low	45.2	Very low	49 Å²	49	123.3 Å²	123.3	51%	0.505	60%	0.595	S	S	.	*	H	α-helix	trans	-69.5	-24.8	169	0	0	0	0	0	115.4
140	S	56.6	Low	45.3	Very low	53 Å²	53	118.6 Å²	118.6	37%	0.371	58%	0.583	S	S	.	*	H	α-helix	trans	-74.1	-27.1	179.4	-173.2	0	0	0	0	112.9	S138 Y142 M143 E144	S138-S140 PolarHBondContact O-N 3.05Å; S140-Y142 VanDerWaalsContact C-N 3.35Å; S140-Y142 PolarHBondContact O-N 3.04Å; S140-M143 PolarHBondContact O-N 3.12Å; S140-E144 WeakPolarHBondContact O-CB 3.35Å; S140-E144 PolarHBondContact O-N 2.9Å
141	A	55	Low	46	Very low	38 Å²	38	116 Å²	116	31%	0.314	58%	0.579	S	S	.	*	H	α-helix	trans	-71.3	-31.1	-173.8	0	0	0	0	0	112.4	S138 R145	S138-A141 PolarHBondContact O-N 3.2Å; A141-R145 PolarHBondContact O-N 3.36Å; A141-R145 VanDerWaalsContact O-N 3.08Å; A141-R145 PolarHBondContact O-NE 2.63Å
142	Y	48.2	Very low	47.2	Very low	79 Å²	79	115.9 Å²	115.9	31%	0.31	58%	0.576	S	S	.	*	H	α-helix	trans	-64.1	-48.3	173.1	-176.9	-95	0	0	0	111.5	S140 E144 R145 R146	S140-Y142 VanDerWaalsContact C-N 3.35Å; S140-Y142 PolarHBondContact O-N 3.04Å; Y142-E144 PolarHBondContact O-N 2.62Å; Y142-R145 PolarHBondContact O-N 3.15Å; Y142-R146 PolarHBondContact O-N 3.09Å; Y142-R146 VanDerWaalsContact O-N 3.14Å; Y142-R146 PolarHBondContact OH-NH1 3.04Å
143	M	51.1	Low	49	Very low	60 Å²	60	109.5 Å²	109.5	30%	0.296	56%	0.559	S	S	.	*	H	α-helix	trans	-67.1	-36.5	177.5	-68.1	-65.2	-105.2	0	0	112.1	S140 R145 R146 R147	S140-M143 PolarHBondContact O-N 3.12Å; M143-R145 PolarHBondContact O-N 3.12Å; M143-R146 PolarHBondContact O-N 3.06Å; M143-R147 WeakPolarHBondContact O-CB 3.27Å; M143-R147 VanDerWaalsContact O-CG 3.28Å; M143-R147 WeakPolarHBondContact O-CG 3.49Å; M143-R147 PolarHBondContact O-N 3.29Å
144	E	53.6	Low	50.5	Low	94 Å²	94	109.2 Å²	109.2	44%	0.439	55%	0.552	S	S	.	*	H	α-helix	trans	-65.6	-37.9	176.9	-149.8	68.1	-165.9	0	0	111.9	S140 Y142 R147 K148	S140-E144 WeakPolarHBondContact O-CB 3.35Å; S140-E144 PolarHBondContact O-N 2.9Å; Y142-E144 PolarHBondContact O-N 2.62Å; E144-R147 IonicContact OE2-NH1 3.67Å; E144-R147 PolarHBondContact OE2-NH1 2.96Å; E144-K148 WeakPolarHBondContact O-CG 3.43Å; E144-K148 PolarHBondContact O-N 2.81Å
145	R	52.4	Low	52.6	Low	144 Å²	144	106.3 Å²	106.3	54%	0.543	54%	0.543	S	S	.	.	H	α-helix	trans	-68.9	-32.6	174.3	-79.4	-175.4	-83.2	-133.6	2.4	112.7	A141 Y142 M143	A141-R145 PolarHBondContact O-N 3.36Å; A141-R145 VanDerWaalsContact O-N 3.08Å; A141-R145 PolarHBondContact O-NE 2.63Å; Y142-R145 PolarHBondContact O-N 3.15Å; M143-R145 PolarHBondContact O-N 3.12Å
146	R	50.6	Low	54.3	Low	167 Å²	167	108.9 Å²	108.9	63%	0.63	54%	0.542	S	S	*	.	H	α-helix	trans	-76.5	-37.9	175.2	-125.2	-179.6	169.3	128.3	-4.3	112.8	Y142 M143 K148 R149	Y142-R146 PolarHBondContact O-N 3.09Å; Y142-R146 VanDerWaalsContact O-N 3.14Å; Y142-R146 PolarHBondContact OH-NH1 3.04Å; M143-R146 PolarHBondContact O-N 3.06Å; R146-K148 PolarHBondContact O-N 3.02Å; R146-R149 PolarHBondContact O-N 3.4Å
147	R	52.1	Low	55.8	Low	129 Å²	129	106.8 Å²	106.8	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-64.8	-24	173.7	-73.1	177.1	-160.9	130.5	1.5	113.4	M143 E144 R149	M143-R147 WeakPolarHBondContact O-CB 3.27Å; M143-R147 VanDerWaalsContact O-CG 3.28Å; M143-R147 WeakPolarHBondContact O-CG 3.49Å; M143-R147 PolarHBondContact O-N 3.29Å; E144-R147 IonicContact OE2-NH1 3.67Å; E144-R147 PolarHBondContact OE2-NH1 2.96Å; R147-R149 PolarHBondContact O-N 3.18Å
148	K	48.2	Very low	57.2	Low	169 Å²	169	104.6 Å²	104.6	74%	0.735	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-9.8	174.4	-80.6	-177.1	-178.9	-174.2	0	114.4	E144 R146 G150	E144-K148 WeakPolarHBondContact O-CG 3.43Å; E144-K148 PolarHBondContact O-N 2.81Å; R146-K148 PolarHBondContact O-N 3.02Å; K148-G150 PolarHBondContact O-N 2.78Å
149	R	45.6	Very low	58.7	Low	227 Å²	227	108.9 Å²	108.9	86%	0.857	54%	0.536	S	S	*	.	S	Bend	trans	-77.4	74.3	161.4	-65.7	-170.3	-174	-177.6	2.5	109.3	R146 R147	R146-R149 PolarHBondContact O-N 3.4Å; R147-R149 PolarHBondContact O-N 3.18Å
150	G	40.7	Very low	60.3	Low	57 Å²	57	111.5 Å²	111.5	59%	0.588	53%	0.534	S	S	*	.			trans	36.3	89.7	165.9	0	0	0	0	0	115.9	K148 V152	K148-G150 PolarHBondContact O-N 2.78Å; G150-V152 PolarHBondContact O-N 2.8Å
151	L	49.9	Very low	61.3	Low	157 Å²	157	111.9 Å²	111.9	82%	0.822	54%	0.537	S	S	*	.			trans	-49	114	162.5	-149.9	84.2	0	0	0	107.7	D153	L151-D153 PolarHBondContact O-N 2.84Å
152	V	59.9	Low	62.5	Low	107 Å²	107	114.3 Å²	114.3	65%	0.648	55%	0.545	S	S	*	.			trans	-57.7	115	-179.2	176.3	0	0	0	0	107.2	G150 L154 V157	G150-V152 PolarHBondContact O-N 2.8Å; V152-L154 PolarHBondContact O-N 2.99Å; V152-V157 HydrophobicContact CG1-CG2 3.16Å
153	D	70.9	Confident	64.1	Low	95 Å²	95	114 Å²	114	51%	0.508	55%	0.549	S	S	.	.			trans	-61.5	104.8	179.1	-178	-0.5	0	0	0	108.4	L151 K155 K156 V157	L151-D153 PolarHBondContact O-N 2.84Å; D153-K155 PolarHBondContact O-N 3.23Å; D153-K155 VanDerWaalsContact O-N 3.14Å; D153-K155 VanDerWaalsContact OD1-CB 3.25Å; D153-K155 WeakPolarHBondContact OD1-CB 3.47Å; D153-K155 PolarHBondContact OD1-N 3.16Å; D153-K156 HydrophobicContact CB-CB 3.93Å; D153-K156 WeakPolarHBondContact O-CA 3.39Å; D153-K156 VanDerWaalsContact O-CB 3.3Å; D153-K156 WeakPolarHBondContact O-CB 3.41Å; D153-K156 PolarHBondContact O-N 3.22Å; D153-V157 PolarHBondContact O-N 3.41Å
154	L	66.7	Low	65.2	Low	122 Å²	122	114.1 Å²	114.1	64%	0.639	55%	0.549	S	S	*	.	H	α-helix	trans	-56.8	-31.8	-177.7	-172.2	70.1	0	0	0	110.6	V152 K156 V157 I158	V152-L154 PolarHBondContact O-N 2.99Å; L154-K156 VanDerWaalsContact C-N 3.33Å; L154-K156 PolarHBondContact O-N 3.45Å; L154-V157 PolarHBondContact O-N 2.93Å; L154-I158 HydrophobicContact CD2-CD1 4.35Å; L154-I158 HydrophobicContact CG-CD1 3.9Å; L154-I158 HydrophobicContact CG-CG1 4.42Å; L154-I158 WeakPolarHBondContact O-CB 3.3Å; L154-I158 VanDerWaalsContact O-CG1 3.24Å; L154-I158 WeakPolarHBondContact O-CG1 3.22Å; L154-I158 PolarHBondContact O-N 3.38Å
155	K	76.7	Confident	66.2	Low	141 Å²	141	112.7 Å²	112.7	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-62.3	-42.7	174.3	-168.7	178.1	-178.3	179	0	110.6	E114 D153 Q159	E114-K155 IonicContact OE1-NZ 3.76Å; D153-K155 PolarHBondContact O-N 3.23Å; D153-K155 VanDerWaalsContact O-N 3.14Å; D153-K155 VanDerWaalsContact OD1-CB 3.25Å; D153-K155 WeakPolarHBondContact OD1-CB 3.47Å; D153-K155 PolarHBondContact OD1-N 3.16Å; K155-Q159 VanDerWaalsContact O-CB 3.25Å; K155-Q159 WeakPolarHBondContact O-CB 3.46Å; K155-Q159 PolarHBondContact O-N 3.44Å
156	K	77.2	Confident	67.5	Low	149 Å²	149	112 Å²	112	65%	0.648	55%	0.548	S	S	*	.	H	α-helix	trans	-67.3	-39.7	177.7	-164.9	175.2	-178.5	178.5	0	112.1	D153 L154 Q159 Q160	D153-K156 HydrophobicContact CB-CB 3.93Å; D153-K156 WeakPolarHBondContact O-CA 3.39Å; D153-K156 VanDerWaalsContact O-CB 3.3Å; D153-K156 WeakPolarHBondContact O-CB 3.41Å; D153-K156 PolarHBondContact O-N 3.22Å; L154-K156 VanDerWaalsContact C-N 3.33Å; L154-K156 PolarHBondContact O-N 3.45Å; K156-Q159 PolarHBondContact O-N 3.36Å; K156-Q160 VanDerWaalsContact O-CB 3.3Å; K156-Q160 WeakPolarHBondContact O-CB 3.33Å; K156-Q160 PolarHBondContact O-N 2.98Å
157	V	71.5	Confident	68.6	Low	62 Å²	62	106.2 Å²	106.2	38%	0.376	53%	0.533	S	S	.	.	H	α-helix	trans	-67	-44.2	176.1	175.3	0	0	0	0	111.8	V152 D153 L154 Q159 Q160 S161	V152-V157 HydrophobicContact CG1-CG2 3.16Å; D153-V157 PolarHBondContact O-N 3.41Å; L154-V157 PolarHBondContact O-N 2.93Å; V157-Q159 VanDerWaalsContact C-N 3.33Å; V157-Q160 PolarHBondContact O-N 2.9Å; V157-S161 WeakPolarHBondContact O-CB 3.26Å; V157-S161 PolarHBondContact O-N 3.49Å
158	I	77.6	Confident	69.6	Low	88 Å²	88	103.4 Å²	103.4	45%	0.451	53%	0.53	S	S	.	.	H	α-helix	trans	-63.3	-43.1	176.5	-69.5	169.3	0	0	0	110.1	L154 S161 N162	L154-I158 HydrophobicContact CD2-CD1 4.35Å; L154-I158 HydrophobicContact CG-CD1 3.9Å; L154-I158 HydrophobicContact CG-CG1 4.42Å; L154-I158 WeakPolarHBondContact O-CB 3.3Å; L154-I158 VanDerWaalsContact O-CG1 3.24Å; L154-I158 WeakPolarHBondContact O-CG1 3.22Å; L154-I158 PolarHBondContact O-N 3.38Å; I158-S161 PolarHBondContact O-N 3.33Å; I158-N162 WeakPolarHBondContact O-CB 3.39Å; I158-N162 VanDerWaalsContact O-CG 3.29Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.12Å
159	Q	82.2	Confident	70.8	Confident	100 Å²	100	103.4 Å²	103.4	47%	0.467	53%	0.53	S	S	.	.	H	α-helix	trans	-60.9	-47.5	176	-174.2	58.1	40.4	0	0	111.5	K155 K156 V157 S161 N162 D163	K155-Q159 VanDerWaalsContact O-CB 3.25Å; K155-Q159 WeakPolarHBondContact O-CB 3.46Å; K155-Q159 PolarHBondContact O-N 3.44Å; K156-Q159 PolarHBondContact O-N 3.36Å; V157-Q159 VanDerWaalsContact C-N 3.33Å; Q159-S161 VanDerWaalsContact C-N 3.31Å; Q159-S161 PolarHBondContact O-N 2.72Å; Q159-N162 PolarHBondContact O-N 3.26Å; Q159-N162 VanDerWaalsContact O-N 3.14Å; Q159-D163 PolarHBondContact NE2-OD1 2.91Å; Q159-D163 VanDerWaalsContact NE2-OD1 3.11Å; Q159-D163 PolarHBondContact NE2-OD2 3.06Å; Q159-D163 VanDerWaalsContact O-CG 3.31Å; Q159-D163 PolarHBondContact O-N 2.91Å
160	Q	79.1	Confident	72.2	Confident	103 Å²	103	99.3 Å²	99.3	48%	0.481	52%	0.52	S	S	.	.	H	α-helix	trans	-59.8	-40.4	176.6	-171.8	176.8	-1.5	0	0	112	K156 V157 D163 M164	K156-Q160 VanDerWaalsContact O-CB 3.3Å; K156-Q160 WeakPolarHBondContact O-CB 3.33Å; K156-Q160 PolarHBondContact O-N 2.98Å; V157-Q160 PolarHBondContact O-N 2.9Å; Q160-D163 PolarHBondContact O-N 3.11Å; Q160-M164 WeakPolarHBondContact O-CG 3.42Å; Q160-M164 PolarHBondContact O-N 3.33Å
161	S	77.7	Confident	73.3	Confident	62 Å²	62	100 Å²	100	43%	0.434	53%	0.527	S	S	.	.	H	α-helix	trans	-64.5	-41.2	174.7	179	0	0	0	0	112.5	V157 I158 Q159 T165	V157-S161 WeakPolarHBondContact O-CB 3.26Å; V157-S161 PolarHBondContact O-N 3.49Å; I158-S161 PolarHBondContact O-N 3.33Å; Q159-S161 VanDerWaalsContact C-N 3.31Å; Q159-S161 PolarHBondContact O-N 2.72Å; S161-T165 WeakPolarHBondContact O-CB 3.22Å; S161-T165 PolarHBondContact O-N 3.29Å; S161-T165 PolarHBondContact O-OG1 3.4Å
162	N	80.3	Confident	74.2	Confident	88 Å²	88	99 Å²	99	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-40.8	176.6	-73.3	-24.2	0	0	0	111.5	I158 Q159 T165 K166	I158-N162 WeakPolarHBondContact O-CB 3.39Å; I158-N162 VanDerWaalsContact O-CG 3.29Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.12Å; Q159-N162 PolarHBondContact O-N 3.26Å; Q159-N162 VanDerWaalsContact O-N 3.14Å; N162-T165 PolarHBondContact O-N 3.47Å; N162-K166 WeakPolarHBondContact O-CB 3.36Å; N162-K166 PolarHBondContact O-N 3.29Å
163	D	81.2	Confident	75	Confident	74 Å²	74	97.2 Å²	97.2	40%	0.396	50%	0.504	S	S	.	.	H	α-helix	trans	-67.1	-41.6	177.3	-68	-28.5	0	0	0	111.6	Q159 Q160 T165 K166 C167	Q159-D163 PolarHBondContact NE2-OD1 2.91Å; Q159-D163 VanDerWaalsContact NE2-OD1 3.11Å; Q159-D163 PolarHBondContact NE2-OD2 3.06Å; Q159-D163 VanDerWaalsContact O-CG 3.31Å; Q159-D163 PolarHBondContact O-N 2.91Å; Q160-D163 PolarHBondContact O-N 3.11Å; D163-T165 PolarHBondContact O-N 3.2Å; D163-K166 WeakPolarHBondContact O-CB 3.41Å; D163-K166 PolarHBondContact O-N 3.37Å; D163-C167 PolarHBondContact O-N 2.84Å; D163-C167 PolarHBondContact O-SG 3.45Å; D163-C167 VanDerWaalsContact O-SG 3.35Å
164	M	74.3	Confident	75	Confident	61 Å²	61	98 Å²	98	30%	0.3	50%	0.504	S	S	.	.	H	α-helix	trans	-59.7	-46.1	171.6	-76.1	179.4	70.2	0	0	111.6	Q160 K166 C167 V168 I177	Q160-M164 WeakPolarHBondContact O-CG 3.42Å; Q160-M164 PolarHBondContact O-N 3.33Å; M164-K166 VanDerWaalsContact C-N 3.27Å; M164-K166 PolarHBondContact O-N 2.71Å; M164-C167 PolarHBondContact O-N 3.49Å; M164-V168 WeakPolarHBondContact O-CG2 3.3Å; M164-V168 PolarHBondContact O-N 3.19Å; M164-I177 HydrophobicContact CE-CG2 4.14Å; M164-I177 HydrophobicContact CG-CG2 4.22Å
165	T	75.6	Confident	75.2	Confident	65 Å²	65	97.9 Å²	97.9	40%	0.399	50%	0.498	S	S	.	.	H	α-helix	trans	-61.5	-38.8	177.4	-57.3	0	0	0	0	111.1	S161 N162 D163 K169	S161-T165 WeakPolarHBondContact O-CB 3.22Å; S161-T165 PolarHBondContact O-N 3.29Å; S161-T165 PolarHBondContact O-OG1 3.4Å; N162-T165 PolarHBondContact O-N 3.47Å; D163-T165 PolarHBondContact O-N 3.2Å; T165-K169 HydrophobicContact CG2-CD 4.4Å; T165-K169 WeakPolarHBondContact O-CB 3.47Å; T165-K169 VanDerWaalsContact O-CG 3.29Å; T165-K169 WeakPolarHBondContact O-CG 3.48Å; T165-K169 PolarHBondContact O-N 3.26Å
166	K	80.1	Confident	75	Confident	128 Å²	128	92.7 Å²	92.7	56%	0.557	48%	0.484	S	S	*	.	H	α-helix	trans	-64.6	-47.3	174.7	-167	177.6	179.6	-176.4	0	110.7	N162 D163 M164 V168 K169 H170	N162-K166 WeakPolarHBondContact O-CB 3.36Å; N162-K166 PolarHBondContact O-N 3.29Å; D163-K166 WeakPolarHBondContact O-CB 3.41Å; D163-K166 PolarHBondContact O-N 3.37Å; M164-K166 VanDerWaalsContact C-N 3.27Å; M164-K166 PolarHBondContact O-N 2.71Å; K166-V168 PolarHBondContact O-N 3.3Å; K166-K169 WeakPolarHBondContact O-CB 3.47Å; K166-K169 PolarHBondContact O-N 3.26Å; K166-K169 VanDerWaalsContact O-N 3.16Å; K166-H170 VanDerWaalsContact CG-CE1 3.49Å; K166-H170 WeakPolarHBondContact CG-CE1 3.26Å; K166-H170 PolarHBondContact O-N 3.21Å; K166-H170 PolarHBondContact O-ND1 2.79Å
167	C	73.8	Confident	74.7	Confident	46 Å²	46	86.4 Å²	86.4	31%	0.311	46%	0.458	S	S	.	.	H	α-helix	trans	-59.4	-43.1	177.7	-73	0	0	0	0	112.8	D163 M164 H170 R172 I177	D163-C167 PolarHBondContact O-N 2.84Å; D163-C167 PolarHBondContact O-SG 3.45Å; D163-C167 VanDerWaalsContact O-SG 3.35Å; M164-C167 PolarHBondContact O-N 3.49Å; C167-H170 PolarHBondContact O-N 3.3Å; C167-R172 WeakPolarHBondContact O-CB 3.42Å; C167-R172 PolarHBondContact O-N 3.11Å; C167-I177 HydrophobicContact CB-CD1 3.61Å; C167-I177 HydrophobicContact CB-CG1 4.24Å
168	V	73.4	Confident	74.6	Confident	70 Å²	70	86.4 Å²	86.4	42%	0.424	46%	0.456	S	S	.	.	H	α-helix	trans	-63.2	-41.4	175.1	175.2	0	0	0	0	111.2	M164 K166 H170 G171 I177	M164-V168 WeakPolarHBondContact O-CG2 3.3Å; M164-V168 PolarHBondContact O-N 3.19Å; K166-V168 PolarHBondContact O-N 3.3Å; V168-H170 VanDerWaalsContact C-N 3.26Å; V168-H170 PolarHBondContact O-N 3.48Å; V168-G171 PolarHBondContact O-N 3.46Å; V168-I177 HydrophobicContact CG2-CD1 3.54Å
169	K	73.3	Confident	74.4	Confident	170 Å²	170	86.8 Å²	86.8	74%	0.739	46%	0.455	S	S	*	.	H	α-helix	trans	-64.2	-26.6	176.4	-76.1	177.9	179.4	-177.1	0	113.7	T165 K166 G171	T165-K169 HydrophobicContact CG2-CD 4.4Å; T165-K169 WeakPolarHBondContact O-CB 3.47Å; T165-K169 VanDerWaalsContact O-CG 3.29Å; T165-K169 WeakPolarHBondContact O-CG 3.48Å; T165-K169 PolarHBondContact O-N 3.26Å; K166-K169 WeakPolarHBondContact O-CB 3.47Å; K166-K169 PolarHBondContact O-N 3.26Å; K166-K169 VanDerWaalsContact O-N 3.16Å; K169-G171 VanDerWaalsContact C-N 3.27Å; K169-G171 PolarHBondContact O-N 3.26Å
170	H	73.7	Confident	74	Confident	141 Å²	141	87.1 Å²	87.1	65%	0.653	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	18.5	177.2	-67.2	74.6	0	0	0	113	K166 C167 V168 R172	K166-H170 VanDerWaalsContact CG-CE1 3.49Å; K166-H170 WeakPolarHBondContact CG-CE1 3.26Å; K166-H170 PolarHBondContact O-N 3.21Å; K166-H170 PolarHBondContact O-ND1 2.79Å; C167-H170 PolarHBondContact O-N 3.3Å; V168-H170 VanDerWaalsContact C-N 3.26Å; V168-H170 PolarHBondContact O-N 3.48Å; H170-R172 PolarHBondContact O-N 3.45Å
171	G	65.2	Low	73.6	Confident	70 Å²	70	85.3 Å²	85.3	72%	0.722	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	7.8	173.1	0	0	0	0	0	115.3	V168 K169 S173	V168-G171 PolarHBondContact O-N 3.46Å; K169-G171 VanDerWaalsContact C-N 3.27Å; K169-G171 PolarHBondContact O-N 3.26Å; G171-S173 PolarHBondContact O-N 3.45Å
172	R	67.3	Low	73.3	Confident	136 Å²	136	86 Å²	86	51%	0.513	45%	0.447	S	S	.	.			trans	-71.6	127.9	166.7	-72.1	-167.7	178.5	-161.4	0.5	108.9	C167 H170 I177	C167-R172 WeakPolarHBondContact O-CB 3.42Å; C167-R172 PolarHBondContact O-N 3.11Å; H170-R172 PolarHBondContact O-N 3.45Å; R172-I177 HydrophobicContact CB-CG1 4.46Å
173	S	77.4	Confident	73.1	Confident	70 Å²	70	86.2 Å²	86.2	49%	0.49	45%	0.447	S	S	.	.			trans	-61.7	143.1	174.8	79.8	0	0	0	0	109.5	G171 F175 G176 I177	G171-S173 PolarHBondContact O-N 3.45Å; S173-F175 PolarHBondContact O-N 3.47Å; S173-G176 WeakPolarHBondContact O-CA 3.45Å; S173-G176 PolarHBondContact O-N 3.47Å; S173-G176 PolarHBondContact OG-N 3.41Å; S173-I177 PolarHBondContact O-N 3.3Å
174	F	71.4	Confident	72.7	Confident	113 Å²	113	87.3 Å²	87.3	50%	0.496	45%	0.449	S	S	.	.	H	α-helix	trans	-52.9	-36.5	173.5	179.4	-101.8	0	0	0	111.5	G176 I177 L178	F174-G176 PolarHBondContact O-N 2.92Å; F174-I177 PolarHBondContact O-N 3.48Å; F174-L178 HydrophobicContact CD1-CD1 3.83Å; F174-L178 HydrophobicContact CD1-CG 4.41Å; F174-L178 HydrophobicContact CE1-CD1 3.36Å; F174-L178 HydrophobicContact CE1-CG 4.05Å; F174-L178 HydrophobicContact CZ-CD1 3.97Å; F174-L178 HydrophobicContact CZ-CG 4.28Å; F174-L178 PolarHBondContact O-N 3.13Å
175	F	69.9	Low	72.7	Confident	118 Å²	118	90.4 Å²	90.4	52%	0.518	46%	0.461	S	S	.	.	H	α-helix	trans	-63.7	-36.7	174.3	-64	-71.4	0	0	0	113.2	S173 I177 L178 H179 Y595	S173-F175 PolarHBondContact O-N 3.47Å; F175-I177 VanDerWaalsContact C-N 3.34Å; F175-I177 PolarHBondContact O-N 3.37Å; F175-L178 PolarHBondContact O-N 2.92Å; F175-H179 VanDerWaalsContact O-CB 3.26Å; F175-H179 WeakPolarHBondContact O-CB 3.4Å; F175-H179 PolarHBondContact O-N 3.16Å; F175-Y595 HydrophobicContact CD1-CE2 4.4Å; F175-Y595 HydrophobicContact CE1-CD2 4.01Å; F175-Y595 AromaticContact CE1-CE2 3.47Å; F175-Y595 HydrophobicContact CE1-CE2 3.47Å; F175-Y595 VanDerWaalsContact CE1-CE2 3.47Å; F175-Y595 HydrophobicContact CZ-CD2 4.39Å; F175-Y595 AromaticContact CZ-CE2 3.9Å; F175-Y595 HydrophobicContact CZ-CE2 3.9Å
176	G	73	Confident	72.6	Confident	32 Å²	32	89 Å²	89	33%	0.33	45%	0.452	S	S	.	.	H	α-helix	trans	-66	-35.1	174.7	0	0	0	0	0	113	S173 F174 Q180	S173-G176 WeakPolarHBondContact O-CA 3.45Å; S173-G176 PolarHBondContact O-N 3.47Å; S173-G176 PolarHBondContact OG-N 3.41Å; F174-G176 PolarHBondContact O-N 2.92Å; G176-Q180 WeakPolarHBondContact O-CB 3.36Å; G176-Q180 PolarHBondContact O-N 2.99Å
177	I	71.7	Confident	72.4	Confident	18 Å²	18	89.4 Å²	89.4	9%	0.092	45%	0.451	C	S	.	.	H	α-helix	trans	-70.1	-44.6	176.1	-60.7	171.9	0	0	0	110.5	M164 C167 V168 R172 S173 F174 F175 Q180 E181	M164-I177 HydrophobicContact CE-CG2 4.14Å; M164-I177 HydrophobicContact CG-CG2 4.22Å; C167-I177 HydrophobicContact CB-CD1 3.61Å; C167-I177 HydrophobicContact CB-CG1 4.24Å; V168-I177 HydrophobicContact CG2-CD1 3.54Å; R172-I177 HydrophobicContact CB-CG1 4.46Å; S173-I177 PolarHBondContact O-N 3.3Å; F174-I177 PolarHBondContact O-N 3.48Å; F175-I177 VanDerWaalsContact C-N 3.34Å; F175-I177 PolarHBondContact O-N 3.37Å; I177-Q180 PolarHBondContact O-N 3.43Å; I177-E181 PolarHBondContact O-N 3.14Å
178	L	69.6	Low	72.3	Confident	62 Å²	62	91.4 Å²	91.4	33%	0.325	46%	0.459	S	S	.	.	H	α-helix	trans	-62.6	-42.3	175.5	-75.6	177.1	0	0	0	112.1	F174 F175 Q180 E181 I182	F174-L178 HydrophobicContact CD1-CD1 3.83Å; F174-L178 HydrophobicContact CD1-CG 4.41Å; F174-L178 HydrophobicContact CE1-CD1 3.36Å; F174-L178 HydrophobicContact CE1-CG 4.05Å; F174-L178 HydrophobicContact CZ-CD1 3.97Å; F174-L178 HydrophobicContact CZ-CG 4.28Å; F174-L178 PolarHBondContact O-N 3.13Å; F175-L178 PolarHBondContact O-N 2.92Å; L178-Q180 VanDerWaalsContact C-N 3.32Å; L178-Q180 PolarHBondContact O-N 2.98Å; L178-E181 PolarHBondContact O-N 3.03Å; L178-I182 WeakPolarHBondContact O-CG1 3.35Å; L178-I182 PolarHBondContact O-N 3.23Å
179	H	72	Confident	72.3	Confident	96 Å²	96	92.1 Å²	92.1	44%	0.444	46%	0.456	S	S	.	.	H	α-helix	trans	-60.9	-43.1	176.4	-171.6	62.3	0	0	0	111.3	F175 E181 I182 I183	F175-H179 VanDerWaalsContact O-CB 3.26Å; F175-H179 WeakPolarHBondContact O-CB 3.4Å; F175-H179 PolarHBondContact O-N 3.16Å; H179-E181 PolarHBondContact O-N 2.98Å; H179-I182 PolarHBondContact O-N 2.7Å; H179-I183 WeakPolarHBondContact O-CG1 3.34Å; H179-I183 PolarHBondContact O-N 3.32Å
180	Q	74.4	Confident	72.4	Confident	106 Å²	106	88.9 Å²	88.9	50%	0.495	44%	0.44	S	S	.	.	H	α-helix	trans	-64.1	-37.3	175.1	-167.6	173.6	1.6	0	0	112.6	G176 I177 L178 I183 Q184	G176-Q180 WeakPolarHBondContact O-CB 3.36Å; G176-Q180 PolarHBondContact O-N 2.99Å; I177-Q180 PolarHBondContact O-N 3.43Å; L178-Q180 VanDerWaalsContact C-N 3.32Å; L178-Q180 PolarHBondContact O-N 2.98Å; Q180-I183 PolarHBondContact O-N 3.05Å; Q180-Q184 WeakPolarHBondContact O-CB 3.36Å; Q180-Q184 PolarHBondContact O-N 3.41Å
181	E	71.2	Confident	72.4	Confident	65 Å²	65	85 Å²	85	30%	0.304	42%	0.424	S	S	.	.	H	α-helix	trans	-66.7	-39.4	175.7	-163.8	-170.5	149.6	0	0	112.2	I177 L178 H179 Q184 K185	I177-E181 PolarHBondContact O-N 3.14Å; L178-E181 PolarHBondContact O-N 3.03Å; H179-E181 PolarHBondContact O-N 2.98Å; E181-Q184 PolarHBondContact O-N 3.37Å; E181-K185 WeakPolarHBondContact O-CG 3.33Å; E181-K185 PolarHBondContact O-N 3.22Å; E181-K185 VanDerWaalsContact OE1-CE 3.3Å; E181-K185 WeakPolarHBondContact OE1-CE 3.33Å; E181-K185 IonicContact OE1-NZ 3.73Å; E181-K185 PolarHBondContact OE1-NZ 3.49Å
182	I	71.8	Confident	72.8	Confident	78 Å²	78	86.9 Å²	86.9	40%	0.4	42%	0.416	S	S	.	.	H	α-helix	trans	-63.6	-48.5	175.1	-68.7	166.5	0	0	0	110.2	L178 H179 Q184 K185 V186	L178-I182 WeakPolarHBondContact O-CG1 3.35Å; L178-I182 PolarHBondContact O-N 3.23Å; H179-I182 PolarHBondContact O-N 2.7Å; I182-Q184 VanDerWaalsContact C-N 3.28Å; I182-Q184 PolarHBondContact O-N 2.98Å; I182-K185 PolarHBondContact O-N 3.38Å; I182-K185 VanDerWaalsContact O-N 3.13Å; I182-V186 WeakPolarHBondContact O-CG2 3.41Å; I182-V186 PolarHBondContact O-N 3.32Å
183	I	74.4	Confident	73	Confident	92 Å²	92	83.7 Å²	83.7	47%	0.472	41%	0.405	S	S	.	.	H	α-helix	trans	-56.9	-44	176.2	-68.2	166.8	0	0	0	110.7	H179 Q180 K185 V186 Y187	H179-I183 WeakPolarHBondContact O-CG1 3.34Å; H179-I183 PolarHBondContact O-N 3.32Å; Q180-I183 PolarHBondContact O-N 3.05Å; I183-K185 VanDerWaalsContact C-N 3.35Å; I183-K185 PolarHBondContact O-N 2.93Å; I183-V186 PolarHBondContact O-N 3.19Å; I183-Y187 WeakPolarHBondContact O-CB 3.41Å; I183-Y187 PolarHBondContact O-N 3.15Å
184	Q	73.8	Confident	72.8	Confident	97 Å²	97	84 Å²	84	45%	0.453	40%	0.401	S	S	.	.	H	α-helix	trans	-64.4	-37.9	178.9	-168.5	65.1	47.6	0	0	112.5	Q180 E181 I182 Y187 N188	Q180-Q184 WeakPolarHBondContact O-CB 3.36Å; Q180-Q184 PolarHBondContact O-N 3.41Å; E181-Q184 PolarHBondContact O-N 3.37Å; I182-Q184 VanDerWaalsContact C-N 3.28Å; I182-Q184 PolarHBondContact O-N 2.98Å; Q184-Y187 PolarHBondContact O-N 3.29Å; Q184-N188 PolarHBondContact NE2-OD1 3.27Å; Q184-N188 WeakPolarHBondContact O-CB 3.47Å; Q184-N188 PolarHBondContact O-N 3.48Å; Q184-N188 PolarHBondContact O-ND2 3.39Å; Q184-N188 PolarHBondContact O-OD1 2.93Å
185	K	74.1	Confident	72.9	Confident	126 Å²	126	84.7 Å²	84.7	55%	0.548	41%	0.406	S	S	.	.	H	α-helix	trans	-65.2	-44.1	175.7	-77.1	176.3	-176	164	0	111.7	E181 I182 I183 Y187 N188 F189	E181-K185 WeakPolarHBondContact O-CG 3.33Å; E181-K185 PolarHBondContact O-N 3.22Å; E181-K185 VanDerWaalsContact OE1-CE 3.3Å; E181-K185 WeakPolarHBondContact OE1-CE 3.33Å; E181-K185 IonicContact OE1-NZ 3.73Å; E181-K185 PolarHBondContact OE1-NZ 3.49Å; I182-K185 PolarHBondContact O-N 3.38Å; I182-K185 VanDerWaalsContact O-N 3.13Å; I183-K185 VanDerWaalsContact C-N 3.35Å; I183-K185 PolarHBondContact O-N 2.93Å; K185-Y187 VanDerWaalsContact C-N 3.35Å; K185-N188 PolarHBondContact O-N 3.34Å; K185-F189 WeakPolarHBondContact O-CB 3.29Å; K185-F189 PolarHBondContact O-N 2.93Å
186	V	72.9	Confident	72.9	Confident	35 Å²	35	82.1 Å²	82.1	21%	0.212	40%	0.4	C	S	.	.	H	α-helix	trans	-61.5	-43.6	175.7	174.6	0	0	0	0	110.9	I182 I183 F189 W190 L246	I182-V186 WeakPolarHBondContact O-CG2 3.41Å; I182-V186 PolarHBondContact O-N 3.32Å; I183-V186 PolarHBondContact O-N 3.19Å; V186-F189 PolarHBondContact O-N 3.17Å; V186-W190 PolarHBondContact O-N 3.3Å; V186-W190 VanDerWaalsContact O-N 3.08Å; V186-L246 HydrophobicContact CG2-CD1 4.29Å
187	Y	75.5	Confident	72.7	Confident	137 Å²	137	82.8 Å²	82.8	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-64.9	-43.4	177.2	-175	-99.9	0	0	0	112.8	I183 Q184 K185 F189 W190 N191	I183-Y187 WeakPolarHBondContact O-CB 3.41Å; I183-Y187 PolarHBondContact O-N 3.15Å; Q184-Y187 PolarHBondContact O-N 3.29Å; K185-Y187 VanDerWaalsContact C-N 3.35Å; Y187-F189 VanDerWaalsContact C-N 3.31Å; Y187-F189 PolarHBondContact O-N 3.49Å; Y187-W190 PolarHBondContact O-N 3.47Å; Y187-N191 WeakPolarHBondContact CE1-ND2 3.44Å; Y187-N191 PolarHBondContact O-N 2.84Å
188	N	73.3	Confident	72.7	Confident	87 Å²	87	87 Å²	87	47%	0.465	42%	0.415	S	S	.	.	H	α-helix	trans	-64.2	-37.3	177.1	-70.8	-9.2	0	0	0	112	Q184 K185 N191 L192	Q184-N188 PolarHBondContact NE2-OD1 3.27Å; Q184-N188 WeakPolarHBondContact O-CB 3.47Å; Q184-N188 PolarHBondContact O-N 3.48Å; Q184-N188 PolarHBondContact O-ND2 3.39Å; Q184-N188 PolarHBondContact O-OD1 2.93Å; K185-N188 PolarHBondContact O-N 3.34Å; N188-N191 PolarHBondContact O-N 2.51Å; N188-L192 WeakPolarHBondContact O-CB 3.33Å; N188-L192 PolarHBondContact O-N 3.38Å
189	F	71.8	Confident	72.7	Confident	86 Å²	86	86.1 Å²	86.1	38%	0.377	42%	0.416	S	S	.	.	H	α-helix	trans	-60.9	-51.8	174.3	174.5	-93.3	0	0	0	111	K185 V186 Y187 N191 L192 Y193 I239	K185-F189 WeakPolarHBondContact O-CB 3.29Å; K185-F189 PolarHBondContact O-N 2.93Å; V186-F189 PolarHBondContact O-N 3.17Å; Y187-F189 VanDerWaalsContact C-N 3.31Å; Y187-F189 PolarHBondContact O-N 3.49Å; F189-N191 VanDerWaalsContact C-N 3.32Å; F189-N191 PolarHBondContact O-N 3.02Å; F189-L192 PolarHBondContact O-N 3.31Å; F189-L192 VanDerWaalsContact O-N 3.11Å; F189-Y193 WeakPolarHBondContact O-CB 3.5Å; F189-Y193 PolarHBondContact O-N 2.94Å; F189-I239 HydrophobicContact CD2-CD1 4.45Å; F189-I239 HydrophobicContact CE2-CD1 3.58Å; F189-I239 HydrophobicContact CZ-CD1 3.64Å
190	W	75.3	Confident	72.3	Confident	102 Å²	102	88.7 Å²	88.7	39%	0.386	42%	0.422	S	S	.	.	H	α-helix	trans	-60.7	-38.4	177.7	-88	107.3	0	0	0	113.1	V186 Y187 Y193 N194 I255	V186-W190 PolarHBondContact O-N 3.3Å; V186-W190 VanDerWaalsContact O-N 3.08Å; Y187-W190 PolarHBondContact O-N 3.47Å; W190-Y193 AromaticContact CE3-CD1 3.87Å; W190-Y193 HydrophobicContact CE3-CD1 3.87Å; W190-Y193 HydrophobicContact CE3-CE1 4.46Å; W190-Y193 AromaticContact CZ3-CD1 3.71Å; W190-Y193 HydrophobicContact CZ3-CD1 3.71Å; W190-Y193 AromaticContact CZ3-CE1 3.84Å; W190-Y193 HydrophobicContact CZ3-CE1 3.84Å; W190-Y193 PolarHBondContact O-N 3.34Å; W190-N194 WeakPolarHBondContact O-CB 3.23Å; W190-N194 PolarHBondContact O-N 2.6Å; W190-N194 PolarHBondContact O-ND2 3.06Å; W190-I255 HydrophobicContact CZ2-CD1 4.2Å
191	N	75.6	Confident	71.9	Confident	60 Å²	60	89.2 Å²	89.2	32%	0.321	42%	0.423	S	S	.	.	H	α-helix	trans	-64	-41.9	173.9	-85.4	-11.9	0	0	0	112.5	Y187 N188 F189 Q195	Y187-N191 WeakPolarHBondContact CE1-ND2 3.44Å; Y187-N191 PolarHBondContact O-N 2.84Å; N188-N191 PolarHBondContact O-N 2.51Å; F189-N191 VanDerWaalsContact C-N 3.32Å; F189-N191 PolarHBondContact O-N 3.02Å; N191-Q195 VanDerWaalsContact O-CG 3.28Å; N191-Q195 WeakPolarHBondContact O-CG 3.35Å; N191-Q195 PolarHBondContact O-N 3.4Å
192	L	72.2	Confident	71.5	Confident	108 Å²	108	90 Å²	90	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-68.1	-41.8	177.5	-169.9	69.8	0	0	0	111.2	N188 F189 Q195 V196	N188-L192 WeakPolarHBondContact O-CB 3.33Å; N188-L192 PolarHBondContact O-N 3.38Å; F189-L192 PolarHBondContact O-N 3.31Å; F189-L192 VanDerWaalsContact O-N 3.11Å; L192-Q195 WeakPolarHBondContact O-CB 3.28Å; L192-Q195 PolarHBondContact O-N 2.89Å; L192-V196 WeakPolarHBondContact O-CG2 3.48Å; L192-V196 PolarHBondContact O-N 3.39Å
193	Y	71.4	Confident	70.7	Confident	70 Å²	70	96.6 Å²	96.6	28%	0.275	46%	0.455	S	S	.	.	H	α-helix	trans	-58.5	-49.6	175.1	-179.2	-98.5	0	0	0	111.3	F189 W190 Q195 V196 I197 L232	F189-Y193 WeakPolarHBondContact O-CB 3.5Å; F189-Y193 PolarHBondContact O-N 2.94Å; W190-Y193 AromaticContact CE3-CD1 3.87Å; W190-Y193 HydrophobicContact CE3-CD1 3.87Å; W190-Y193 HydrophobicContact CE3-CE1 4.46Å; W190-Y193 AromaticContact CZ3-CD1 3.71Å; W190-Y193 HydrophobicContact CZ3-CD1 3.71Å; W190-Y193 AromaticContact CZ3-CE1 3.84Å; W190-Y193 HydrophobicContact CZ3-CE1 3.84Å; W190-Y193 PolarHBondContact O-N 3.34Å; Y193-Q195 VanDerWaalsContact C-N 3.33Å; Y193-Q195 PolarHBondContact O-N 3.07Å; Y193-V196 PolarHBondContact O-N 3.03Å; Y193-V196 VanDerWaalsContact O-N 3.13Å; Y193-I197 HydrophobicContact CD1-CD1 3.79Å; Y193-I197 HydrophobicContact CD1-CG1 4.46Å; Y193-I197 HydrophobicContact CE1-CD1 3.16Å; Y193-I197 HydrophobicContact CE1-CG1 4.16Å; Y193-I197 HydrophobicContact CE2-CD1 4.3Å; Y193-I197 VanDerWaalsContact CZ-CD1 3.46Å; Y193-I197 PolarHBondContact O-N 3.18Å; Y193-L232 HydrophobicContact CE2-CD2 4.27Å
194	N	73.7	Confident	69.5	Low	76 Å²	76	98.8 Å²	98.8	41%	0.406	47%	0.466	S	S	.	.	H	α-helix	trans	-60.1	-40.8	175.1	-73	-24.2	0	0	0	112	W190 V196 I197 E198	W190-N194 WeakPolarHBondContact O-CB 3.23Å; W190-N194 PolarHBondContact O-N 2.6Å; W190-N194 PolarHBondContact O-ND2 3.06Å; N194-V196 PolarHBondContact O-N 3.37Å; N194-I197 PolarHBondContact O-N 3.4Å; N194-E198 WeakPolarHBondContact O-CB 3.4Å; N194-E198 VanDerWaalsContact O-CG 3.31Å; N194-E198 WeakPolarHBondContact O-CG 3.48Å; N194-E198 PolarHBondContact O-N 3.1Å
195	Q	73.2	Confident	67.9	Low	127 Å²	127	100 Å²	100	59%	0.593	47%	0.474	S	S	*	.	H	α-helix	trans	-62.9	-40	174.8	-76.6	174.5	17.7	0	0	112.6	N191 L192 Y193 A199	N191-Q195 VanDerWaalsContact O-CG 3.28Å; N191-Q195 WeakPolarHBondContact O-CG 3.35Å; N191-Q195 PolarHBondContact O-N 3.4Å; L192-Q195 WeakPolarHBondContact O-CB 3.28Å; L192-Q195 PolarHBondContact O-N 2.89Å; Y193-Q195 VanDerWaalsContact C-N 3.33Å; Y193-Q195 PolarHBondContact O-N 3.07Å; Q195-A199 WeakPolarHBondContact O-CB 3.31Å; Q195-A199 PolarHBondContact O-N 3.22Å
196	V	70.2	Confident	65.9	Low	64 Å²	64	98.6 Å²	98.6	39%	0.388	48%	0.478	S	S	.	.	H	α-helix	trans	-67.8	-41.9	177.4	171.3	0	0	0	0	110.9	L192 Y193 N194 A199 R200	L192-V196 WeakPolarHBondContact O-CG2 3.48Å; L192-V196 PolarHBondContact O-N 3.39Å; Y193-V196 PolarHBondContact O-N 3.03Å; Y193-V196 VanDerWaalsContact O-N 3.13Å; N194-V196 PolarHBondContact O-N 3.37Å; V196-A199 PolarHBondContact O-N 2.93Å; V196-R200 WeakPolarHBondContact O-CB 3.48Å; V196-R200 VanDerWaalsContact O-CG 3.32Å; V196-R200 WeakPolarHBondContact O-CG 3.49Å; V196-R200 PolarHBondContact O-N 3.37Å
197	I	69.3	Low	64.3	Low	47 Å²	47	103 Å²	103	24%	0.241	51%	0.507	C	S	.	.	H	α-helix	trans	-61	-50	174.1	-73.6	-174.5	0	0	0	110.8	Y193 N194 A199 R200 K201	Y193-I197 HydrophobicContact CD1-CD1 3.79Å; Y193-I197 HydrophobicContact CD1-CG1 4.46Å; Y193-I197 HydrophobicContact CE1-CD1 3.16Å; Y193-I197 HydrophobicContact CE1-CG1 4.16Å; Y193-I197 HydrophobicContact CE2-CD1 4.3Å; Y193-I197 VanDerWaalsContact CZ-CD1 3.46Å; Y193-I197 PolarHBondContact O-N 3.18Å; N194-I197 PolarHBondContact O-N 3.4Å; I197-A199 VanDerWaalsContact C-N 3.33Å; I197-A199 PolarHBondContact O-N 3.41Å; I197-R200 WeakPolarHBondContact O-CB 3.44Å; I197-R200 PolarHBondContact O-N 2.86Å; I197-R200 VanDerWaalsContact O-N 3.11Å; I197-K201 HydrophobicContact CG2-CD 4.23Å; I197-K201 HydrophobicContact CG2-CG 4.49Å; I197-K201 WeakPolarHBondContact O-CG 2.92Å; I197-K201 PolarHBondContact O-N 2.99Å
198	E	70.1	Confident	62.6	Low	107 Å²	107	102.8 Å²	102.8	50%	0.5	52%	0.521	S	S	.	.	H	α-helix	trans	-63	-39	179.4	-71.8	-58	126.1	0	0	111.9	N194 R200 K201 S202	N194-E198 WeakPolarHBondContact O-CB 3.4Å; N194-E198 VanDerWaalsContact O-CG 3.31Å; N194-E198 WeakPolarHBondContact O-CG 3.48Å; N194-E198 PolarHBondContact O-N 3.1Å; E198-R200 VanDerWaalsContact C-N 3.31Å; E198-R200 PolarHBondContact O-N 3.03Å; E198-K201 PolarHBondContact O-N 3.15Å; E198-K201 WeakPolarHBondContact OE1-CD 3.47Å; E198-K201 IonicContact OE1-NZ 3.55Å; E198-K201 PolarHBondContact OE1-NZ 3.25Å; E198-S202 PolarHBondContact O-N 2.88Å; E198-S202 PolarHBondContact O-OG 2.94Å
199	A	69.9	Low	60.9	Low	43 Å²	43	109.2 Å²	109.2	36%	0.355	54%	0.538	S	S	.	.	H	α-helix	trans	-66.3	-30.5	174.3	0	0	0	0	0	113.2	Q195 V196 I197 S202 R203	Q195-A199 WeakPolarHBondContact O-CB 3.31Å; Q195-A199 PolarHBondContact O-N 3.22Å; V196-A199 PolarHBondContact O-N 2.93Å; I197-A199 VanDerWaalsContact C-N 3.33Å; I197-A199 PolarHBondContact O-N 3.41Å; A199-S202 PolarHBondContact O-OG 3.06Å; A199-R203 VanDerWaalsContact O-CG 3.32Å; A199-R203 WeakPolarHBondContact O-CG 3.44Å; A199-R203 PolarHBondContact O-N 2.79Å
200	R	63.4	Low	59.1	Low	149 Å²	149	109.5 Å²	109.5	56%	0.562	56%	0.557	S	S	*	*	H	α-helix	trans	-73.4	-44.4	173.1	-75.8	176.1	179.1	179.5	0.1	110.9	V196 I197 E198 S202 R203 I204	V196-R200 WeakPolarHBondContact O-CB 3.48Å; V196-R200 VanDerWaalsContact O-CG 3.32Å; V196-R200 WeakPolarHBondContact O-CG 3.49Å; V196-R200 PolarHBondContact O-N 3.37Å; I197-R200 WeakPolarHBondContact O-CB 3.44Å; I197-R200 PolarHBondContact O-N 2.86Å; I197-R200 VanDerWaalsContact O-N 3.11Å; E198-R200 VanDerWaalsContact C-N 3.31Å; E198-R200 PolarHBondContact O-N 3.03Å; R200-S202 VanDerWaalsContact C-N 3.27Å; R200-S202 PolarHBondContact O-N 3.35Å; R200-R203 PolarHBondContact O-N 3.39Å; R200-I204 WeakPolarHBondContact O-CG1 3.47Å; R200-I204 PolarHBondContact O-N 2.98Å
201	K	66.6	Low	57.3	Low	118 Å²	118	113.8 Å²	113.8	51%	0.513	57%	0.574	S	S	.	*	H	α-helix	trans	-56.6	-40.9	173.1	-70.6	176.6	-174.4	167.8	0	111.8	I197 E198 R203	I197-K201 HydrophobicContact CG2-CD 4.23Å; I197-K201 HydrophobicContact CG2-CG 4.49Å; I197-K201 WeakPolarHBondContact O-CG 2.92Å; I197-K201 PolarHBondContact O-N 2.99Å; E198-K201 PolarHBondContact O-N 3.15Å; E198-K201 WeakPolarHBondContact OE1-CD 3.47Å; E198-K201 IonicContact OE1-NZ 3.55Å; E198-K201 PolarHBondContact OE1-NZ 3.25Å; K201-R203 VanDerWaalsContact C-N 3.31Å; K201-R203 PolarHBondContact O-N 3.05Å
202	S	62.6	Low	55.4	Low	81 Å²	81	116.9 Å²	116.9	57%	0.566	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-17.7	178.4	71.3	0	0	0	0	114.5	E198 A199 R200	E198-S202 PolarHBondContact O-N 2.88Å; E198-S202 PolarHBondContact O-OG 2.94Å; A199-S202 PolarHBondContact O-OG 3.06Å; R200-S202 VanDerWaalsContact C-N 3.27Å; R200-S202 PolarHBondContact O-N 3.35Å
203	R	55.4	Low	53.6	Low	217 Å²	217	119.9 Å²	119.9	82%	0.819	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-16.5	178.5	-78.5	179.6	-174.4	-167.8	2.7	113.8	A199 R200 K201 I205	A199-R203 VanDerWaalsContact O-CG 3.32Å; A199-R203 WeakPolarHBondContact O-CG 3.44Å; A199-R203 PolarHBondContact O-N 2.79Å; R200-R203 PolarHBondContact O-N 3.39Å; K201-R203 VanDerWaalsContact C-N 3.31Å; K201-R203 PolarHBondContact O-N 3.05Å; R203-I205 VanDerWaalsContact C-N 3.34Å
204	I	48.9	Very low	51.9	Low	137 Å²	137	123.2 Å²	123.2	70%	0.703	63%	0.634	S	S	*	*	S	Bend	trans	-87.6	-6.2	-179.9	-64.3	166.1	0	0	0	111.6	R200 P206	R200-I204 WeakPolarHBondContact O-CG1 3.47Å; R200-I204 PolarHBondContact O-N 2.98Å; I204-P206 WeakPolarHBondContact O-CD 3.38Å
205	I	40.4	Very low	50.1	Low	122 Å²	122	126.9 Å²	126.9	63%	0.626	65%	0.648	S	S	*	*	S	Bend	trans	-89.5	107.6	173.9	-54.3	170.5	0	0	0	108.6	R203	R203-I205 VanDerWaalsContact C-N 3.34Å
206	P	32.7	Very low	48.4	Very low	98 Å²	98	127.9 Å²	127.9	64%	0.636	65%	0.653	S	S	*	*			trans	-63.6	146.6	172.2	26.9	-31.8	0	0	0	109.4	I204 T208	I204-P206 WeakPolarHBondContact O-CD 3.38Å; P206-T208 PolarHBondContact O-N 3.13Å
207	P	39	Very low	46.9	Very low	126 Å²	126	131 Å²	131	82%	0.818	67%	0.668	S	S	*	*			trans	-64.1	112	177.8	21	-22.4	0	0	0	108.7	R209	P207-R209 PolarHBondContact O-N 2.86Å
208	T	39.3	Very low	45.5	Very low	134 Å²	134	136.7 Å²	136.7	82%	0.822	69%	0.693	S	S	*	*			trans	-58.6	102.2	174.8	-35.3	0	0	0	0	108.3	P206 A210	P206-T208 PolarHBondContact O-N 3.13Å; T208-A210 PolarHBondContact O-N 3.47Å; T208-A210 VanDerWaalsContact O-N 3.14Å
209	R	37.2	Very low	44	Very low	221 Å²	221	136.1 Å²	136.1	83%	0.834	70%	0.701	S	S	*	*			trans	-65.1	112.4	170.9	-96.1	-175.5	178.8	174.9	0.6	108	P207 Y211	P207-R209 PolarHBondContact O-N 2.86Å; R209-Y211 HydrophobicContact CB-CD2 4.31Å; R209-Y211 PolarHBondContact O-N 2.86Å; R209-Y211 VanDerWaalsContact O-N 3.11Å
210	A	34.1	Very low	42.5	Very low	92 Å²	92	141.7 Å²	141.7	76%	0.76	73%	0.725	S	S	*	*			trans	-69.7	98.4	168.7	0	0	0	0	0	109.7	T208	T208-A210 PolarHBondContact O-N 3.47Å; T208-A210 VanDerWaalsContact O-N 3.14Å
211	Y	37.9	Very low	41	Very low	193 Å²	193	138.6 Å²	138.6	76%	0.757	74%	0.739	S	S	*	*			trans	-141.3	105.4	160.7	-72.7	-74.1	0	0	0	110.1	R209	R209-Y211 HydrophobicContact CB-CD2 4.31Å; R209-Y211 PolarHBondContact O-N 2.86Å; R209-Y211 VanDerWaalsContact O-N 3.11Å
212	T	36.1	Very low	39.7	Very low	125 Å²	125	141.9 Å²	141.9	77%	0.767	76%	0.756	S	S	*	*			trans	33.7	110.1	143.3	56.5	0	0	0	0	120.4
213	L	33.5	Very low	38.7	Very low	170 Å²	170	142.8 Å²	142.8	89%	0.89	76%	0.762	S	S	*	*			trans	23.7	106.6	133.4	-82.1	143.1	0	0	0	117.9
214	N	36.6	Very low	37.9	Very low	140 Å²	140	140.3 Å²	140.3	75%	0.749	76%	0.763	S	S	*	*				-172.1	121.4	110.2	-117.4	1.3	0	0	0	112.3
215	E	36.1	Very low	37.6	Very low	153 Å²	153	140.2 Å²	140.2	72%	0.715	76%	0.764	S	S	*	*			trans	40.3	129.2	141	-70.6	-171.4	168.5	0	0	123.8
216	Q	36.7	Very low	37.8	Very low	149 Å²	149	143.7 Å²	143.7	70%	0.696	78%	0.778	S	S	*	*			trans	92.6	100.1	138.5	-73.1	175.1	16	0	0	120.5
217	N	39.5	Very low	38.5	Very low	129 Å²	129	145.5 Å²	145.5	69%	0.69	78%	0.781	S	S	*	*				89.5	134.5	125.1	-61.4	-24.4	0	0	0	121.2
218	H	40.6	Very low	39.1	Very low	166 Å²	166	144.5 Å²	144.5	77%	0.769	77%	0.769	S	S	*	*			trans	93.7	89.9	154.9	-61.6	-58.3	0	0	0	120.3
219	S	38	Very low	39.7	Very low	95 Å²	95	144.9 Å²	144.9	66%	0.664	76%	0.761	S	S	*	*				32.7	114.2	123.9	61.5	0	0	0	0	119.6
220	N	38.1	Very low	40.6	Very low	161 Å²	161	138.3 Å²	138.3	86%	0.861	74%	0.743	S	S	*	*				-170.5	123.5	114.6	-96.3	-11.4	0	0	0	109.4
221	G	32.6	Very low	41.8	Very low	83 Å²	83	139.1 Å²	139.1	86%	0.856	73%	0.734	S	S	*	*			trans	-80.4	115.4	176.2	0	0	0	0	0	110.3
222	E	38.6	Very low	42.4	Very low	188 Å²	188	133 Å²	133	88%	0.879	71%	0.714	S	S	*	*			trans	-87.5	116.8	161.3	-86.9	178.8	153.1	0	0	108.5	I224	E222-I224 PolarHBondContact O-N 3.09Å
223	S	40.5	Very low	43	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	70%	0.695	S	S	*	*			trans	-62.2	117.6	167.9	56.4	0	0	0	0	108.9	N225	S223-N225 PolarHBondContact O-N 3.33Å; S223-N225 VanDerWaalsContact O-N 3.15Å
224	I	40.5	Very low	44.1	Very low	164 Å²	164	127.2 Å²	127.2	84%	0.841	68%	0.679	S	S	*	*			trans	-65.6	112.6	165.7	-65.7	166.7	0	0	0	106	E222 E226	E222-I224 PolarHBondContact O-N 3.09Å; I224-E226 PolarHBondContact O-N 3.41Å; I224-E226 VanDerWaalsContact O-N 3.15Å
225	N	41.3	Very low	45.1	Very low	135 Å²	135	127.8 Å²	127.8	72%	0.722	68%	0.677	S	S	*	*			trans	-51.9	117.6	176.1	-68.6	-33.3	0	0	0	109.6	S223 I227	S223-N225 PolarHBondContact O-N 3.33Å; S223-N225 VanDerWaalsContact O-N 3.15Å; N225-I227 PolarHBondContact O-N 2.99Å; N225-I227 VanDerWaalsContact O-N 3.11Å
226	E	44.2	Very low	46.1	Very low	196 Å²	196	125.9 Å²	125.9	92%	0.916	67%	0.668	S	S	*	*			trans	-57.4	111.2	160.8	-81.5	175.2	152.7	0	0	106.7	I224 D228	I224-E226 PolarHBondContact O-N 3.41Å; I224-E226 VanDerWaalsContact O-N 3.15Å; E226-D228 PolarHBondContact O-N 2.79Å
227	I	48.7	Very low	47.1	Very low	136 Å²	136	123.1 Å²	123.1	70%	0.697	66%	0.663	S	S	*	*			trans	-66.3	119.8	169.6	-67.1	166.8	0	0	0	105.6	N225 E229	N225-I227 PolarHBondContact O-N 2.99Å; N225-I227 VanDerWaalsContact O-N 3.11Å; I227-E229 PolarHBondContact O-N 3.15Å
228	D	51.8	Low	48	Very low	105 Å²	105	124.7 Å²	124.7	56%	0.561	67%	0.666	S	S	*	*			trans	-56.6	122.1	-178.7	-135	-24.1	0	0	0	109	E226 D230 D231	E226-D228 PolarHBondContact O-N 2.79Å; D228-D230 PolarHBondContact O-N 3.45Å; D228-D230 VanDerWaalsContact O-N 3.08Å; D228-D231 PolarHBondContact O-N 3.26Å; D228-D231 VanDerWaalsContact O-N 3.11Å
229	E	52.2	Low	48.7	Very low	142 Å²	142	119.3 Å²	119.3	66%	0.664	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-19.6	-178.7	-68.8	-170.7	162.2	0	0	111.8	I227	I227-E229 PolarHBondContact O-N 3.15Å
230	D	54.7	Low	49.9	Very low	83 Å²	83	120.9 Å²	120.9	44%	0.444	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	-31.5	177.2	-76.3	-27.3	0	0	0	113.3	D228 L232 L233	D228-D230 PolarHBondContact O-N 3.45Å; D228-D230 VanDerWaalsContact O-N 3.08Å; D230-L232 PolarHBondContact O-N 3.46Å; D230-L233 PolarHBondContact O-N 3.04Å
231	D	59.2	Low	51.4	Low	109 Å²	109	119.3 Å²	119.3	58%	0.583	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-23.6	178.8	-78.9	-17.5	0	0	0	112.4	D228	D228-D231 PolarHBondContact O-N 3.26Å; D228-D231 VanDerWaalsContact O-N 3.11Å
232	L	50.6	Low	52.7	Low	63 Å²	63	120 Å²	120	33%	0.33	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.4	-20.3	-179.5	-137.8	85.9	0	0	0	112.8	Y193 D230 E235	Y193-L232 HydrophobicContact CE2-CD2 4.27Å; D230-L232 PolarHBondContact O-N 3.46Å; L232-E235 PolarHBondContact O-N 3.14Å
233	L	49.9	Very low	53.6	Low	70 Å²	70	114.1 Å²	114.1	37%	0.366	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	-14.6	178.7	-72.1	172.5	0	0	0	112.7	D230 E235	D230-L233 PolarHBondContact O-N 3.04Å; L233-E235 VanDerWaalsContact C-N 3.25Å
234	D	56.6	Low	55	Low	105 Å²	105	113.3 Å²	113.3	56%	0.561	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-15.2	168.9	-76.6	-15.5	0	0	0	112.5
235	E	58	Low	56.4	Low	152 Å²	152	109.6 Å²	109.6	71%	0.71	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-20.2	176.3	-65.9	-163.2	159.6	0	0	113.9	L232 L233	L232-E235 PolarHBondContact O-N 3.14Å; L233-E235 VanDerWaalsContact C-N 3.25Å
236	E	55.3	Low	57.4	Low	112 Å²	112	104.8 Å²	104.8	52%	0.523	52%	0.522	S	S	.	.			trans	-140.1	78.7	-178	-68	-161.9	164.6	0	0	113.7	E238 I239	E236-E238 PolarHBondContact O-N 2.84Å; E236-E238 VanDerWaalsContact O-N 3.14Å; E236-I239 HydrophobicContact CB-CD1 4.25Å; E236-I239 HydrophobicContact CB-CG1 4.22Å; E236-I239 PolarHBondContact O-N 3.42Å; E236-I239 VanDerWaalsContact O-N 3.08Å; E236-I239 WeakPolarHBondContact OE2-CD1 3.42Å
237	P	59.2	Low	58.7	Low	91 Å²	91	100 Å²	100	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-24.5	-173.4	24.4	-34.8	0	0	0	114.4	I239 R240 E241	P237-I239 VanDerWaalsContact C-N 3.28Å; P237-I239 PolarHBondContact O-N 3.08Å; P237-R240 PolarHBondContact O-N 3.39Å; P237-E241 PolarHBondContact O-N 3.02Å; P237-E241 VanDerWaalsContact O-N 3.08Å
238	E	58.7	Low	59.7	Low	162 Å²	162	97.3 Å²	97.3	76%	0.757	50%	0.5	S	S	*	.	H	α-helix	trans	-65.5	-32	177.3	-60.6	-179.5	-178.8	0	0	112	E236 L242	E236-E238 PolarHBondContact O-N 2.84Å; E236-E238 VanDerWaalsContact O-N 3.14Å; E238-L242 WeakPolarHBondContact O-CB 3.47Å; E238-L242 PolarHBondContact O-N 3.29Å; E238-L242 VanDerWaalsContact O-N 3.1Å
239	I	54.9	Low	60.3	Low	53 Å²	53	98.5 Å²	98.5	27%	0.272	51%	0.507	S	S	.	.	H	α-helix	trans	-75.4	-38.4	177.6	-61.6	-167.5	0	0	0	110.4	F189 E236 P237 E241 L242 M243	F189-I239 HydrophobicContact CD2-CD1 4.45Å; F189-I239 HydrophobicContact CE2-CD1 3.58Å; F189-I239 HydrophobicContact CZ-CD1 3.64Å; E236-I239 HydrophobicContact CB-CD1 4.25Å; E236-I239 HydrophobicContact CB-CG1 4.22Å; E236-I239 PolarHBondContact O-N 3.42Å; E236-I239 VanDerWaalsContact O-N 3.08Å; E236-I239 WeakPolarHBondContact OE2-CD1 3.42Å; P237-I239 VanDerWaalsContact C-N 3.28Å; P237-I239 PolarHBondContact O-N 3.08Å; I239-E241 VanDerWaalsContact C-N 3.34Å; I239-E241 PolarHBondContact O-N 3.07Å; I239-L242 PolarHBondContact O-N 3.49Å; I239-M243 VanDerWaalsContact O-CB 3.28Å; I239-M243 WeakPolarHBondContact O-CB 3.25Å; I239-M243 PolarHBondContact O-N 3.18Å
240	R	63.2	Low	60.3	Low	128 Å²	128	94.9 Å²	94.9	48%	0.483	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-42.6	175.5	-160.4	175.8	-158.4	-113.2	3.5	111.5	P237 M243 N244	P237-R240 PolarHBondContact O-N 3.39Å; R240-M243 PolarHBondContact O-N 3.04Å; R240-N244 WeakPolarHBondContact O-CB 3.34Å; R240-N244 VanDerWaalsContact O-CG 3.24Å; R240-N244 PolarHBondContact O-N 3.15Å; R240-N244 PolarHBondContact O-ND2 3.17Å
241	E	68	Low	59.9	Low	129 Å²	129	93 Å²	93	60%	0.603	50%	0.5	S	S	*	.	H	α-helix	trans	-66.4	-41.6	175.9	-168.8	174.8	-177.2	0	0	112	P237 I239 N244 N245	P237-E241 PolarHBondContact O-N 3.02Å; P237-E241 VanDerWaalsContact O-N 3.08Å; I239-E241 VanDerWaalsContact C-N 3.34Å; I239-E241 PolarHBondContact O-N 3.07Å; E241-N244 PolarHBondContact O-N 3.46Å; E241-N245 WeakPolarHBondContact O-CB 3.49Å; E241-N245 VanDerWaalsContact O-CG 3.32Å; E241-N245 PolarHBondContact O-N 3.4Å; E241-N245 PolarHBondContact O-ND2 2.89Å
242	L	61.3	Low	59.5	Low	98 Å²	98	93.9 Å²	93.9	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-40.1	175.4	-160.5	106.3	0	0	0	112	E238 I239 N245 L246	E238-L242 WeakPolarHBondContact O-CB 3.47Å; E238-L242 PolarHBondContact O-N 3.29Å; E238-L242 VanDerWaalsContact O-N 3.1Å; I239-L242 PolarHBondContact O-N 3.49Å; L242-N245 PolarHBondContact O-N 2.83Å; L242-L246 HydrophobicContact CD2-CD1 4.07Å; L242-L246 HydrophobicContact CG-CD1 4.5Å; L242-L246 WeakPolarHBondContact O-CG 3.38Å; L242-L246 PolarHBondContact O-N 3.13Å
243	M	56.8	Low	59.5	Low	63 Å²	63	94.8 Å²	94.8	31%	0.31	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-47.6	177.5	-172.1	179.2	72.2	0	0	111.4	I239 R240 N245 L246 I247	I239-M243 VanDerWaalsContact O-CB 3.28Å; I239-M243 WeakPolarHBondContact O-CB 3.25Å; I239-M243 PolarHBondContact O-N 3.18Å; R240-M243 PolarHBondContact O-N 3.04Å; M243-N245 VanDerWaalsContact C-N 3.29Å; M243-N245 PolarHBondContact O-N 3.3Å; M243-L246 PolarHBondContact O-N 3.36Å; M243-L246 VanDerWaalsContact O-N 3.13Å; M243-I247 HydrophobicContact CG-CD1 3.95Å; M243-I247 WeakPolarHBondContact O-CG1 3.34Å; M243-I247 PolarHBondContact O-N 3.24Å
244	N	71	Confident	59.1	Low	83 Å²	83	99.8 Å²	99.8	44%	0.444	53%	0.529	S	S	.	.	H	α-helix	trans	-61	-38.1	176.4	-73	-25.2	0	0	0	112	R240 E241 A248	R240-N244 WeakPolarHBondContact O-CB 3.34Å; R240-N244 VanDerWaalsContact O-CG 3.24Å; R240-N244 PolarHBondContact O-N 3.15Å; R240-N244 PolarHBondContact O-ND2 3.17Å; E241-N244 PolarHBondContact O-N 3.46Å; N244-A248 WeakPolarHBondContact O-CB 3.47Å; N244-A248 PolarHBondContact O-N 3.33Å
245	N	69.6	Low	58.4	Low	86 Å²	86	99.3 Å²	99.3	46%	0.46	53%	0.525	S	S	.	.	H	α-helix	trans	-68.6	-33.3	175.1	-77.5	-45.6	0	0	0	113.1	E241 L242 M243 N249	E241-N245 WeakPolarHBondContact O-CB 3.49Å; E241-N245 VanDerWaalsContact O-CG 3.32Å; E241-N245 PolarHBondContact O-N 3.4Å; E241-N245 PolarHBondContact O-ND2 2.89Å; L242-N245 PolarHBondContact O-N 2.83Å; M243-N245 VanDerWaalsContact C-N 3.29Å; M243-N245 PolarHBondContact O-N 3.3Å; N245-N249 WeakPolarHBondContact O-CB 3.33Å; N245-N249 PolarHBondContact O-N 3.37Å; N245-N249 PolarHBondContact O-ND2 3.17Å
246	L	61	Low	57.1	Low	34 Å²	34	97.9 Å²	97.9	18%	0.178	53%	0.529	C	S	.	.	H	α-helix	trans	-73.2	-40.7	175.5	-74.8	166.2	0	0	0	111.8	V186 L242 M243 N249 C251	V186-L246 HydrophobicContact CG2-CD1 4.29Å; L242-L246 HydrophobicContact CD2-CD1 4.07Å; L242-L246 HydrophobicContact CG-CD1 4.5Å; L242-L246 WeakPolarHBondContact O-CG 3.38Å; L242-L246 PolarHBondContact O-N 3.13Å; M243-L246 PolarHBondContact O-N 3.36Å; M243-L246 VanDerWaalsContact O-N 3.13Å; L246-N249 PolarHBondContact O-N 3.19Å; L246-C251 HydrophobicContact CB-CB 4.48Å; L246-C251 WeakPolarHBondContact O-CB 3.23Å; L246-C251 PolarHBondContact O-N 3.15Å
247	I	71.6	Confident	56.2	Low	96 Å²	96	99.1 Å²	99.1	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-44.9	174.7	-66	167	0	0	0	110.3	M243 N249 G250	M243-I247 HydrophobicContact CG-CD1 3.95Å; M243-I247 WeakPolarHBondContact O-CG1 3.34Å; M243-I247 PolarHBondContact O-N 3.24Å; I247-N249 PolarHBondContact O-N 2.96Å; I247-G250 PolarHBondContact O-N 3.42Å; I247-G250 VanDerWaalsContact O-N 3.13Å
248	A	70.5	Confident	54.8	Low	79 Å²	79	99.8 Å²	99.8	65%	0.653	55%	0.545	S	S	*	.	H	α-helix	trans	-63.1	-25.5	177.9	0	0	0	0	0	113.7	N244	N244-A248 WeakPolarHBondContact O-CB 3.47Å; N244-A248 PolarHBondContact O-N 3.33Å
249	N	64.9	Low	53.6	Low	131 Å²	131	101.4 Å²	101.4	70%	0.701	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	12	177.6	-74.5	-46.4	0	0	0	113.9	N245 L246 I247	N245-N249 WeakPolarHBondContact O-CB 3.33Å; N245-N249 PolarHBondContact O-N 3.37Å; N245-N249 PolarHBondContact O-ND2 3.17Å; L246-N249 PolarHBondContact O-N 3.19Å; I247-N249 PolarHBondContact O-N 2.96Å
250	G	51	Low	52.8	Low	66 Å²	66	105.1 Å²	105.1	68%	0.68	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.7	19.4	173.7	0	0	0	0	0	114.7	I247 D252	I247-G250 PolarHBondContact O-N 3.42Å; I247-G250 VanDerWaalsContact O-N 3.13Å; G250-D252 PolarHBondContact O-N 3.3Å; G250-D252 VanDerWaalsContact O-N 3.16Å
251	C	47.5	Very low	51.2	Low	44 Å²	44	108.7 Å²	108.7	30%	0.297	59%	0.594	S	S	.	*			trans	-72.6	105.7	167.5	-71.4	0	0	0	0	109.1	L246 L253	L246-C251 HydrophobicContact CB-CB 4.48Å; L246-C251 WeakPolarHBondContact O-CB 3.23Å; L246-C251 PolarHBondContact O-N 3.15Å; C251-L253 PolarHBondContact O-N 3.46Å
252	D	49.4	Very low	49.6	Very low	127 Å²	127	111 Å²	111	68%	0.679	61%	0.605	S	S	*	*			trans	-69.9	75.2	174.9	-164.4	16.5	0	0	0	110.2	G250 K254	G250-D252 PolarHBondContact O-N 3.3Å; G250-D252 VanDerWaalsContact O-N 3.16Å; D252-K254 VanDerWaalsContact C-N 3.26Å; D252-K254 PolarHBondContact O-N 2.9Å; D252-K254 VanDerWaalsContact O-N 3.08Å; D252-K254 WeakPolarHBondContact OD2-CE 3.4Å
253	L	50.3	Low	48.3	Very low	82 Å²	82	114.1 Å²	114.1	43%	0.429	62%	0.621	S	S	.	*			trans	-75.9	84.4	166	-75	161.2	0	0	0	106.7	C251 I255	C251-L253 PolarHBondContact O-N 3.46Å; L253-I255 PolarHBondContact O-N 3.24Å
254	K	41.5	Very low	47	Very low	175 Å²	175	117 Å²	117	76%	0.761	65%	0.647	S	S	*	*			trans	-63.7	83.2	173.6	-72.3	-176.9	178.9	177.4	0	110.5	D252	D252-K254 VanDerWaalsContact C-N 3.26Å; D252-K254 PolarHBondContact O-N 2.9Å; D252-K254 VanDerWaalsContact O-N 3.08Å; D252-K254 WeakPolarHBondContact OD2-CE 3.4Å
255	I	42.3	Very low	45.1	Very low	94 Å²	94	117.2 Å²	117.2	48%	0.482	66%	0.655	S	S	.	*			trans	-132.3	122.7	161.2	-55.5	177.2	0	0	0	105.1	W190 L253 L257	W190-I255 HydrophobicContact CZ2-CD1 4.2Å; L253-I255 PolarHBondContact O-N 3.24Å; I255-L257 PolarHBondContact O-N 3.48Å
256	P	32	Very low	43.6	Very low	122 Å²	122	120.2 Å²	120.2	79%	0.792	67%	0.667	S	S	*	*			trans	-78	96.8	-168.6	29.6	-31.7	0	0	0	110.9
257	L	35.3	Very low	42.3	Very low	138 Å²	138	127 Å²	127	72%	0.723	70%	0.701	S	S	*	*			trans	-107.7	75.7	165.3	-79.8	157.7	0	0	0	109.1	I255	I255-L257 PolarHBondContact O-N 3.48Å
258	S	29.8	Very low	40.9	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	72%	0.718	S	S	*	*			trans	-90.8	96.4	166.9	55.2	0	0	0	0	109.4
259	K	33	Very low	39.4	Very low	196 Å²	196	133.9 Å²	133.9	85%	0.852	72%	0.715	S	S	*	*			trans	154.5	108.2	146.8	-90.1	170.2	-177.6	-178.9	0	108.3
260	T	38.2	Very low	38.1	Very low	131 Å²	131	132.8 Å²	132.8	80%	0.804	72%	0.717	S	S	*	*			trans	178.8	72.5	143.4	31.4	0	0	0	0	108.2
261	K	30.7	Very low	37.4	Very low	204 Å²	204	137.5 Å²	137.5	89%	0.887	72%	0.722	S	S	*	*			trans	-95.7	97.1	149.6	-92.8	-176.3	175.3	179.1	0	105.1
262	E	33.7	Very low	37.2	Very low	177 Å²	177	141.3 Å²	141.3	83%	0.827	74%	0.739	S	S	*	*			trans	169.4	150.2	153.4	-98.1	163	-173.6	0	0	108.1
263	L	35	Very low	36.6	Very low	163 Å²	163	141.8 Å²	141.8	85%	0.853	74%	0.737	S	S	*	*			trans	90.3	54.4	-179.9	-57.8	150.3	0	0	0	116	S265	L263-S265 PolarHBondContact O-N 3.24Å
264	S	28.7	Very low	36.1	Very low	123 Å²	123	143.4 Å²	143.4	86%	0.86	75%	0.746	S	S	*	*			trans	-79.7	88.8	146.1	70.9	0	0	0	0	109.7
265	S	32	Very low	36.6	Very low	88 Å²	88	138.6 Å²	138.6	62%	0.615	73%	0.731	S	S	*	*			trans	179.7	103.8	157.3	49.8	0	0	0	0	109.6	L263	L263-S265 PolarHBondContact O-N 3.24Å
266	E	36.2	Very low	37.4	Very low	150 Å²	150	137.8 Å²	137.8	70%	0.701	73%	0.733	S	S	*	*			trans	179.9	76.7	143.2	-101	170.1	-159.3	0	0	111.3	K268	E266-K268 VanDerWaalsContact C-N 3.3Å; E266-K268 PolarHBondContact O-N 2.99Å; E266-K268 VanDerWaalsContact O-N 3.09Å
267	I	35.1	Very low	38.4	Very low	175 Å²	175	134.8 Å²	134.8	90%	0.897	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	87.1	160.9	-62.9	168.4	0	0	0	105.9
268	K	41	Very low	39.6	Very low	194 Å²	194	129.5 Å²	129.5	84%	0.843	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.1	1.8	169.6	-106	164.6	-164.5	-168.3	0	117.1	E266 S270	E266-K268 VanDerWaalsContact C-N 3.3Å; E266-K268 PolarHBondContact O-N 2.99Å; E266-K268 VanDerWaalsContact O-N 3.09Å; K268-S270 PolarHBondContact O-N 3.45Å
269	Q	39.4	Very low	41.1	Very low	127 Å²	127	130.7 Å²	130.7	59%	0.593	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	8.6	-165.9	-67.3	-177.8	-7.3	0	0	117.7	E271	Q269-E271 VanDerWaalsContact C-N 3.32Å; Q269-E271 PolarHBondContact O-N 3.23Å
270	S	38	Very low	42.5	Very low	108 Å²	108	127.7 Å²	127.7	76%	0.755	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-18.1	-173.2	58.1	0	0	0	0	115.5	K268	K268-S270 PolarHBondContact O-N 3.45Å
271	E	37.3	Very low	43.8	Very low	164 Å²	164	124.7 Å²	124.7	77%	0.766	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-31.4	-179	-73.9	-177.6	158.2	0	0	113.4	Q269 T275	Q269-E271 VanDerWaalsContact C-N 3.32Å; Q269-E271 PolarHBondContact O-N 3.23Å; E271-T275 PolarHBondContact O-OG1 3.05Å
272	N	42.2	Very low	45.4	Very low	124 Å²	124	116.6 Å²	116.6	66%	0.663	61%	0.613	S	S	*	*	H	α-helix	trans	-77.1	-24.9	-177.4	-70.3	-11.8	0	0	0	113.6	L274 T275	N272-L274 VanDerWaalsContact C-N 3.34Å; N272-L274 PolarHBondContact O-N 3.36Å; N272-T275 WeakPolarHBondContact CA-OG1 3.08Å; N272-T275 PolarHBondContact O-OG1 3.33Å
273	H	37.3	Very low	47.1	Very low	138 Å²	138	112.5 Å²	112.5	64%	0.639	60%	0.596	S	S	*	*	H	α-helix	trans	-74.8	-24.4	-176.9	-146.3	-64	0	0	0	113
274	L	39.1	Very low	48.7	Very low	116 Å²	116	111.6 Å²	111.6	61%	0.607	59%	0.586	S	S	*	*	H	α-helix	trans	-76.2	-34.1	178.2	-162.6	72.4	0	0	0	111.7	N272 T278	N272-L274 VanDerWaalsContact C-N 3.34Å; N272-L274 PolarHBondContact O-N 3.36Å; L274-T278 WeakPolarHBondContact O-CB 3.46Å; L274-T278 PolarHBondContact O-N 2.96Å; L274-T278 PolarHBondContact O-OG1 2.99Å
275	T	51.4	Low	50.7	Low	73 Å²	73	106.9 Å²	106.9	45%	0.448	55%	0.55	S	S	.	.	H	α-helix	trans	-64	-45.9	175.7	15.1	0	0	0	0	112	E271 N272 A277 T278 E279	E271-T275 PolarHBondContact O-OG1 3.05Å; N272-T275 WeakPolarHBondContact CA-OG1 3.08Å; N272-T275 PolarHBondContact O-OG1 3.33Å; T275-A277 PolarHBondContact O-N 2.84Å; T275-T278 PolarHBondContact O-N 3.23Å; T275-E279 WeakPolarHBondContact O-CB 3.48Å; T275-E279 WeakPolarHBondContact O-CG 3.38Å; T275-E279 PolarHBondContact O-N 3.14Å
276	S	60.2	Low	52.4	Low	77 Å²	77	107.5 Å²	107.5	54%	0.538	54%	0.54	S	S	.	.	H	α-helix	trans	-63.6	-44.5	-179.1	178	0	0	0	0	113.2	T278 E279 H280	S276-T278 VanDerWaalsContact C-N 3.34Å; S276-T278 PolarHBondContact O-N 3.43Å; S276-E279 PolarHBondContact O-N 2.9Å; S276-H280 WeakPolarHBondContact O-CB 3.33Å; S276-H280 PolarHBondContact O-N 3.07Å
277	A	52.5	Low	54.1	Low	60 Å²	60	106.8 Å²	106.8	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-37.1	177.9	0	0	0	0	0	112.6	T275 R281	T275-A277 PolarHBondContact O-N 2.84Å; A277-R281 WeakPolarHBondContact O-CB 3.2Å; A277-R281 PolarHBondContact O-N 3.44Å
278	T	60.8	Low	55.7	Low	27 Å²	27	102.5 Å²	102.5	17%	0.166	51%	0.51	C	S	.	.	H	α-helix	trans	-68.3	-46.3	177.1	-54.9	0	0	0	0	110.8	L274 T275 S276 H280 R281 R282 D640	L274-T278 WeakPolarHBondContact O-CB 3.46Å; L274-T278 PolarHBondContact O-N 2.96Å; L274-T278 PolarHBondContact O-OG1 2.99Å; T275-T278 PolarHBondContact O-N 3.23Å; S276-T278 VanDerWaalsContact C-N 3.34Å; S276-T278 PolarHBondContact O-N 3.43Å; T278-H280 PolarHBondContact O-N 3.35Å; T278-R281 PolarHBondContact O-N 3.42Å; T278-R282 WeakPolarHBondContact O-CB 3.41Å; T278-R282 VanDerWaalsContact O-CG 3.31Å; T278-R282 WeakPolarHBondContact O-CG 3.48Å; T278-R282 PolarHBondContact O-N 3.01Å; T278-D640 WeakPolarHBondContact CG2-OD1 3.37Å
279	E	62.1	Low	57.1	Low	129 Å²	129	95.8 Å²	95.8	60%	0.603	48%	0.48	S	S	*	.	H	α-helix	trans	-61	-43.3	174.9	-77.1	-177.1	171.8	0	0	112.2	T275 S276 R281 R282 L283	T275-E279 WeakPolarHBondContact O-CB 3.48Å; T275-E279 WeakPolarHBondContact O-CG 3.38Å; T275-E279 PolarHBondContact O-N 3.14Å; S276-E279 PolarHBondContact O-N 2.9Å; E279-R281 VanDerWaalsContact C-N 3.32Å; E279-R281 PolarHBondContact O-N 2.85Å; E279-R282 WeakPolarHBondContact O-CB 3.12Å; E279-R282 PolarHBondContact O-N 2.97Å; E279-L283 WeakPolarHBondContact O-CB 3.36Å; E279-L283 PolarHBondContact O-N 3.38Å
280	H	62.2	Low	58.6	Low	133 Å²	133	95.7 Å²	95.7	62%	0.616	48%	0.475	S	S	*	.	H	α-helix	trans	-64.3	-38.4	177.3	-166.7	-52.5	0	0	0	111.7	S276 T278 L283 K284	S276-H280 WeakPolarHBondContact O-CB 3.33Å; S276-H280 PolarHBondContact O-N 3.07Å; T278-H280 PolarHBondContact O-N 3.35Å; H280-L283 PolarHBondContact O-N 2.95Å; H280-K284 PolarHBondContact O-N 2.93Å
281	R	63.9	Low	59.9	Low	68 Å²	68	96 Å²	96	26%	0.257	47%	0.473	S	S	.	.	H	α-helix	trans	-64.1	-45	173.3	-173.2	-175.9	-174.8	-173.1	4.2	111	A277 T278 E279 L283 K284 Q285 D640	A277-R281 WeakPolarHBondContact O-CB 3.2Å; A277-R281 PolarHBondContact O-N 3.44Å; T278-R281 PolarHBondContact O-N 3.42Å; E279-R281 VanDerWaalsContact C-N 3.32Å; E279-R281 PolarHBondContact O-N 2.85Å; R281-L283 PolarHBondContact O-N 3.16Å; R281-K284 WeakPolarHBondContact O-CB 3.37Å; R281-K284 PolarHBondContact O-N 3.47Å; R281-Q285 WeakPolarHBondContact O-CG 3.49Å; R281-Q285 PolarHBondContact O-N 2.98Å; R281-Q285 PolarHBondContact O-OE1 3.09Å; R281-D640 IonicContact NH1-OD2 2.77Å
282	R	66.1	Low	61.1	Low	34 Å²	34	90.7 Å²	90.7	13%	0.128	45%	0.448	C	S	.	.	H	α-helix	trans	-59.4	-44	176.1	-76.2	171.7	162.4	-124.8	-22.7	111.7	T278 E279 K284 Q285 Y286 D308 D640 T643 D644	T278-R282 WeakPolarHBondContact O-CB 3.41Å; T278-R282 VanDerWaalsContact O-CG 3.31Å; T278-R282 WeakPolarHBondContact O-CG 3.48Å; T278-R282 PolarHBondContact O-N 3.01Å; E279-R282 WeakPolarHBondContact O-CB 3.12Å; E279-R282 PolarHBondContact O-N 2.97Å; R282-K284 VanDerWaalsContact C-N 3.34Å; R282-K284 PolarHBondContact O-N 3.32Å; R282-Q285 CarbonylContact O-C 3.56Å; R282-Q285 WeakPolarHBondContact O-CB 3.3Å; R282-Q285 PolarHBondContact O-N 2.78Å; R282-Q285 VanDerWaalsContact O-N 3.15Å; R282-Y286 WeakPolarHBondContact O-CB 3.47Å; R282-Y286 PolarHBondContact O-N 3.36Å; R282-D308 IonicContact NH1-OD1 3.46Å; R282-D308 PolarHBondContact NH1-OD1 2.88Å; R282-D640 IonicContact NE-OD1 2.82Å; R282-D640 PolarHBondContact NH2-O 3.5Å; R282-T643 VanDerWaalsContact NH2-CB 3.27Å; R282-D644 IonicContact CZ-OD1 3.82Å; R282-D644 IonicContact NH1-OD1 3.35Å; R282-D644 IonicContact NH2-OD1 3.07Å; R282-D644 PolarHBondContact NH2-OD1 2.87Å; R282-D644 IonicContact NH2-OD2 2.93Å
283	L	67.8	Low	61.9	Low	91 Å²	91	89.2 Å²	89.2	48%	0.476	45%	0.447	S	S	.	.	H	α-helix	trans	-63	-39.4	176.3	-173.6	66.7	0	0	0	112.1	E279 H280 R281 Q285 Y286 K287	E279-L283 WeakPolarHBondContact O-CB 3.36Å; E279-L283 PolarHBondContact O-N 3.38Å; H280-L283 PolarHBondContact O-N 2.95Å; R281-L283 PolarHBondContact O-N 3.16Å; L283-Q285 VanDerWaalsContact C-N 3.33Å; L283-Y286 PolarHBondContact O-N 3.36Å; L283-K287 WeakPolarHBondContact O-CG 3.27Å; L283-K287 PolarHBondContact O-N 3.33Å
284	K	69.7	Low	63.1	Low	144 Å²	144	90.4 Å²	90.4	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-63.9	-41	174.4	-173.7	-179.7	178.3	-176.9	0	111.3	H280 R281 R282 K287 Q288	H280-K284 PolarHBondContact O-N 2.93Å; R281-K284 WeakPolarHBondContact O-CB 3.37Å; R281-K284 PolarHBondContact O-N 3.47Å; R282-K284 VanDerWaalsContact C-N 3.34Å; R282-K284 PolarHBondContact O-N 3.32Å; K284-K287 PolarHBondContact O-N 2.93Å; K284-Q288 WeakPolarHBondContact O-CB 3.12Å; K284-Q288 PolarHBondContact O-N 3.35Å
285	Q	69.6	Low	64.5	Low	24 Å²	24	86.3 Å²	86.3	11%	0.112	43%	0.429	C	S	.	.	H	α-helix	trans	-69.9	-38	177.3	-72	161.1	-16.9	0	0	112.1	R281 R282 L283 Q288 W289 P307	R281-Q285 WeakPolarHBondContact O-CG 3.49Å; R281-Q285 PolarHBondContact O-N 2.98Å; R281-Q285 PolarHBondContact O-OE1 3.09Å; R282-Q285 CarbonylContact O-C 3.56Å; R282-Q285 WeakPolarHBondContact O-CB 3.3Å; R282-Q285 PolarHBondContact O-N 2.78Å; R282-Q285 VanDerWaalsContact O-N 3.15Å; L283-Q285 VanDerWaalsContact C-N 3.33Å; Q285-Q288 PolarHBondContact O-N 3.42Å; Q285-W289 WeakPolarHBondContact O-CB 3.49Å; Q285-W289 PolarHBondContact O-N 3.16Å; Q285-P307 HydrophobicContact CB-CG 4.34Å
286	Y	69.2	Low	65.1	Low	102 Å²	102	85 Å²	85	40%	0.4	42%	0.422	S	S	.	.	H	α-helix	trans	-58.8	-53.3	172	-169.1	-83.8	0	0	0	109.4	R282 L283 Q288 W289 Y290 P307	R282-Y286 WeakPolarHBondContact O-CB 3.47Å; R282-Y286 PolarHBondContact O-N 3.36Å; L283-Y286 PolarHBondContact O-N 3.36Å; Y286-Q288 VanDerWaalsContact C-N 3.32Å; Y286-Q288 PolarHBondContact O-N 3.14Å; Y286-W289 PolarHBondContact O-N 3.04Å; Y286-Y290 AromaticContact CD1-CD2 3.7Å; Y286-Y290 HydrophobicContact CD1-CD2 3.7Å; Y286-Y290 AromaticContact CD1-CE2 3.89Å; Y286-Y290 HydrophobicContact CD1-CE2 3.89Å; Y286-Y290 HydrophobicContact CD2-CD2 4.35Å; Y286-Y290 AromaticContact CD2-CE2 3.82Å; Y286-Y290 HydrophobicContact CD2-CE2 3.82Å; Y286-Y290 AromaticContact CE1-CD2 3.51Å; Y286-Y290 HydrophobicContact CE1-CD2 3.51Å; Y286-Y290 AromaticContact CE1-CE2 3.44Å; Y286-Y290 HydrophobicContact CE1-CE2 3.44Å; Y286-Y290 VanDerWaalsContact CE1-CE2 3.44Å; Y286-Y290 HydrophobicContact CE1-CG 4.45Å; Y286-Y290 HydrophobicContact CE2-CD2 4.2Å; Y286-Y290 AromaticContact CE2-CE2 3.38Å; Y286-Y290 HydrophobicContact CE2-CE2 3.38Å; Y286-Y290 HydrophobicContact CG-CD2 4.11Å; Y286-Y290 HydrophobicContact CG-CE2 4.06Å; Y286-Y290 AromaticContact CZ-CD2 3.77Å; Y286-Y290 AromaticContact CZ-CE2 3.15Å; Y286-Y290 AromaticContact CZ-CZ 3.74Å; Y286-Y290 VanDerWaalsContact O-CD2 3.28Å; Y286-Y290 WeakPolarHBondContact O-CD2 3.44Å; Y286-Y290 PolarHBondContact O-N 2.9Å; Y286-Y290 VanDerWaalsContact O-N 3.08Å; Y286-Y290 WeakPolarHBondContact OH-CE2 3.16Å; Y286-Y290 PolarHBondContact OH-OH 3.42Å; Y286-P307 HydrophobicContact CD2-CB 4.5Å
287	K	70.3	Confident	65.5	Low	134 Å²	134	84.5 Å²	84.5	58%	0.583	41%	0.41	S	S	*	.	H	α-helix	trans	-54.5	-49.2	175.1	-73.8	179.7	-177.1	-179.7	0	111.4	L283 K284 W289 Y290 T291	L283-K287 WeakPolarHBondContact O-CG 3.27Å; L283-K287 PolarHBondContact O-N 3.33Å; K284-K287 PolarHBondContact O-N 2.93Å; K287-W289 PolarHBondContact O-N 3.39Å; K287-Y290 PolarHBondContact O-N 3.5Å; K287-T291 WeakPolarHBondContact O-CB 3.44Å; K287-T291 VanDerWaalsContact O-CG2 3.23Å; K287-T291 WeakPolarHBondContact O-CG2 3.28Å; K287-T291 PolarHBondContact O-N 2.81Å; K287-T291 PolarHBondContact O-OG1 2.83Å
288	Q	70.4	Confident	66.6	Low	86 Å²	86	82.9 Å²	82.9	40%	0.402	39%	0.394	S	S	.	.	H	α-helix	trans	-58.4	-48.1	178.6	-173.6	174.5	-9.2	0	0	111.6	K284 Q285 Y286 Y290 T291 E292	K284-Q288 WeakPolarHBondContact O-CB 3.12Å; K284-Q288 PolarHBondContact O-N 3.35Å; Q285-Q288 PolarHBondContact O-N 3.42Å; Y286-Q288 VanDerWaalsContact C-N 3.32Å; Y286-Q288 PolarHBondContact O-N 3.14Å; Q288-Y290 VanDerWaalsContact C-N 3.35Å; Q288-Y290 PolarHBondContact O-N 2.83Å; Q288-T291 WeakPolarHBondContact CA-OG1 3.48Å; Q288-T291 PolarHBondContact O-N 3.33Å; Q288-T291 PolarHBondContact O-OG1 2.95Å; Q288-E292 PolarHBondContact NE2-OE2 3.38Å; Q288-E292 VanDerWaalsContact O-CB 3.28Å; Q288-E292 WeakPolarHBondContact O-CB 3.32Å; Q288-E292 PolarHBondContact O-N 2.95Å
289	W	70.4	Confident	67.2	Low	52 Å²	52	83 Å²	83	20%	0.197	40%	0.395	C	S	.	.	H	α-helix	trans	-58.6	-41.7	-178.3	-169.9	-96.7	0	0	0	113	Q285 Y286 K287 N303 C305 K306	Q285-W289 WeakPolarHBondContact O-CB 3.49Å; Q285-W289 PolarHBondContact O-N 3.16Å; Y286-W289 PolarHBondContact O-N 3.04Å; K287-W289 PolarHBondContact O-N 3.39Å; W289-N303 WeakPolarHBondContact CH2-ND2 3.42Å; W289-C305 HydrophobicContact CE3-CB 4.25Å; W289-C305 HydrophobicContact CH2-CB 3.41Å; W289-C305 VanDerWaalsContact CH2-CB 3.41Å; W289-C305 HydrophobicContact CZ2-CB 4.45Å; W289-C305 HydrophobicContact CZ3-CB 3.27Å; W289-K306 HydrophobicContact CZ2-CB 4.15Å
290	Y	69.6	Low	67.4	Low	126 Å²	126	85.2 Å²	85.2	49%	0.494	40%	0.398	S	S	.	.	H	α-helix	trans	-81.8	-22.7	178.4	-75.8	-86.4	0	0	0	113.7	Y286 K287 Q288	Y286-Y290 AromaticContact CD1-CD2 3.7Å; Y286-Y290 HydrophobicContact CD1-CD2 3.7Å; Y286-Y290 AromaticContact CD1-CE2 3.89Å; Y286-Y290 HydrophobicContact CD1-CE2 3.89Å; Y286-Y290 HydrophobicContact CD2-CD2 4.35Å; Y286-Y290 AromaticContact CD2-CE2 3.82Å; Y286-Y290 HydrophobicContact CD2-CE2 3.82Å; Y286-Y290 AromaticContact CE1-CD2 3.51Å; Y286-Y290 HydrophobicContact CE1-CD2 3.51Å; Y286-Y290 AromaticContact CE1-CE2 3.44Å; Y286-Y290 HydrophobicContact CE1-CE2 3.44Å; Y286-Y290 VanDerWaalsContact CE1-CE2 3.44Å; Y286-Y290 HydrophobicContact CE1-CG 4.45Å; Y286-Y290 HydrophobicContact CE2-CD2 4.2Å; Y286-Y290 AromaticContact CE2-CE2 3.38Å; Y286-Y290 HydrophobicContact CE2-CE2 3.38Å; Y286-Y290 HydrophobicContact CG-CD2 4.11Å; Y286-Y290 HydrophobicContact CG-CE2 4.06Å; Y286-Y290 AromaticContact CZ-CD2 3.77Å; Y286-Y290 AromaticContact CZ-CE2 3.15Å; Y286-Y290 AromaticContact CZ-CZ 3.74Å; Y286-Y290 VanDerWaalsContact O-CD2 3.28Å; Y286-Y290 WeakPolarHBondContact O-CD2 3.44Å; Y286-Y290 PolarHBondContact O-N 2.9Å; Y286-Y290 VanDerWaalsContact O-N 3.08Å; Y286-Y290 WeakPolarHBondContact OH-CE2 3.16Å; Y286-Y290 PolarHBondContact OH-OH 3.42Å; K287-Y290 PolarHBondContact O-N 3.5Å; Q288-Y290 VanDerWaalsContact C-N 3.35Å; Q288-Y290 PolarHBondContact O-N 2.83Å
291	T	64.8	Low	67.5	Low	115 Å²	115	82.1 Å²	82.1	71%	0.706	38%	0.383	S	S	*	.	H	α-helix	trans	-88.2	-24.6	177.2	56.3	0	0	0	0	114.1	K287 Q288	K287-T291 WeakPolarHBondContact O-CB 3.44Å; K287-T291 VanDerWaalsContact O-CG2 3.23Å; K287-T291 WeakPolarHBondContact O-CG2 3.28Å; K287-T291 PolarHBondContact O-N 2.81Å; K287-T291 PolarHBondContact O-OG1 2.83Å; Q288-T291 WeakPolarHBondContact CA-OG1 3.48Å; Q288-T291 PolarHBondContact O-N 3.33Å; Q288-T291 PolarHBondContact O-OG1 2.95Å
292	E	62.9	Low	67.7	Low	52 Å²	52	79.2 Å²	79.2	24%	0.243	37%	0.372	C	S	.	.	S	Bend	trans	-76.4	134	-178.1	-150.8	163.3	-179.1	0	0	109.3	Q288 R295 T710	Q288-E292 PolarHBondContact NE2-OE2 3.38Å; Q288-E292 VanDerWaalsContact O-CB 3.28Å; Q288-E292 WeakPolarHBondContact O-CB 3.32Å; Q288-E292 PolarHBondContact O-N 2.95Å; E292-R295 IonicContact OE2-CZ 2.63Å; E292-R295 IonicContact OE2-NE 3.73Å; E292-R295 IonicContact OE2-NH2 2.79Å; E292-R295 PolarHBondContact OE2-NH2 3.15Å; E292-T710 WeakPolarHBondContact OE1-CB 3.16Å; E292-T710 PolarHBondContact OE1-OG1 3.15Å
293	S	59.8	Low	68.3	Low	93 Å²	93	77.6 Å²	77.6	65%	0.65	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-55.8	154.1	175.4	47.7	0	0	0	0	110.5	R295	S293-R295 PolarHBondContact O-N 3.15Å
294	Q	62.7	Low	69	Low	162 Å²	162	73.6 Å²	73.6	76%	0.757	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-49.9	120.4	-180	-71.3	-173.4	5.6	0	0	110
295	R	67.6	Low	69.4	Low	31 Å²	31	66.9 Å²	66.9	12%	0.117	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-71.5	124.6	-177.3	-63.2	-180	-175	-172.8	3.2	107.7	E292 S293 F297 T298 D699	E292-R295 IonicContact OE2-CZ 2.63Å; E292-R295 IonicContact OE2-NE 3.73Å; E292-R295 IonicContact OE2-NH2 2.79Å; E292-R295 PolarHBondContact OE2-NH2 3.15Å; S293-R295 PolarHBondContact O-N 3.15Å; R295-F297 PolarHBondContact O-N 3.36Å; R295-T298 PolarHBondContact O-N 3.36Å; R295-D699 WeakPolarHBondContact CD-OD2 3.36Å; R295-D699 IonicContact CZ-OD1 3.61Å; R295-D699 IonicContact CZ-OD2 3.18Å; R295-D699 IonicContact NE-OD2 2.96Å; R295-D699 IonicContact NH1-OD1 3.62Å; R295-D699 PolarHBondContact NH1-OD1 3.34Å; R295-D699 IonicContact NH1-OD2 3.89Å; R295-D699 PolarHBondContact NH1-OD2 3.46Å
296	P	63.8	Low	69.7	Low	44 Å²	44	67.5 Å²	67.5	29%	0.286	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	136.8	-177.5	25.5	-33.5	0	0	0	109.5	T298 L714	P296-T298 PolarHBondContact O-N 2.99Å; P296-T298 VanDerWaalsContact O-N 3.09Å; P296-L714 HydrophobicContact CG-CD1 4.31Å; P296-L714 HydrophobicContact CG-CD2 3.64Å
297	F	70.1	Confident	69.9	Low	68 Å²	68	62.9 Å²	62.9	30%	0.298	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	-6.8	177.3	-39.5	-72.9	0	0	0	117	R295 P299 L690 I724 I728	R295-F297 PolarHBondContact O-N 3.36Å; F297-P299 WeakPolarHBondContact O-CD 3.27Å; F297-L690 HydrophobicContact CB-CD2 4.04Å; F297-L690 HydrophobicContact CD1-CD2 3.86Å; F297-L690 HydrophobicContact CD2-CD2 3.5Å; F297-L690 VanDerWaalsContact CD2-CD2 3.5Å; F297-L690 HydrophobicContact CE1-CD1 4.4Å; F297-L690 HydrophobicContact CE1-CD2 4.18Å; F297-L690 HydrophobicContact CE2-CD2 3.84Å; F297-L690 HydrophobicContact CG-CD2 3.51Å; F297-L690 HydrophobicContact CZ-CD2 4.18Å; F297-I724 HydrophobicContact CE2-CG2 4.07Å; F297-I724 HydrophobicContact CZ-CG2 3.92Å; F297-I728 HydrophobicContact CE2-CD1 4.44Å; F297-I728 HydrophobicContact CE2-CG1 4.14Å; F297-I728 HydrophobicContact CZ-CG1 4.19Å
298	T	74.3	Confident	70	Confident	26 Å²	26	59.8 Å²	59.8	16%	0.16	29%	0.291	C	S	.	.	S	Bend	trans	-89.8	121.3	178.3	-49.9	0	0	0	0	109.5	R295 P296 R300 N303 V696	R295-T298 PolarHBondContact O-N 3.36Å; P296-T298 PolarHBondContact O-N 2.99Å; P296-T298 VanDerWaalsContact O-N 3.09Å; T298-R300 PolarHBondContact O-N 3.38Å; T298-N303 WeakPolarHBondContact CG2-ND2 3.37Å; T298-V696 HydrophobicContact CG2-CG2 3.86Å
299	P	73.8	Confident	70.1	Confident	28 Å²	28	55.9 Å²	55.9	18%	0.182	27%	0.273	C	S	.	.			trans	-51.8	135.7	174.5	-26.2	33.6	0	0	0	112.4	F297 F301 N303 P692 V696	F297-P299 WeakPolarHBondContact O-CD 3.27Å; P299-F301 VanDerWaalsContact C-N 3.32Å; P299-N303 PolarHBondContact O-ND2 3.36Å; P299-P692 HydrophobicContact CG-CB 3.65Å; P299-V696 HydrophobicContact CG-CG2 4.22Å
300	R	66	Low	70.1	Confident	176 Å²	176	53.9 Å²	53.9	66%	0.664	27%	0.268	S	S	*	.	S	Bend	trans	-71.3	-29.2	177.6	-172.7	175.4	-179.5	-177.1	-1	112.6	T298	T298-R300 PolarHBondContact O-N 3.38Å
301	F	65.6	Low	70.2	Confident	68 Å²	68	52.9 Å²	52.9	30%	0.298	28%	0.275	S	S	.	.	S	Bend	trans	-115.8	155	-176.5	-55.1	-71.8	0	0	0	110.8	P299 L318 T321	P299-F301 VanDerWaalsContact C-N 3.32Å; F301-L318 HydrophobicContact CD1-CD1 4.32Å; F301-L318 HydrophobicContact CD1-CD2 3.78Å; F301-L318 HydrophobicContact CE1-CD2 3.73Å; F301-L318 HydrophobicContact CG-CD2 4.44Å; F301-L318 HydrophobicContact CZ-CD2 4.36Å; F301-T321 HydrophobicContact CD2-CG2 4.26Å; F301-T321 HydrophobicContact CE2-CG2 4.16Å
302	F	68.2	Low	70.3	Confident	7 Å²	7	48.6 Å²	48.6	3%	0.031	25%	0.247	C	C	.	.	S	Bend	trans	51.5	58.1	-178.3	-53.8	-63.1	0	0	0	112.2	L318 V349 I352 Q356	F302-L318 HydrophobicContact CE1-CB 4.5Å; F302-L318 HydrophobicContact CE2-CB 4.16Å; F302-L318 HydrophobicContact CZ-CB 3.71Å; F302-V349 HydrophobicContact CD1-CB 4.49Å; F302-V349 HydrophobicContact CD1-CG1 3.35Å; F302-V349 HydrophobicContact CD1-CG2 4.43Å; F302-V349 HydrophobicContact CE1-CB 4.2Å; F302-V349 HydrophobicContact CE1-CG1 3.28Å; F302-V349 HydrophobicContact CE1-CG2 3.79Å; F302-V349 HydrophobicContact CE2-CG2 4.19Å; F302-V349 HydrophobicContact CG-CG1 4.15Å; F302-V349 HydrophobicContact CZ-CG1 4.03Å; F302-V349 HydrophobicContact CZ-CG2 3.64Å; F302-I352 HydrophobicContact CB-CG2 4.33Å; F302-Q356 PolarHBondContact O-NE2 3.32Å; F302-Q356 PolarHBondContact O-OE1 3.14Å
303	N	77.8	Confident	70.5	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.243	C	C	.	.			trans	-124.6	115.2	-172.5	-177.4	-23.8	0	0	0	109.4	W289 T298 P299 C305 K306 V696	W289-N303 WeakPolarHBondContact CH2-ND2 3.42Å; T298-N303 WeakPolarHBondContact CG2-ND2 3.37Å; P299-N303 PolarHBondContact O-ND2 3.36Å; N303-C305 PolarHBondContact O-N 2.78Å; N303-C305 WeakPolarHBondContact OD1-CB 3.38Å; N303-C305 PolarHBondContact OD1-N 3.48Å; N303-C305 PolarHBondContact OD1-SG 3.43Å; N303-C305 VanDerWaalsContact OD1-SG 3.37Å; N303-K306 WeakPolarHBondContact O-CB 3.38Å; N303-K306 PolarHBondContact O-N 2.79Å; N303-V696 HydrophobicContact CB-CG2 4.35Å; N303-V696 WeakPolarHBondContact OD1-CG1 3.48Å
304	I	83.1	Confident	70.6	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.031	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-12.7	178.4	55.8	161.7	0	0	0	114.3	F309 I353 Q356 I357 V360 V696 F700	I304-F309 HydrophobicContact CB-CE1 4.26Å; I304-F309 HydrophobicContact CB-CZ 4.42Å; I304-F309 HydrophobicContact CG2-CE1 4.28Å; I304-F309 HydrophobicContact CG2-CE2 4.23Å; I304-F309 HydrophobicContact CG2-CZ 3.94Å; I304-I353 HydrophobicContact CG2-CG2 3.99Å; I304-Q356 HydrophobicContact CD1-CB 4.22Å; I304-Q356 HydrophobicContact CG1-CB 4.25Å; I304-Q356 HydrophobicContact CG2-CB 4.28Å; I304-I357 HydrophobicContact CG2-CG1 4.26Å; I304-V360 HydrophobicContact CD1-CG2 3.59Å; I304-V696 HydrophobicContact CB-CG1 4.49Å; I304-V696 HydrophobicContact CD1-CG1 4.18Å; I304-V696 HydrophobicContact CG1-CG1 3.34Å; I304-F700 HydrophobicContact CD1-CB 4.05Å; I304-F700 HydrophobicContact CD1-CD2 4.06Å; I304-F700 HydrophobicContact CD1-CG 3.99Å; I304-F700 HydrophobicContact CG1-CB 4.47Å; I304-F700 HydrophobicContact CG1-CD2 4.26Å
305	C	76.5	Confident	70.6	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.027	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-22.6	172.7	-59.7	0	0	0	0	113.4	W289 N303 P307 V696 F700	W289-C305 HydrophobicContact CE3-CB 4.25Å; W289-C305 HydrophobicContact CH2-CB 3.41Å; W289-C305 VanDerWaalsContact CH2-CB 3.41Å; W289-C305 HydrophobicContact CZ2-CB 4.45Å; W289-C305 HydrophobicContact CZ3-CB 3.27Å; N303-C305 PolarHBondContact O-N 2.78Å; N303-C305 WeakPolarHBondContact OD1-CB 3.38Å; N303-C305 PolarHBondContact OD1-N 3.48Å; N303-C305 PolarHBondContact OD1-SG 3.43Å; N303-C305 VanDerWaalsContact OD1-SG 3.37Å; C305-P307 WeakPolarHBondContact O-CD 3.33Å; C305-V696 PolarHBondContact SG-O 3.26Å; C305-F700 WeakPolarHBondContact SG-CA 3.3Å; C305-F700 PolarHBondContact SG-N 2.93Å
306	K	77.4	Confident	70	Confident	36 Å²	36	47.4 Å²	47.4	16%	0.157	25%	0.25	C	S	.	.	S	Bend	trans	-73	122.7	179.8	-176.8	178.7	175.1	174.9	0	109	W289 N303 D308 F309 E312	W289-K306 HydrophobicContact CZ2-CB 4.15Å; N303-K306 WeakPolarHBondContact O-CB 3.38Å; N303-K306 PolarHBondContact O-N 2.79Å; K306-D308 PolarHBondContact O-N 3.43Å; K306-F309 HydrophobicContact CB-CB 4.37Å; K306-F309 WeakPolarHBondContact O-CB 3.26Å; K306-F309 WeakPolarHBondContact O-CD1 3.48Å; K306-F309 PolarHBondContact O-N 3.49Å; K306-E312 IonicContact NZ-OE1 3.61Å; K306-E312 PolarHBondContact NZ-OE1 2.68Å; K306-E312 IonicContact NZ-OE2 2.7Å
307	P	72.5	Confident	69.6	Low	6 Å²	6	53 Å²	53	4%	0.039	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	139.8	172.9	-20.7	31.7	0	0	0	110.9	Q285 Y286 C305 F309	Q285-P307 HydrophobicContact CB-CG 4.34Å; Y286-P307 HydrophobicContact CD2-CB 4.5Å; C305-P307 WeakPolarHBondContact O-CD 3.33Å; P307-F309 PolarHBondContact O-N 2.85Å
308	D	71.7	Confident	68.9	Low	69 Å²	69	51.2 Å²	51.2	37%	0.369	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	26.8	177.9	-47.7	-47.3	0	0	0	114.3	R282 K306 G310 T311 D644	R282-D308 IonicContact NH1-OD1 3.46Å; R282-D308 PolarHBondContact NH1-OD1 2.88Å; K306-D308 PolarHBondContact O-N 3.43Å; D308-G310 PolarHBondContact O-N 3.36Å; D308-T311 HydrophobicContact CB-CG2 4.34Å; D308-T311 WeakPolarHBondContact O-CB 3.22Å; D308-T311 PolarHBondContact O-N 2.89Å; D308-T311 PolarHBondContact O-OG1 2.79Å; D308-D644 PolarHBondContact N-OD1 2.92Å
309	F	74.3	Confident	67.7	Low	4 Å²	4	50.6 Å²	50.6	2%	0.018	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-56.8	-23.3	177.8	71.8	-94.6	0	0	0	113.4	I304 K306 P307 T311 E312 I353 D644 L645	I304-F309 HydrophobicContact CB-CE1 4.26Å; I304-F309 HydrophobicContact CB-CZ 4.42Å; I304-F309 HydrophobicContact CG2-CE1 4.28Å; I304-F309 HydrophobicContact CG2-CE2 4.23Å; I304-F309 HydrophobicContact CG2-CZ 3.94Å; K306-F309 HydrophobicContact CB-CB 4.37Å; K306-F309 WeakPolarHBondContact O-CB 3.26Å; K306-F309 WeakPolarHBondContact O-CD1 3.48Å; K306-F309 PolarHBondContact O-N 3.49Å; P307-F309 PolarHBondContact O-N 2.85Å; F309-T311 PolarHBondContact O-N 3.28Å; F309-E312 WeakPolarHBondContact O-CB 3.41Å; F309-E312 PolarHBondContact O-N 3.43Å; F309-I353 HydrophobicContact CD2-CD1 3.82Å; F309-I353 HydrophobicContact CE2-CD1 3.84Å; F309-I353 HydrophobicContact CE2-CG2 4.04Å; F309-D644 HydrophobicContact CD1-CB 3.63Å; F309-D644 HydrophobicContact CE1-CB 3.23Å; F309-D644 HydrophobicContact CG-CB 4.48Å; F309-D644 HydrophobicContact CZ-CB 3.8Å; F309-L645 HydrophobicContact CE2-CD2 3.54Å; F309-L645 HydrophobicContact CE2-CG 4.27Å; F309-L645 HydrophobicContact CZ-CD2 3.52Å; F309-L645 HydrophobicContact CZ-CG 3.75Å
310	G	70	Confident	66.6	Low	9 Å²	9	54 Å²	54	9%	0.093	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-57.4	-28.7	173.4	0	0	0	0	0	113.3	D308 E312 L313 D644	D308-G310 PolarHBondContact O-N 3.36Å; G310-E312 PolarHBondContact O-N 3.39Å; G310-L313 WeakPolarHBondContact O-CB 3.5Å; G310-L313 PolarHBondContact O-N 3.08Å; G310-D644 VanDerWaalsContact CA-O 3.29Å; G310-D644 WeakPolarHBondContact CA-O 3.48Å
311	T	70.4	Confident	65.9	Low	106 Å²	106	48.5 Å²	48.5	65%	0.65	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-67.8	-24.8	175.6	62.3	0	0	0	0	112.9	D308 F309	D308-T311 HydrophobicContact CB-CG2 4.34Å; D308-T311 WeakPolarHBondContact O-CB 3.22Å; D308-T311 PolarHBondContact O-N 2.89Å; D308-T311 PolarHBondContact O-OG1 2.79Å; F309-T311 PolarHBondContact O-N 3.28Å
312	E	67.8	Low	65.2	Low	24 Å²	24	47.9 Å²	47.9	11%	0.112	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-81.8	-16.2	178.7	-56.8	-166.2	140.1	0	0	113.1	K306 F309 G310 H314 S315 L318	K306-E312 IonicContact NZ-OE1 3.61Å; K306-E312 PolarHBondContact NZ-OE1 2.68Å; K306-E312 IonicContact NZ-OE2 2.7Å; F309-E312 WeakPolarHBondContact O-CB 3.41Å; F309-E312 PolarHBondContact O-N 3.43Å; G310-E312 PolarHBondContact O-N 3.39Å; E312-H314 PolarHBondContact O-N 2.99Å; E312-H314 VanDerWaalsContact O-N 3.15Å; E312-S315 PolarHBondContact O-N 2.81Å; E312-L318 HydrophobicContact CB-CD1 4.39Å
313	L	66.9	Low	64.5	Low	32 Å²	32	51.3 Å²	51.3	17%	0.168	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-59	-26	177.7	-75.6	171.8	0	0	0	113.1	G310 V349 I353 L648	G310-L313 WeakPolarHBondContact O-CB 3.5Å; G310-L313 PolarHBondContact O-N 3.08Å; L313-V349 HydrophobicContact CD2-CG1 3.73Å; L313-I353 HydrophobicContact CD1-CD1 4.48Å; L313-I353 HydrophobicContact CD2-CD1 3.38Å; L313-I353 HydrophobicContact CD2-CG1 4.5Å; L313-I353 HydrophobicContact CG-CD1 4.09Å; L313-L648 HydrophobicContact CD1-CD1 3.45Å; L313-L648 VanDerWaalsContact CD1-CD1 3.45Å; L313-L648 HydrophobicContact CD1-CD2 4.42Å; L313-L648 HydrophobicContact CD1-CG 3.8Å; L313-L648 HydrophobicContact CD2-CD1 4.26Å; L313-L648 HydrophobicContact CG-CD1 4.5Å
314	H	62.7	Low	63.3	Low	129 Å²	129	55.5 Å²	55.5	60%	0.597	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-99.9	0.5	-179.2	-55.9	-68.8	0	0	0	112.9	E312 S316 D647	E312-H314 PolarHBondContact O-N 2.99Å; E312-H314 VanDerWaalsContact O-N 3.15Å; H314-S316 PolarHBondContact O-N 3.21Å; H314-D647 IonicContact CD2-OD2 3.52Å; H314-D647 IonicContact CE1-OD2 3.89Å; H314-D647 IonicContact NE2-OD2 3.7Å; H314-D647 PolarHBondContact NE2-OD2 3.45Å
315	S	62.2	Low	61.6	Low	48 Å²	48	61.2 Å²	61.2	34%	0.336	34%	0.335	S	S	.	.			trans	-88	102.1	-178.9	-166.9	0	0	0	0	110.9	E312 Q317 L318	E312-S315 PolarHBondContact O-N 2.81Å; S315-Q317 PolarHBondContact O-N 2.89Å; S315-L318 PolarHBondContact O-N 3.25Å
316	S	55.2	Low	60.1	Low	105 Å²	105	64.8 Å²	64.8	73%	0.734	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-60.5	-22.4	178.3	52	0	0	0	0	114.1	H314 L318	H314-S316 PolarHBondContact O-N 3.21Å; S316-L318 VanDerWaalsContact C-N 3.31Å; S316-L318 PolarHBondContact O-N 2.97Å
317	Q	56.2	Low	58.6	Low	162 Å²	162	66.8 Å²	66.8	76%	0.757	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-73.6	-13.3	-175.6	-83.9	179.8	-14.4	0	0	115.2	S315	S315-Q317 PolarHBondContact O-N 2.89Å
318	L	54.9	Low	57.3	Low	30 Å²	30	75.3 Å²	75.3	16%	0.157	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-101.4	-14.6	-170.6	-67.2	174.4	0	0	0	114.3	F301 F302 E312 S315 S316 D320 T321	F301-L318 HydrophobicContact CD1-CD1 4.32Å; F301-L318 HydrophobicContact CD1-CD2 3.78Å; F301-L318 HydrophobicContact CE1-CD2 3.73Å; F301-L318 HydrophobicContact CG-CD2 4.44Å; F301-L318 HydrophobicContact CZ-CD2 4.36Å; F302-L318 HydrophobicContact CE1-CB 4.5Å; F302-L318 HydrophobicContact CE2-CB 4.16Å; F302-L318 HydrophobicContact CZ-CB 3.71Å; E312-L318 HydrophobicContact CB-CD1 4.39Å; S315-L318 PolarHBondContact O-N 3.25Å; S316-L318 VanDerWaalsContact C-N 3.31Å; S316-L318 PolarHBondContact O-N 2.97Å; L318-D320 PolarHBondContact O-N 2.75Å; L318-T321 PolarHBondContact O-N 2.87Å
319	C	49.2	Very low	55.9	Low	13 Å²	13	81 Å²	81	9%	0.088	44%	0.436	C	S	.	.	H	α-helix	trans	-67.5	-34.9	-177.1	-151.3	0	0	0	0	112.5	T321 Y322 K323	C319-T321 VanDerWaalsContact C-N 3.3Å; C319-T321 PolarHBondContact O-N 3.42Å; C319-Y322 PolarHBondContact O-N 2.97Å; C319-K323 PolarHBondContact O-N 2.95Å
320	D	50.8	Low	54.5	Low	98 Å²	98	89.3 Å²	89.3	52%	0.524	48%	0.475	S	S	.	.	H	α-helix	trans	-64.1	-32	-178.9	-64	-26.2	0	0	0	113.6	L318 Y322 S324	L318-D320 PolarHBondContact O-N 2.75Å; D320-Y322 VanDerWaalsContact C-N 3.31Å; D320-Y322 PolarHBondContact O-N 2.87Å; D320-S324 PolarHBondContact O-N 3.49Å; D320-S324 VanDerWaalsContact O-N 3.15Å; D320-S324 PolarHBondContact O-OG 3.3Å
321	T	51.5	Low	53.3	Low	61 Å²	61	94.3 Å²	94.3	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-68.5	-33.8	-178.3	-56.6	0	0	0	0	111	F301 L318 C319 I325	F301-T321 HydrophobicContact CD2-CG2 4.26Å; F301-T321 HydrophobicContact CE2-CG2 4.16Å; L318-T321 PolarHBondContact O-N 2.87Å; C319-T321 VanDerWaalsContact C-N 3.3Å; C319-T321 PolarHBondContact O-N 3.42Å; T321-I325 HydrophobicContact CG2-CD1 4.48Å; T321-I325 WeakPolarHBondContact O-CD1 3.48Å; T321-I325 WeakPolarHBondContact O-CG1 3.48Å
322	Y	50.8	Low	52	Low	55 Å²	55	99 Å²	99	22%	0.216	51%	0.514	C	S	.	.	H	α-helix	trans	-83.8	-35.6	-179.5	-166.2	-98	0	0	0	112.7	C319 D320 S324 I325 T326 I352	C319-Y322 PolarHBondContact O-N 2.97Å; D320-Y322 VanDerWaalsContact C-N 3.31Å; D320-Y322 PolarHBondContact O-N 2.87Å; Y322-S324 PolarHBondContact O-N 3.08Å; Y322-I325 PolarHBondContact O-N 2.95Å; Y322-T326 HydrophobicContact CD1-CG2 3.84Å; Y322-T326 HydrophobicContact CE1-CG2 3.33Å; Y322-T326 HydrophobicContact CE2-CG2 4.3Å; Y322-T326 PolarHBondContact O-N 2.95Å; Y322-T326 PolarHBondContact O-OG1 3.02Å; Y322-I352 HydrophobicContact CD1-CD1 3.53Å; Y322-I352 HydrophobicContact CE1-CD1 3.44Å; Y322-I352 VanDerWaalsContact CE1-CD1 3.44Å; Y322-I352 HydrophobicContact CE1-CG1 4.1Å; Y322-I352 HydrophobicContact CG-CD1 4.16Å
323	K	52.2	Low	50.8	Low	80 Å²	80	101.5 Å²	101.5	35%	0.348	55%	0.547	S	S	.	.	H	α-helix	trans	-54.5	-45.2	169.4	-77.1	-179.5	175.8	176.4	0	110.2	C319 I325 T326 S327 D345	C319-K323 PolarHBondContact O-N 2.95Å; K323-I325 PolarHBondContact O-N 3.4Å; K323-T326 PolarHBondContact O-N 3.42Å; K323-T326 VanDerWaalsContact O-N 3.13Å; K323-T326 PolarHBondContact O-OG1 2.85Å; K323-S327 WeakPolarHBondContact O-CB 3.18Å; K323-S327 PolarHBondContact O-N 3.05Å; K323-S327 PolarHBondContact O-OG 2.89Å; K323-D345 IonicContact NZ-OD1 2.64Å; K323-D345 PolarHBondContact NZ-OD1 3.38Å; K323-D345 IonicContact NZ-OD2 3.74Å; K323-D345 PolarHBondContact NZ-OD2 3.46Å
324	S	52.4	Low	49.6	Very low	89 Å²	89	107.6 Å²	107.6	62%	0.622	58%	0.58	S	S	*	*	H	α-helix	trans	-60.7	-28.1	177	-56.6	0	0	0	0	114.4	D320 Y322	D320-S324 PolarHBondContact O-N 3.49Å; D320-S324 VanDerWaalsContact O-N 3.15Å; D320-S324 PolarHBondContact O-OG 3.3Å; Y322-S324 PolarHBondContact O-N 3.08Å
325	I	48.8	Very low	49.1	Very low	125 Å²	125	110.6 Å²	110.6	64%	0.641	59%	0.591	S	S	*	*	H	α-helix	trans	-86.6	-25.5	179.3	-64.1	165	0	0	0	111.7	T321 Y322 K323	T321-I325 HydrophobicContact CG2-CD1 4.48Å; T321-I325 WeakPolarHBondContact O-CD1 3.48Å; T321-I325 WeakPolarHBondContact O-CG1 3.48Å; Y322-I325 PolarHBondContact O-N 2.95Å; K323-I325 PolarHBondContact O-N 3.4Å
326	T	45.3	Very low	48.5	Very low	79 Å²	79	117.3 Å²	117.3	49%	0.485	61%	0.614	S	S	.	*	H	α-helix	trans	-105	-23.2	-173.8	53.1	0	0	0	0	114.3	Y322 K323 K328	Y322-T326 HydrophobicContact CD1-CG2 3.84Å; Y322-T326 HydrophobicContact CE1-CG2 3.33Å; Y322-T326 HydrophobicContact CE2-CG2 4.3Å; Y322-T326 PolarHBondContact O-N 2.95Å; Y322-T326 PolarHBondContact O-OG1 3.02Å; K323-T326 PolarHBondContact O-N 3.42Å; K323-T326 VanDerWaalsContact O-N 3.13Å; K323-T326 PolarHBondContact O-OG1 2.85Å; T326-K328 PolarHBondContact O-N 3.41Å
327	S	44.9	Very low	48.1	Very low	78 Å²	78	121.4 Å²	121.4	55%	0.545	62%	0.622	S	S	.	*	S	Bend	trans	-73.7	109.6	168.8	61.4	0	0	0	0	109	K323 E329	K323-S327 WeakPolarHBondContact O-CB 3.18Å; K323-S327 PolarHBondContact O-N 3.05Å; K323-S327 PolarHBondContact O-OG 2.89Å; S327-E329 PolarHBondContact O-N 3.24Å
328	K	45.7	Very low	48	Very low	186 Å²	186	121 Å²	121	81%	0.809	62%	0.617	S	S	*	*			trans	-49.2	126.6	166.2	-81.8	175.5	172.2	175.9	0	109.1	T326 E330	T326-K328 PolarHBondContact O-N 3.41Å; K328-E330 PolarHBondContact O-N 3.44Å
329	E	42.6	Very low	47.7	Very low	188 Å²	188	127.1 Å²	127.1	88%	0.879	65%	0.65	S	S	*	*			trans	-56.8	88.2	163.5	-74.3	-178.4	142.6	0	0	109.5	S327 V331	S327-E329 PolarHBondContact O-N 3.24Å; E329-V331 PolarHBondContact O-N 3.5Å
330	E	44.1	Very low	47.9	Very low	179 Å²	179	134.8 Å²	134.8	84%	0.836	68%	0.679	S	S	*	*			trans	-85.4	93	160.1	-78.8	-166.8	171.6	0	0	108.5	K328 K332	K328-E330 PolarHBondContact O-N 3.44Å; E330-K332 PolarHBondContact O-N 2.98Å
331	V	45.9	Very low	48	Very low	114 Å²	114	137.9 Å²	137.9	69%	0.691	70%	0.695	S	S	*	*			trans	-61.5	122.4	164.3	170.1	0	0	0	0	109.4	E329	E329-V331 PolarHBondContact O-N 3.5Å
332	K	42.4	Very low	48.3	Very low	203 Å²	203	141.8 Å²	141.8	88%	0.883	71%	0.714	S	S	*	*			trans	84.7	109.6	160.5	-69.9	169.4	-178.3	-178.9	0	118.8	E330	E330-K332 PolarHBondContact O-N 2.98Å
333	G	41.9	Very low	48.6	Very low	77 Å²	77	146.8 Å²	146.8	79%	0.794	74%	0.744	S	S	*	*			trans	171.7	88.8	151.1	0	0	0	0	0	113.5	K335	G333-K335 PolarHBondContact O-N 3.15Å
334	D	42.9	Very low	48.8	Very low	160 Å²	160	148.9 Å²	148.9	86%	0.856	76%	0.759	S	S	*	*			trans	-47.2	120.9	165.5	-71.3	-44.8	0	0	0	111
335	K	50.5	Low	49	Very low	192 Å²	192	147.7 Å²	147.7	84%	0.835	75%	0.746	S	S	*	*			trans	173	123.8	138.3	-96	154.3	-172	171.7	0	113.7	G333	G333-K335 PolarHBondContact O-N 3.15Å
336	K	49.7	Very low	49.4	Very low	189 Å²	189	143.8 Å²	143.8	82%	0.822	74%	0.736	S	S	*	*			trans	74.6	86.3	147.9	-64.2	-172.9	176	-174.9	0	117.5	K338	K336-K338 PolarHBondContact O-N 3.4Å
337	E	47.7	Very low	50.3	Low	191 Å²	191	144.1 Å²	144.1	89%	0.893	74%	0.735	S	S	*	*			trans	-21	112.6	137.1	-150.5	167.9	-150.7	0	0	112.3
338	K	53	Low	51.7	Low	153 Å²	153	142.9 Å²	142.9	67%	0.665	73%	0.726	S	S	*	*			trans	-132	113.1	163.8	-106.6	-170.3	174.4	-173.4	0	105.5	K336 Y340	K336-K338 PolarHBondContact O-N 3.4Å; K338-Y340 HydrophobicContact CB-CD2 4.13Å; K338-Y340 HydrophobicContact CB-CE2 3.87Å; K338-Y340 HydrophobicContact CD-CE2 3.87Å; K338-Y340 HydrophobicContact CG-CE2 4.49Å; K338-Y340 PolarHBondContact O-N 3.38Å
339	D	49.8	Very low	53.2	Low	159 Å²	159	134.6 Å²	134.6	85%	0.85	69%	0.691	S	S	*	*			trans	-53.8	114.6	167	-65.1	-37.5	0	0	0	108.7
340	Y	53.6	Low	55	Low	175 Å²	175	129.9 Å²	129.9	69%	0.686	67%	0.666	S	S	*	*			trans	-123.3	129.5	162.8	-77.8	-75.1	0	0	0	106.8	K338	K338-Y340 HydrophobicContact CB-CD2 4.13Å; K338-Y340 HydrophobicContact CB-CE2 3.87Å; K338-Y340 HydrophobicContact CD-CE2 3.87Å; K338-Y340 HydrophobicContact CG-CE2 4.49Å; K338-Y340 PolarHBondContact O-N 3.38Å
341	D	52.4	Low	56.9	Low	163 Å²	163	124.7 Å²	124.7	87%	0.872	64%	0.644	S	S	*	*			trans	-55.6	133.2	-176.6	-61.3	-58.5	0	0	0	112.2	D343	D341-D343 PolarHBondContact O-N 2.96Å
342	D	57	Low	58.7	Low	143 Å²	143	120.1 Å²	120.1	77%	0.765	62%	0.615	S	S	*	*			trans	-96.8	45.1	-158.3	-132.2	-5.5	0	0	0	112.7
343	D	57.1	Low	60.8	Low	159 Å²	159	110.5 Å²	110.5	85%	0.85	57%	0.573	S	S	*	*			trans	-108.6	10.1	-167.5	-80.4	-32.8	0	0	0	116.2	D341	D341-D343 PolarHBondContact O-N 2.96Å
344	D	57.2	Low	63.1	Low	124 Å²	124	107.9 Å²	107.9	66%	0.663	54%	0.54	S	S	*	.			trans	-113.6	16.3	-170.2	-150.5	17	0	0	0	116
345	D	56.4	Low	65.2	Low	64 Å²	64	102 Å²	102	34%	0.342	51%	0.51	S	S	.	.	H	α-helix	trans	-79.3	-21.9	-172.9	-85.6	1.8	0	0	0	114.8	K323 D347	K323-D345 IonicContact NZ-OD1 2.64Å; K323-D345 PolarHBondContact NZ-OD1 3.38Å; K323-D345 IonicContact NZ-OD2 3.74Å; K323-D345 PolarHBondContact NZ-OD2 3.46Å; D345-D347 VanDerWaalsContact C-N 3.34Å; D345-D347 PolarHBondContact O-N 3.34Å
346	G	57	Low	67.1	Low	43 Å²	43	93 Å²	93	44%	0.443	47%	0.471	S	S	.	.	H	α-helix	trans	-69.1	-29.6	-179.8	0	0	0	0	0	114
347	D	64.6	Low	69.1	Low	86 Å²	86	84.1 Å²	84.1	46%	0.46	43%	0.432	S	S	.	.	H	α-helix	trans	-74.1	-32.1	-175	-87	7.7	0	0	0	111.9	D345 V349 R350 D351	D345-D347 VanDerWaalsContact C-N 3.34Å; D345-D347 PolarHBondContact O-N 3.34Å; D347-V349 PolarHBondContact O-N 3Å; D347-R350 PolarHBondContact O-N 2.72Å; D347-D351 WeakPolarHBondContact O-CB 3.38Å; D347-D351 PolarHBondContact O-N 3.3Å
348	S	73.3	Confident	71.2	Confident	52 Å²	52	75 Å²	75	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-62.6	-40.2	179	-177.6	0	0	0	0	112.7	I352	S348-I352 WeakPolarHBondContact O-CD1 3.31Å; S348-I352 VanDerWaalsContact O-CG1 3.22Å; S348-I352 WeakPolarHBondContact O-CG1 3.38Å; S348-I352 PolarHBondContact O-N 3.36Å; S348-I352 VanDerWaalsContact O-N 3.13Å
349	V	77	Confident	73	Confident	12 Å²	12	67.9 Å²	67.9	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-69.8	-44.2	-179.2	173.7	0	0	0	0	110.7	F302 L313 D347 D351 I352 I353	F302-V349 HydrophobicContact CD1-CB 4.49Å; F302-V349 HydrophobicContact CD1-CG1 3.35Å; F302-V349 HydrophobicContact CD1-CG2 4.43Å; F302-V349 HydrophobicContact CE1-CB 4.2Å; F302-V349 HydrophobicContact CE1-CG1 3.28Å; F302-V349 HydrophobicContact CE1-CG2 3.79Å; F302-V349 HydrophobicContact CE2-CG2 4.19Å; F302-V349 HydrophobicContact CG-CG1 4.15Å; F302-V349 HydrophobicContact CZ-CG1 4.03Å; F302-V349 HydrophobicContact CZ-CG2 3.64Å; L313-V349 HydrophobicContact CD2-CG1 3.73Å; D347-V349 PolarHBondContact O-N 3Å; V349-D351 VanDerWaalsContact C-N 3.31Å; V349-D351 PolarHBondContact O-N 2.92Å; V349-I352 WeakPolarHBondContact O-CB 3.48Å; V349-I352 PolarHBondContact O-N 2.68Å; V349-I353 PolarHBondContact O-N 3.22Å; V349-I353 VanDerWaalsContact O-N 3.11Å
350	R	81.9	Confident	75	Confident	90 Å²	90	60.3 Å²	60.3	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-40.7	178.5	-65	-177.7	-169.6	-175.9	12	111.1	D347 I352 I353 F354 L648 E651	D347-R350 PolarHBondContact O-N 2.72Å; R350-I352 VanDerWaalsContact C-N 3.33Å; R350-I352 PolarHBondContact O-N 3.22Å; R350-I353 PolarHBondContact O-N 2.95Å; R350-F354 VanDerWaalsContact O-CB 3.3Å; R350-F354 WeakPolarHBondContact O-CB 3.48Å; R350-F354 PolarHBondContact O-N 3.37Å; R350-L648 HydrophobicContact CG-CD2 4.03Å; R350-E651 IonicContact CZ-OE1 3.32Å; R350-E651 IonicContact NE-OE1 3.77Å; R350-E651 IonicContact NH1-OE1 2.75Å; R350-E651 PolarHBondContact NH1-OE1 3.46Å
351	D	83	Confident	76.8	Confident	69 Å²	69	52.4 Å²	52.4	37%	0.369	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-33.8	176	-80.4	-20.3	0	0	0	112.3	D347 V349 T355 K653	D347-D351 WeakPolarHBondContact O-CB 3.38Å; D347-D351 PolarHBondContact O-N 3.3Å; V349-D351 VanDerWaalsContact C-N 3.31Å; V349-D351 PolarHBondContact O-N 2.92Å; D351-T355 WeakPolarHBondContact O-CB 3.42Å; D351-T355 PolarHBondContact O-N 3.36Å; D351-T355 PolarHBondContact O-OG1 2.99Å; D351-K653 IonicContact OD1-NZ 3.83Å; D351-K653 PolarHBondContact OD1-NZ 2.88Å; D351-K653 VanDerWaalsContact OD1-NZ 3.12Å
352	I	84.6	Confident	78.7	Confident	19 Å²	19	45.1 Å²	45.1	10%	0.097	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-48.9	172.8	-69	160.8	0	0	0	110.8	F302 Y322 S348 V349 R350 F354 T355 Q356	F302-I352 HydrophobicContact CB-CG2 4.33Å; Y322-I352 HydrophobicContact CD1-CD1 3.53Å; Y322-I352 HydrophobicContact CE1-CD1 3.44Å; Y322-I352 VanDerWaalsContact CE1-CD1 3.44Å; Y322-I352 HydrophobicContact CE1-CG1 4.1Å; Y322-I352 HydrophobicContact CG-CD1 4.16Å; S348-I352 WeakPolarHBondContact O-CD1 3.31Å; S348-I352 VanDerWaalsContact O-CG1 3.22Å; S348-I352 WeakPolarHBondContact O-CG1 3.38Å; S348-I352 PolarHBondContact O-N 3.36Å; S348-I352 VanDerWaalsContact O-N 3.13Å; V349-I352 WeakPolarHBondContact O-CB 3.48Å; V349-I352 PolarHBondContact O-N 2.68Å; R350-I352 VanDerWaalsContact C-N 3.33Å; R350-I352 PolarHBondContact O-N 3.22Å; I352-F354 VanDerWaalsContact C-N 3.34Å; I352-F354 PolarHBondContact O-N 3.48Å; I352-T355 WeakPolarHBondContact O-CB 3.18Å; I352-T355 PolarHBondContact O-N 3.36Å; I352-Q356 WeakPolarHBondContact O-CG 3.46Å; I352-Q356 PolarHBondContact O-N 3.35Å
353	I	86.9	Confident	80.4	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-43.2	178.9	-62.7	-170.4	0	0	0	110.5	I304 F309 L313 V349 R350 T355 Q356 I357 L645 F654	I304-I353 HydrophobicContact CG2-CG2 3.99Å; F309-I353 HydrophobicContact CD2-CD1 3.82Å; F309-I353 HydrophobicContact CE2-CD1 3.84Å; F309-I353 HydrophobicContact CE2-CG2 4.04Å; L313-I353 HydrophobicContact CD1-CD1 4.48Å; L313-I353 HydrophobicContact CD2-CD1 3.38Å; L313-I353 HydrophobicContact CD2-CG1 4.5Å; L313-I353 HydrophobicContact CG-CD1 4.09Å; V349-I353 PolarHBondContact O-N 3.22Å; V349-I353 VanDerWaalsContact O-N 3.11Å; R350-I353 PolarHBondContact O-N 2.95Å; I353-T355 VanDerWaalsContact C-N 3.28Å; I353-T355 PolarHBondContact O-N 3.45Å; I353-Q356 WeakPolarHBondContact O-CB 3.34Å; I353-Q356 PolarHBondContact O-N 2.58Å; I353-Q356 VanDerWaalsContact O-N 3.14Å; I353-I357 HydrophobicContact CG2-CD1 3.99Å; I353-I357 HydrophobicContact CG2-CG1 4.39Å; I353-I357 WeakPolarHBondContact O-CG1 3.44Å; I353-I357 PolarHBondContact O-N 3.41Å; I353-L645 HydrophobicContact CG2-CD2 4.06Å; I353-F654 HydrophobicContact CG2-CE1 4.12Å; I353-F654 HydrophobicContact CG2-CZ 4.47Å
354	F	88.5	Confident	82	Confident	22 Å²	22	30.7 Å²	30.7	10%	0.096	17%	0.172	C	C	.	.	H	α-helix	trans	-55.8	-45.8	174.7	178.2	-104	0	0	0	111.3	R350 I352 Q356 I357 C358 L388 K653 F654 V657	R350-F354 VanDerWaalsContact O-CB 3.3Å; R350-F354 WeakPolarHBondContact O-CB 3.48Å; R350-F354 PolarHBondContact O-N 3.37Å; I352-F354 VanDerWaalsContact C-N 3.34Å; I352-F354 PolarHBondContact O-N 3.48Å; F354-Q356 VanDerWaalsContact C-N 3.34Å; F354-Q356 PolarHBondContact O-N 2.91Å; F354-I357 PolarHBondContact O-N 3.26Å; F354-C358 WeakPolarHBondContact O-CB 3.4Å; F354-C358 PolarHBondContact O-N 2.9Å; F354-C358 PolarHBondContact O-SG 2.98Å; F354-L388 HydrophobicContact CE1-CD1 4.33Å; F354-L388 HydrophobicContact CE2-CD1 4.1Å; F354-L388 HydrophobicContact CZ-CD1 3.46Å; F354-L388 VanDerWaalsContact CZ-CD1 3.46Å; F354-K653 HydrophobicContact CD2-CB 4.02Å; F354-K653 HydrophobicContact CE2-CB 3.64Å; F354-K653 HydrophobicContact CZ-CB 4.15Å; F354-F654 HydrophobicContact CB-CE1 4.21Å; F354-F654 HydrophobicContact CB-CE2 4.21Å; F354-F654 HydrophobicContact CB-CZ 3.73Å; F354-F654 HydrophobicContact CD2-CD2 4.45Å; F354-F654 HydrophobicContact CD2-CE1 4.43Å; F354-F654 HydrophobicContact CD2-CE2 4.36Å; F354-F654 HydrophobicContact CD2-CZ 4.35Å; F354-V657 HydrophobicContact CD2-CG2 4.46Å; F354-V657 HydrophobicContact CE2-CG2 3.57Å; F354-V657 HydrophobicContact CZ-CG2 4.1Å
355	T	88.3	Confident	83.6	Confident	36 Å²	36	26.6 Å²	26.6	22%	0.221	15%	0.149	C	C	.	.	H	α-helix	trans	-60.5	-41.9	176.9	-56.8	0	0	0	0	111.6	D351 I352 I353 C358 C359 W386 A693	D351-T355 WeakPolarHBondContact O-CB 3.42Å; D351-T355 PolarHBondContact O-N 3.36Å; D351-T355 PolarHBondContact O-OG1 2.99Å; I352-T355 WeakPolarHBondContact O-CB 3.18Å; I352-T355 PolarHBondContact O-N 3.36Å; I353-T355 VanDerWaalsContact C-N 3.28Å; I353-T355 PolarHBondContact O-N 3.45Å; T355-C358 PolarHBondContact O-N 3.07Å; T355-C359 PolarHBondContact O-N 3.05Å; T355-C359 PolarHBondContact O-SG 3.28Å; T355-C359 VanDerWaalsContact O-SG 3.32Å; T355-W386 HydrophobicContact CG2-CZ2 4.38Å; T355-A693 HydrophobicContact CG2-CB 3.6Å
356	Q	90.7	Very high	85.1	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.009	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-45.5	176.6	-70.9	172.7	10.4	0	0	112.3	F302 I304 I352 I353 F354 C358 C359 V360 A693 V696	F302-Q356 PolarHBondContact O-NE2 3.32Å; F302-Q356 PolarHBondContact O-OE1 3.14Å; I304-Q356 HydrophobicContact CD1-CB 4.22Å; I304-Q356 HydrophobicContact CG1-CB 4.25Å; I304-Q356 HydrophobicContact CG2-CB 4.28Å; I352-Q356 WeakPolarHBondContact O-CG 3.46Å; I352-Q356 PolarHBondContact O-N 3.35Å; I353-Q356 WeakPolarHBondContact O-CB 3.34Å; I353-Q356 PolarHBondContact O-N 2.58Å; I353-Q356 VanDerWaalsContact O-N 3.14Å; F354-Q356 VanDerWaalsContact C-N 3.34Å; F354-Q356 PolarHBondContact O-N 2.91Å; Q356-C358 VanDerWaalsContact C-N 3.32Å; Q356-C358 PolarHBondContact O-N 3.39Å; Q356-C359 WeakPolarHBondContact O-CB 3.38Å; Q356-C359 PolarHBondContact O-N 3.41Å; Q356-V360 PolarHBondContact O-N 3.05Å; Q356-A693 HydrophobicContact CG-CB 4.07Å; Q356-V696 HydrophobicContact CB-CG1 4.41Å; Q356-V696 HydrophobicContact CG-CB 4.15Å; Q356-V696 HydrophobicContact CG-CG1 4.09Å
357	I	90.8	Very high	86.7	Confident	3 Å²	3	21.5 Å²	21.5	2%	0.015	11%	0.111	C	C	.	.	H	α-helix	trans	-66.6	-37.3	178.5	-59.2	171.6	0	0	0	110.6	I304 I353 F354 C359 V360 L361 L645 F654 V657 L661	I304-I357 HydrophobicContact CG2-CG1 4.26Å; I353-I357 HydrophobicContact CG2-CD1 3.99Å; I353-I357 HydrophobicContact CG2-CG1 4.39Å; I353-I357 WeakPolarHBondContact O-CG1 3.44Å; I353-I357 PolarHBondContact O-N 3.41Å; F354-I357 PolarHBondContact O-N 3.26Å; I357-C359 VanDerWaalsContact C-N 3.33Å; I357-C359 PolarHBondContact O-N 2.91Å; I357-V360 WeakPolarHBondContact O-CB 3.48Å; I357-V360 PolarHBondContact O-N 2.87Å; I357-V360 VanDerWaalsContact O-N 3.16Å; I357-L361 PolarHBondContact O-N 2.98Å; I357-L645 HydrophobicContact CD1-CD1 3.44Å; I357-L645 VanDerWaalsContact CD1-CD1 3.44Å; I357-L645 HydrophobicContact CD1-CD2 4.25Å; I357-L645 HydrophobicContact CD1-CG 4.49Å; I357-F654 HydrophobicContact CD1-CD1 3.81Å; I357-F654 HydrophobicContact CD1-CE1 3.63Å; I357-V657 HydrophobicContact CB-CG1 4.35Å; I357-V657 HydrophobicContact CG2-CG1 3.44Å; I357-V657 VanDerWaalsContact CG2-CG1 3.44Å; I357-L661 HydrophobicContact CG2-CD1 3.55Å
358	C	91	Very high	87.7	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.007	9%	0.09	C	C	.	.	H	α-helix	trans	-60.9	-41.5	173.5	-69.1	0	0	0	0	111.9	F354 T355 Q356 V360 L361 W362	F354-C358 WeakPolarHBondContact O-CB 3.4Å; F354-C358 PolarHBondContact O-N 2.9Å; F354-C358 PolarHBondContact O-SG 2.98Å; T355-C358 PolarHBondContact O-N 3.07Å; Q356-C358 VanDerWaalsContact C-N 3.32Å; Q356-C358 PolarHBondContact O-N 3.39Å; C358-V360 VanDerWaalsContact C-N 3.34Å; C358-V360 PolarHBondContact O-N 3.18Å; C358-L361 PolarHBondContact O-N 2.95Å; C358-W362 WeakPolarHBondContact O-CB 3.38Å; C358-W362 PolarHBondContact O-N 3.36Å
359	C	91.4	Very high	88.3	Confident	2 Å²	2	16 Å²	16	1%	0.014	8%	0.077	C	C	.	.	H	α-helix	trans	-61.8	-40.5	173.3	-70.7	0	0	0	0	111.8	T355 Q356 I357 W362 I363 A697	T355-C359 PolarHBondContact O-N 3.05Å; T355-C359 PolarHBondContact O-SG 3.28Å; T355-C359 VanDerWaalsContact O-SG 3.32Å; Q356-C359 WeakPolarHBondContact O-CB 3.38Å; Q356-C359 PolarHBondContact O-N 3.41Å; I357-C359 VanDerWaalsContact C-N 3.33Å; I357-C359 PolarHBondContact O-N 2.91Å; C359-W362 PolarHBondContact O-N 2.87Å; C359-I363 WeakPolarHBondContact O-CG1 3.15Å; C359-I363 PolarHBondContact O-N 3.29Å; C359-A697 HydrophobicContact CB-CB 3.46Å; C359-A697 VanDerWaalsContact CB-CB 3.46Å
360	V	92.2	Very high	88.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.4	-47.9	174.9	175.5	0	0	0	0	110.9	I304 Q356 I357 C358 W362 I363 M364 L661 A697 F700 I701	I304-V360 HydrophobicContact CD1-CG2 3.59Å; Q356-V360 PolarHBondContact O-N 3.05Å; I357-V360 WeakPolarHBondContact O-CB 3.48Å; I357-V360 PolarHBondContact O-N 2.87Å; I357-V360 VanDerWaalsContact O-N 3.16Å; C358-V360 VanDerWaalsContact C-N 3.34Å; C358-V360 PolarHBondContact O-N 3.18Å; V360-W362 VanDerWaalsContact C-N 3.32Å; V360-W362 PolarHBondContact O-N 3.47Å; V360-I363 PolarHBondContact O-N 3.32Å; V360-M364 HydrophobicContact CG1-CG 4.36Å; V360-M364 VanDerWaalsContact O-CG 3.27Å; V360-M364 WeakPolarHBondContact O-CG 3.48Å; V360-M364 PolarHBondContact O-N 3.27Å; V360-L661 HydrophobicContact CG1-CD2 3.92Å; V360-A697 HydrophobicContact CB-CB 4.49Å; V360-A697 HydrophobicContact CG2-CB 3.6Å; V360-F700 HydrophobicContact CG1-CD1 4.24Å; V360-F700 HydrophobicContact CG2-CB 4.42Å; V360-F700 HydrophobicContact CG2-CD1 4.15Å; V360-F700 HydrophobicContact CG2-CG 4.45Å; V360-I701 HydrophobicContact CG1-CD1 4.23Å; V360-I701 HydrophobicContact CG1-CG1 4.14Å
361	L	92	Very high	88.1	Confident	10 Å²	10	16.1 Å²	16.1	5%	0.052	9%	0.087	C	C	.	.	H	α-helix	trans	-56.5	-47.6	177.7	178.8	63.7	0	0	0	111.2	I357 C358 M364 E365 L388 V657 K660 L661 Y664	I357-L361 PolarHBondContact O-N 2.98Å; C358-L361 PolarHBondContact O-N 2.95Å; L361-M364 PolarHBondContact O-N 3.46Å; L361-E365 WeakPolarHBondContact O-CB 3.49Å; L361-E365 PolarHBondContact O-N 3.33Å; L361-L388 HydrophobicContact CD2-CD2 4.25Å; L361-V657 HydrophobicContact CD2-CG1 4.18Å; L361-K660 HydrophobicContact CD1-CB 3.72Å; L361-K660 HydrophobicContact CD2-CB 3.97Å; L361-K660 HydrophobicContact CD2-CD 3.94Å; L361-L661 HydrophobicContact CB-CD1 3.83Å; L361-L661 HydrophobicContact CB-CG 4.38Å; L361-L661 HydrophobicContact CD1-CD1 4.17Å; L361-L661 HydrophobicContact CD1-CG 4.11Å; L361-L661 HydrophobicContact CG-CD1 4.48Å; L361-Y664 HydrophobicContact CD1-CD2 3.81Å; L361-Y664 HydrophobicContact CD1-CE2 3.54Å
362	W	92.5	Very high	87.5	Confident	9 Å²	9	15 Å²	15	3%	0.034	8%	0.08	C	C	.	.	H	α-helix	trans	-60.2	-50.1	-179.4	-177.9	92.3	0	0	0	111.4	C358 C359 V360 M364 E365 Q366 R380 I382 V680 L684	C358-W362 WeakPolarHBondContact O-CB 3.38Å; C358-W362 PolarHBondContact O-N 3.36Å; C359-W362 PolarHBondContact O-N 2.87Å; V360-W362 VanDerWaalsContact C-N 3.32Å; V360-W362 PolarHBondContact O-N 3.47Å; W362-M364 VanDerWaalsContact C-N 3.3Å; W362-M364 PolarHBondContact O-N 3.44Å; W362-E365 PolarHBondContact O-N 3.37Å; W362-Q366 HydrophobicContact CD2-CG 3.82Å; W362-Q366 HydrophobicContact CE3-CG 3.86Å; W362-Q366 HydrophobicContact CH2-CG 3.51Å; W362-Q366 HydrophobicContact CZ2-CG 3.46Å; W362-Q366 VanDerWaalsContact CZ2-CG 3.46Å; W362-Q366 HydrophobicContact CZ3-CG 3.72Å; W362-Q366 VanDerWaalsContact O-CG 3.28Å; W362-Q366 WeakPolarHBondContact O-CG 3.39Å; W362-Q366 PolarHBondContact O-N 3.21Å; W362-R380 WeakPolarHBondContact CZ2-O 3.23Å; W362-R380 PolarHBondContact NE1-O 3.06Å; W362-R380 VanDerWaalsContact NE1-O 3.12Å; W362-I382 HydrophobicContact CD2-CB 4.35Å; W362-I382 HydrophobicContact CD2-CG1 4.08Å; W362-I382 HydrophobicContact CE3-CB 4.45Å; W362-I382 HydrophobicContact CE3-CD1 4.19Å; W362-I382 HydrophobicContact CE3-CG1 4.02Å; W362-I382 HydrophobicContact CG-CG1 4.43Å; W362-I382 HydrophobicContact CZ3-CD1 4.49Å; W362-V680 HydrophobicContact CH2-CG1 4.17Å; W362-V680 HydrophobicContact CZ3-CG1 3.79Å; W362-L684 HydrophobicContact CH2-CD1 4.44Å; W362-L684 HydrophobicContact CH2-CD2 3.51Å; W362-L684 HydrophobicContact CH2-CG 4.09Å; W362-L684 HydrophobicContact CZ2-CD2 4.31Å; W362-L684 HydrophobicContact CZ3-CD1 4.02Å; W362-L684 HydrophobicContact CZ3-CD2 3.85Å; W362-L684 HydrophobicContact CZ3-CG 4.17Å
363	I	91.7	Very high	86.4	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.4	-42.9	-179.7	-63.4	168.2	0	0	0	110.4	C359 V360 Q366 M367 F677 V680 A697 I698 I701	C359-I363 WeakPolarHBondContact O-CG1 3.15Å; C359-I363 PolarHBondContact O-N 3.29Å; V360-I363 PolarHBondContact O-N 3.32Å; I363-Q366 PolarHBondContact O-N 3.49Å; I363-M367 HydrophobicContact CG2-CG 4.39Å; I363-M367 HydrophobicContact CG2-SD 3.96Å; I363-M367 VanDerWaalsContact O-CG 3.28Å; I363-M367 WeakPolarHBondContact O-CG 3.29Å; I363-M367 PolarHBondContact O-N 2.85Å; I363-F677 HydrophobicContact CG2-CD2 4.14Å; I363-F677 HydrophobicContact CG2-CE2 4.2Å; I363-V680 HydrophobicContact CG2-CG1 4.19Å; I363-A697 HydrophobicContact CD1-CB 4.19Å; I363-I698 HydrophobicContact CD1-CG1 3.83Å; I363-I701 HydrophobicContact CB-CD1 3.4Å; I363-I701 VanDerWaalsContact CB-CD1 3.4Å; I363-I701 HydrophobicContact CD1-CD1 3.78Å; I363-I701 HydrophobicContact CG1-CD1 4.16Å; I363-I701 HydrophobicContact CG2-CD1 3.36Å
364	M	91.2	Very high	85.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-41.9	178.4	-70.2	-68.3	-75.2	0	0	112.5	V360 L361 W362 M367 Y368 W637 Y664 F672 I701 I705	V360-M364 HydrophobicContact CG1-CG 4.36Å; V360-M364 VanDerWaalsContact O-CG 3.27Å; V360-M364 WeakPolarHBondContact O-CG 3.48Å; V360-M364 PolarHBondContact O-N 3.27Å; L361-M364 PolarHBondContact O-N 3.46Å; W362-M364 VanDerWaalsContact C-N 3.3Å; W362-M364 PolarHBondContact O-N 3.44Å; M364-M367 PolarHBondContact O-N 3.38Å; M364-Y368 WeakPolarHBondContact O-CB 3.28Å; M364-Y368 PolarHBondContact O-N 3.24Å; M364-W637 HydrophobicContact CE-CZ2 4.13Å; M364-Y664 HydrophobicContact CB-CG 4.26Å; M364-F672 HydrophobicContact CE-CD1 3.64Å; M364-F672 HydrophobicContact CE-CD2 3.92Å; M364-F672 HydrophobicContact CE-CE1 3.33Å; M364-F672 HydrophobicContact CE-CE2 3.62Å; M364-F672 HydrophobicContact CE-CG 3.93Å; M364-F672 HydrophobicContact CE-CZ 3.31Å; M364-F672 HydrophobicContact SD-CD1 3.79Å; M364-F672 HydrophobicContact SD-CE1 3.86Å; M364-F672 HydrophobicContact SD-CG 4.34Å; M364-F672 HydrophobicContact SD-CZ 4.43Å; M364-I701 HydrophobicContact CG-CD1 4.32Å; M364-I705 HydrophobicContact CE-CD1 3.83Å; M364-I705 HydrophobicContact CE-CG2 4.26Å; M364-I705 HydrophobicContact CG-CD1 4.4Å; M364-I705 HydrophobicContact SD-CD1 3.51Å; M364-I705 VanDerWaalsContact SD-CD1 3.51Å; M364-I705 HydrophobicContact SD-CG2 4.18Å
365	E	90.1	Very high	83.9	Confident	38 Å²	38	29.9 Å²	29.9	18%	0.178	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-44.1	174.7	179.9	173.3	176.2	0	0	111.3	L361 W362 M367 Y368 N369 Y664	L361-E365 WeakPolarHBondContact O-CB 3.49Å; L361-E365 PolarHBondContact O-N 3.33Å; W362-E365 PolarHBondContact O-N 3.37Å; E365-M367 PolarHBondContact O-N 2.64Å; E365-Y368 PolarHBondContact O-N 2.9Å; E365-N369 WeakPolarHBondContact O-CB 3.45Å; E365-N369 PolarHBondContact O-N 2.85Å; E365-N369 PolarHBondContact O-ND2 2.75Å; E365-Y664 HydrophobicContact CB-CE2 4.49Å; E365-Y664 WeakPolarHBondContact CB-OH 3.43Å; E365-Y664 WeakPolarHBondContact CG-OH 2.94Å
366	Q	88.7	Confident	82.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-42	175.8	-61.6	-46.3	-85.6	0	0	112.3	W362 I363 Y368 N369 L370 W379 V680	W362-Q366 HydrophobicContact CD2-CG 3.82Å; W362-Q366 HydrophobicContact CE3-CG 3.86Å; W362-Q366 HydrophobicContact CH2-CG 3.51Å; W362-Q366 HydrophobicContact CZ2-CG 3.46Å; W362-Q366 VanDerWaalsContact CZ2-CG 3.46Å; W362-Q366 HydrophobicContact CZ3-CG 3.72Å; W362-Q366 VanDerWaalsContact O-CG 3.28Å; W362-Q366 WeakPolarHBondContact O-CG 3.39Å; W362-Q366 PolarHBondContact O-N 3.21Å; I363-Q366 PolarHBondContact O-N 3.49Å; Q366-Y368 VanDerWaalsContact C-N 3.32Å; Q366-Y368 PolarHBondContact O-N 2.89Å; Q366-N369 PolarHBondContact O-N 2.94Å; Q366-L370 WeakPolarHBondContact O-CG 3.43Å; Q366-L370 PolarHBondContact O-N 3.42Å; Q366-W379 HydrophobicContact CB-CZ3 3.9Å; Q366-W379 HydrophobicContact CG-CE3 4.31Å; Q366-W379 HydrophobicContact CG-CZ3 4.05Å; Q366-V680 HydrophobicContact CB-CB 4.3Å; Q366-V680 HydrophobicContact CB-CG1 3.66Å; Q366-V680 HydrophobicContact CB-CG2 3.57Å; Q366-V680 HydrophobicContact CG-CG1 4.06Å
367	M	89.4	Confident	80.8	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-38.3	177.5	-70.6	173.5	69	0	0	111.6	I363 M364 E365 S371 F672 S676 F677 V680 I701 V706	I363-M367 HydrophobicContact CG2-CG 4.39Å; I363-M367 HydrophobicContact CG2-SD 3.96Å; I363-M367 VanDerWaalsContact O-CG 3.28Å; I363-M367 WeakPolarHBondContact O-CG 3.29Å; I363-M367 PolarHBondContact O-N 2.85Å; M364-M367 PolarHBondContact O-N 3.38Å; E365-M367 PolarHBondContact O-N 2.64Å; M367-S371 PolarHBondContact O-N 2.79Å; M367-S371 PolarHBondContact O-OG 3.47Å; M367-F672 HydrophobicContact CB-CD1 4.05Å; M367-F672 HydrophobicContact CB-CE1 4.4Å; M367-F672 HydrophobicContact CE-CB 3.74Å; M367-F672 HydrophobicContact CE-CD1 3.93Å; M367-F672 HydrophobicContact CE-CG 4.34Å; M367-F672 HydrophobicContact SD-CD1 4.4Å; M367-S676 WeakPolarHBondContact CE-OG 3.44Å; M367-F677 HydrophobicContact CE-CB 3.77Å; M367-F677 HydrophobicContact SD-CB 4.09Å; M367-F677 HydrophobicContact SD-CD2 3.98Å; M367-V680 HydrophobicContact CB-CG2 4.43Å; M367-V680 HydrophobicContact CG-CB 4.42Å; M367-V680 HydrophobicContact CG-CG2 3.69Å; M367-I701 HydrophobicContact SD-CG2 4.33Å; M367-V706 HydrophobicContact CE-CG2 3.94Å
368	Y	87.2	Confident	79.7	Confident	6 Å²	6	47.5 Å²	47.5	2%	0.024	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-47.2	175	178.4	-101.8	0	0	0	111.6	M364 E365 Q366 L370 S371 H372 I397 Y664 L667	M364-Y368 WeakPolarHBondContact O-CB 3.28Å; M364-Y368 PolarHBondContact O-N 3.24Å; E365-Y368 PolarHBondContact O-N 2.9Å; Q366-Y368 VanDerWaalsContact C-N 3.32Å; Q366-Y368 PolarHBondContact O-N 2.89Å; Y368-L370 VanDerWaalsContact C-N 3.32Å; Y368-L370 PolarHBondContact O-N 3.05Å; Y368-S371 WeakPolarHBondContact O-CA 3.37Å; Y368-S371 WeakPolarHBondContact O-CB 3.34Å; Y368-S371 PolarHBondContact O-N 3.28Å; Y368-H372 AromaticContact CD2-CE1 3.63Å; Y368-H372 AromaticContact CD2-ND1 3.99Å; Y368-H372 AromaticContact CE2-CE1 3.12Å; Y368-H372 WeakPolarHBondContact CE2-CE1 3.36Å; Y368-H372 AromaticContact CE2-ND1 3.76Å; Y368-H372 AromaticContact CE2-NE2 3.7Å; Y368-H372 AromaticContact CZ-CE1 3.4Å; Y368-H372 VanDerWaalsContact CZ-CE1 3.4Å; Y368-H372 AromaticContact CZ-ND1 3.78Å; Y368-H372 AromaticContact CZ-NE2 3.67Å; Y368-H372 PolarHBondContact O-ND1 2.87Å; Y368-H372 PolarHBondContact OH-NE2 3.08Å; Y368-I397 HydrophobicContact CE1-CG2 4.12Å; Y368-Y664 HydrophobicContact CD1-CE1 4.31Å; Y368-Y664 HydrophobicContact CG-CE1 4.01Å; Y368-L667 HydrophobicContact CD2-CD1 3.45Å; Y368-L667 VanDerWaalsContact CD2-CD1 3.45Å; Y368-L667 HydrophobicContact CE2-CD1 3.63Å; Y368-L667 HydrophobicContact CE2-CD2 4.44Å; Y368-L667 HydrophobicContact CG-CD1 4.38Å
369	N	85.3	Confident	78.7	Confident	16 Å²	16	52.3 Å²	52.3	9%	0.086	26%	0.26	C	S	.	.	H	α-helix	trans	-62.7	-37.1	179.2	-66.7	-20.2	0	0	0	112.2	E365 Q366 S371 H372 F377	E365-N369 WeakPolarHBondContact O-CB 3.45Å; E365-N369 PolarHBondContact O-N 2.85Å; E365-N369 PolarHBondContact O-ND2 2.75Å; Q366-N369 PolarHBondContact O-N 2.94Å; N369-S371 PolarHBondContact O-N 3.36Å; N369-H372 CarbonylContact O-C 3.59Å; N369-H372 PolarHBondContact O-N 3.05Å; N369-F377 HydrophobicContact CB-CD2 3.85Å; N369-F377 HydrophobicContact CB-CE2 4.02Å; N369-F377 HydrophobicContact CB-CG 4.3Å; N369-F377 WeakPolarHBondContact ND2-CE2 3.33Å
370	L	82	Confident	78	Confident	60 Å²	60	56.8 Å²	56.8	31%	0.314	28%	0.277	S	S	.	.	H	α-helix	trans	-58.4	-28.4	172.4	-78.2	179.7	0	0	0	113.4	Q366 Y368 H372 W379 R679 V680	Q366-L370 WeakPolarHBondContact O-CG 3.43Å; Q366-L370 PolarHBondContact O-N 3.42Å; Y368-L370 VanDerWaalsContact C-N 3.32Å; Y368-L370 PolarHBondContact O-N 3.05Å; L370-H372 VanDerWaalsContact C-N 3.3Å; L370-W379 HydrophobicContact CD1-CH2 4.12Å; L370-W379 HydrophobicContact CD2-CH2 3.92Å; L370-W379 HydrophobicContact CD2-CZ2 3.93Å; L370-W379 HydrophobicContact CG-CH2 4.07Å; L370-R679 HydrophobicContact CD1-CB 3.85Å; L370-V680 HydrophobicContact CD1-CG2 3.55Å; L370-V680 HydrophobicContact CG-CG2 4.39Å
371	S	72.5	Confident	77.4	Confident	45 Å²	45	60.3 Å²	60.3	32%	0.315	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-11.3	179.9	-54.7	0	0	0	0	112.9	M367 Y368 N369 P373	M367-S371 PolarHBondContact O-N 2.79Å; M367-S371 PolarHBondContact O-OG 3.47Å; Y368-S371 WeakPolarHBondContact O-CA 3.37Å; Y368-S371 WeakPolarHBondContact O-CB 3.34Å; Y368-S371 PolarHBondContact O-N 3.28Å; N369-S371 PolarHBondContact O-N 3.36Å; S371-P373 WeakPolarHBondContact O-CD 3.22Å
372	H	70.4	Confident	76.8	Confident	45 Å²	45	60.3 Å²	60.3	21%	0.208	30%	0.3	C	S	.	.			trans	-124.1	79.8	-175.2	-61.1	73.7	0	0	0	109.4	Y368 N369 L370 E374 L375	Y368-H372 AromaticContact CD2-CE1 3.63Å; Y368-H372 AromaticContact CD2-ND1 3.99Å; Y368-H372 AromaticContact CE2-CE1 3.12Å; Y368-H372 WeakPolarHBondContact CE2-CE1 3.36Å; Y368-H372 AromaticContact CE2-ND1 3.76Å; Y368-H372 AromaticContact CE2-NE2 3.7Å; Y368-H372 AromaticContact CZ-CE1 3.4Å; Y368-H372 VanDerWaalsContact CZ-CE1 3.4Å; Y368-H372 AromaticContact CZ-ND1 3.78Å; Y368-H372 AromaticContact CZ-NE2 3.67Å; Y368-H372 PolarHBondContact O-ND1 2.87Å; Y368-H372 PolarHBondContact OH-NE2 3.08Å; N369-H372 CarbonylContact O-C 3.59Å; N369-H372 PolarHBondContact O-N 3.05Å; L370-H372 VanDerWaalsContact C-N 3.3Å; H372-E374 PolarHBondContact O-N 3.03Å; H372-E374 VanDerWaalsContact O-N 3.07Å; H372-L375 HydrophobicContact CB-CD1 4.39Å; H372-L375 PolarHBondContact O-N 3.04Å
373	P	61.3	Low	76.1	Confident	111 Å²	111	62.5 Å²	62.5	72%	0.721	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-8.5	-174.5	25.9	-33.6	0	0	0	114.4	S371 L375	S371-P373 WeakPolarHBondContact O-CD 3.22Å; P373-L375 PolarHBondContact O-N 3.23Å
374	E	60.8	Low	75.3	Confident	175 Å²	175	64.5 Å²	64.5	82%	0.818	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-13.2	178.2	-59.3	-172.7	178.6	0	0	113.4	H372	H372-E374 PolarHBondContact O-N 3.03Å; H372-E374 VanDerWaalsContact O-N 3.07Å
375	L	62.1	Low	74.5	Confident	68 Å²	68	65.3 Å²	65.3	36%	0.356	34%	0.339	S	S	.	.	S	Bend	trans	-91.3	116.9	175.6	-64.9	169.4	0	0	0	109.4	H372 P373 F377	H372-L375 HydrophobicContact CB-CD1 4.39Å; H372-L375 PolarHBondContact O-N 3.04Å; P373-L375 PolarHBondContact O-N 3.23Å; L375-F377 PolarHBondContact O-N 2.96Å
376	D	53.8	Low	73.6	Confident	173 Å²	173	69.5 Å²	69.5	93%	0.925	35%	0.353	S	S	*	.			trans	-61.4	100.8	172.8	-174	6.1	0	0	0	109.4
377	F	61.1	Low	72.6	Confident	56 Å²	56	78 Å²	78	25%	0.246	39%	0.39	C	S	.	.			trans	-104.5	110.1	-164.9	-168.1	-101.7	0	0	0	112.3	N369 L375 W379	N369-F377 HydrophobicContact CB-CD2 3.85Å; N369-F377 HydrophobicContact CB-CE2 4.02Å; N369-F377 HydrophobicContact CB-CG 4.3Å; N369-F377 WeakPolarHBondContact ND2-CE2 3.33Å; L375-F377 PolarHBondContact O-N 2.96Å; F377-W379 HydrophobicContact CD1-CD2 4.34Å; F377-W379 HydrophobicContact CE1-CB 4.4Å; F377-W379 AromaticContact CE1-CD2 3.78Å; F377-W379 HydrophobicContact CE1-CD2 3.78Å; F377-W379 AromaticContact CE1-CE3 3.79Å; F377-W379 HydrophobicContact CE1-CE3 3.79Å; F377-W379 HydrophobicContact CE1-CG 4.09Å; F377-W379 HydrophobicContact CE1-CZ3 4.3Å
378	K	66.3	Low	71.3	Confident	183 Å²	183	80.3 Å²	80.3	80%	0.796	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-95.6	120	163.4	-171.8	176.3	-179.9	-179.7	0	109.6	R380	K378-R380 PolarHBondContact O-N 2.74Å; K378-R380 VanDerWaalsContact O-N 3.09Å
379	W	71.5	Confident	69.5	Low	101 Å²	101	83 Å²	83	38%	0.383	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-49.3	116.1	173.2	-64.5	97.6	0	0	0	110.8	Q366 L370 F377 V680 S683	Q366-W379 HydrophobicContact CB-CZ3 3.9Å; Q366-W379 HydrophobicContact CG-CE3 4.31Å; Q366-W379 HydrophobicContact CG-CZ3 4.05Å; L370-W379 HydrophobicContact CD1-CH2 4.12Å; L370-W379 HydrophobicContact CD2-CH2 3.92Å; L370-W379 HydrophobicContact CD2-CZ2 3.93Å; L370-W379 HydrophobicContact CG-CH2 4.07Å; F377-W379 HydrophobicContact CD1-CD2 4.34Å; F377-W379 HydrophobicContact CE1-CB 4.4Å; F377-W379 AromaticContact CE1-CD2 3.78Å; F377-W379 HydrophobicContact CE1-CD2 3.78Å; F377-W379 AromaticContact CE1-CE3 3.79Å; F377-W379 HydrophobicContact CE1-CE3 3.79Å; F377-W379 HydrophobicContact CE1-CG 4.09Å; F377-W379 HydrophobicContact CE1-CZ3 4.3Å; W379-V680 HydrophobicContact CH2-CB 4.49Å; W379-V680 HydrophobicContact CH2-CG2 4.05Å; W379-V680 HydrophobicContact CZ3-CB 4.32Å; W379-V680 HydrophobicContact CZ3-CG1 4.23Å; W379-V680 HydrophobicContact CZ3-CG2 4.05Å; W379-S683 VanDerWaalsContact CE3-OG 3.24Å; W379-S683 WeakPolarHBondContact CZ3-OG 3.41Å
380	R	76.5	Confident	67.6	Low	97 Å²	97	87.3 Å²	87.3	37%	0.366	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-78.9	135.5	172.6	-65	-174	-175.7	-162.3	2.1	107.7	W362 K378 A384 D392	W362-R380 WeakPolarHBondContact CZ2-O 3.23Å; W362-R380 PolarHBondContact NE1-O 3.06Å; W362-R380 VanDerWaalsContact NE1-O 3.12Å; K378-R380 PolarHBondContact O-N 2.74Å; K378-R380 VanDerWaalsContact O-N 3.09Å; R380-A384 HydrophobicContact CB-CB 4.48Å; R380-D392 IonicContact CZ-OD1 3.9Å; R380-D392 IonicContact NH1-OD1 2.58Å; R380-D392 PolarHBondContact NH1-OD1 3.4Å; R380-D392 IonicContact NH1-OD2 3.05Å; R380-D392 IonicContact NH2-OD1 3.55Å
381	P	78.4	Confident	65.7	Low	74 Å²	74	91.1 Å²	91.1	48%	0.481	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-59.5	146.4	175.5	23.9	-31.4	0	0	0	110.8	S383 A384	P381-S383 PolarHBondContact O-N 3.14Å; P381-S383 VanDerWaalsContact O-N 3.15Å; P381-A384 HydrophobicContact CG-CB 4.34Å; P381-A384 WeakPolarHBondContact O-CB 3.48Å; P381-A384 PolarHBondContact O-N 3.15Å
382	I	80.9	Confident	64.4	Low	10 Å²	10	91.1 Å²	91.1	5%	0.051	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-60.3	-28.6	-177.5	-166.6	167.4	0	0	0	112.3	W362 A384 S385 L684 E688	W362-I382 HydrophobicContact CD2-CB 4.35Å; W362-I382 HydrophobicContact CD2-CG1 4.08Å; W362-I382 HydrophobicContact CE3-CB 4.45Å; W362-I382 HydrophobicContact CE3-CD1 4.19Å; W362-I382 HydrophobicContact CE3-CG1 4.02Å; W362-I382 HydrophobicContact CG-CG1 4.43Å; W362-I382 HydrophobicContact CZ3-CD1 4.49Å; I382-A384 PolarHBondContact O-N 2.97Å; I382-S385 WeakPolarHBondContact O-CB 3.25Å; I382-S385 PolarHBondContact O-N 3.35Å; I382-S385 PolarHBondContact O-OG 3.08Å; I382-L684 HydrophobicContact CB-CD2 4.07Å; I382-L684 HydrophobicContact CD1-CD1 4.26Å; I382-L684 HydrophobicContact CG2-CD2 4.42Å; I382-E688 HydrophobicContact CG2-CB 4.16Å; I382-E688 HydrophobicContact CG2-CG 3.88Å
383	S	76	Confident	63.4	Low	54 Å²	54	91.2 Å²	91.2	38%	0.378	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-64.9	-18.6	174.5	58.1	0	0	0	0	113.9	P381 S385 W386	P381-S383 PolarHBondContact O-N 3.14Å; P381-S383 VanDerWaalsContact O-N 3.15Å; S383-S385 PolarHBondContact O-N 2.8Å; S383-W386 PolarHBondContact O-N 3.31Å
384	A	75.2	Confident	62.7	Low	42 Å²	42	89.9 Å²	89.9	35%	0.347	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-67.2	-23.3	172.4	0	0	0	0	0	112	R380 P381 I382 W386 K387	R380-A384 HydrophobicContact CB-CB 4.48Å; P381-A384 HydrophobicContact CG-CB 4.34Å; P381-A384 WeakPolarHBondContact O-CB 3.48Å; P381-A384 PolarHBondContact O-N 3.15Å; I382-A384 PolarHBondContact O-N 2.97Å; A384-W386 PolarHBondContact O-N 2.99Å; A384-W386 VanDerWaalsContact O-N 3.17Å; A384-K387 PolarHBondContact O-N 3.45Å
385	S	75.1	Confident	61.9	Low	17 Å²	17	86.4 Å²	86.4	12%	0.119	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-61.3	-23.3	178	70.5	0	0	0	0	113.4	I382 S383 K387	I382-S385 WeakPolarHBondContact O-CB 3.25Å; I382-S385 PolarHBondContact O-N 3.35Å; I382-S385 PolarHBondContact O-OG 3.08Å; S383-S385 PolarHBondContact O-N 2.8Å; S385-K387 VanDerWaalsContact C-N 3.33Å
386	W	71.8	Confident	61.1	Low	127 Å²	127	89.2 Å²	89.2	48%	0.481	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-80.3	-15.3	-178	-49.1	-26.2	0	0	0	113.2	T355 S383 A384	T355-W386 HydrophobicContact CG2-CZ2 4.38Å; S383-W386 PolarHBondContact O-N 3.31Å; A384-W386 PolarHBondContact O-N 2.99Å; A384-W386 VanDerWaalsContact O-N 3.17Å
387	K	66.6	Low	61	Low	179 Å²	179	82.4 Å²	82.4	78%	0.778	43%	0.43	S	S	*	.			trans	-108.1	77.8	179.6	-67.1	-176	-179	179.9	0	109.6	A384 S385 S389	A384-K387 PolarHBondContact O-N 3.45Å; S385-K387 VanDerWaalsContact C-N 3.33Å; K387-S389 PolarHBondContact O-N 2.87Å
388	L	61.6	Low	60.3	Low	48 Å²	48	82.7 Å²	82.7	25%	0.251	44%	0.439	S	S	.	.			trans	-70.7	94.5	170.9	-72.3	124.1	0	0	0	109.6	F354 L361 T656 V657 K660	F354-L388 HydrophobicContact CE1-CD1 4.33Å; F354-L388 HydrophobicContact CE2-CD1 4.1Å; F354-L388 HydrophobicContact CZ-CD1 3.46Å; F354-L388 VanDerWaalsContact CZ-CD1 3.46Å; L361-L388 HydrophobicContact CD2-CD2 4.25Å; L388-T656 HydrophobicContact CD2-CG2 4.28Å; L388-V657 HydrophobicContact CD1-CG2 3.21Å; L388-V657 HydrophobicContact CD2-CG2 3.81Å; L388-V657 HydrophobicContact CG-CG2 4.13Å; L388-K660 HydrophobicContact CD2-CD 4.15Å
389	S	51.3	Low	59.4	Low	61 Å²	61	79.2 Å²	79.2	43%	0.427	43%	0.426	S	S	.	.			trans	-67.9	133.7	160.9	178.5	0	0	0	0	108.2	K387 N391	K387-S389 PolarHBondContact O-N 2.87Å; S389-N391 PolarHBondContact O-N 3.19Å; S389-N391 PolarHBondContact OG-N 3.3Å
390	S	44.4	Very low	58.4	Low	107 Å²	107	76.4 Å²	76.4	75%	0.748	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-12.5	173.7	60.5	0	0	0	0	113.1
391	N	41.6	Very low	57	Low	140 Å²	140	77.3 Å²	77.3	75%	0.749	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	22.6	-168.8	-58.5	-11.6	0	0	0	113.8	S389	S389-N391 PolarHBondContact O-N 3.19Å; S389-N391 PolarHBondContact OG-N 3.3Å
392	D	46.6	Very low	55.6	Low	46 Å²	46	78.4 Å²	78.4	25%	0.246	43%	0.426	C	S	.	.	S	Bend	trans	-77.8	152.2	173.5	-101.4	-43.6	0	0	0	111.9	R380 T394	R380-D392 IonicContact CZ-OD1 3.9Å; R380-D392 IonicContact NH1-OD1 2.58Å; R380-D392 PolarHBondContact NH1-OD1 3.4Å; R380-D392 IonicContact NH1-OD2 3.05Å; R380-D392 IonicContact NH2-OD1 3.55Å; D392-T394 VanDerWaalsContact C-N 3.27Å; D392-T394 PolarHBondContact O-N 3.5Å
393	P	47.6	Very low	54.1	Low	46 Å²	46	83.3 Å²	83.3	30%	0.299	45%	0.448	S	S	.	.	S	Bend	trans	-77.2	54.9	-154.2	33.8	-38.6	0	0	0	114.8	T395 E396 I397	P393-T395 PolarHBondContact O-N 3.35Å; P393-E396 HydrophobicContact CB-CB 4.34Å; P393-E396 PolarHBondContact O-N 2.89Å; P393-I397 PolarHBondContact O-N 3.02Å
394	T	46.7	Very low	52.7	Low	83 Å²	83	85.5 Å²	85.5	51%	0.509	45%	0.453	S	S	.	.	H	α-helix	trans	-64.3	-21.5	172.4	52	0	0	0	0	112.5	D392 S398	D392-T394 VanDerWaalsContact C-N 3.27Å; D392-T394 PolarHBondContact O-N 3.5Å; T394-S398 PolarHBondContact O-N 3.34Å
395	T	44.2	Very low	51.7	Low	103 Å²	103	85.9 Å²	85.9	63%	0.632	45%	0.449	S	S	*	.	H	α-helix	trans	-71.2	-42.2	176	-34.5	0	0	0	0	112.1	P393 I397 S398 E399	P393-T395 PolarHBondContact O-N 3.35Å; T395-I397 PolarHBondContact O-N 3.25Å; T395-S398 PolarHBondContact O-N 3.32Å; T395-E399 PolarHBondContact O-N 3.43Å
396	E	45.9	Very low	50.6	Low	126 Å²	126	91.1 Å²	91.1	59%	0.589	47%	0.472	S	S	*	.	H	α-helix	trans	-66.8	-37.4	178	-80.4	179.4	158.4	0	0	111.9	P393 S398 E399 V400	P393-E396 HydrophobicContact CB-CB 4.34Å; P393-E396 PolarHBondContact O-N 2.89Å; E396-S398 VanDerWaalsContact C-N 3.33Å; E396-S398 PolarHBondContact O-N 3.09Å; E396-E399 PolarHBondContact O-N 2.95Å; E396-V400 WeakPolarHBondContact O-CG2 3.46Å; E396-V400 PolarHBondContact O-N 3.34Å
397	I	51.5	Low	49.9	Very low	30 Å²	30	87.7 Å²	87.7	15%	0.154	47%	0.47	C	S	.	.	H	α-helix	trans	-67.1	-35.2	-178.4	-60.7	166.3	0	0	0	111.4	Y368 P393 T395 Y401 F663	Y368-I397 HydrophobicContact CE1-CG2 4.12Å; P393-I397 PolarHBondContact O-N 3.02Å; T395-I397 PolarHBondContact O-N 3.25Å; I397-Y401 PolarHBondContact O-N 3.15Å; I397-F663 HydrophobicContact CG2-CE1 3.65Å; I397-F663 HydrophobicContact CG2-CE2 4.34Å; I397-F663 HydrophobicContact CG2-CZ 3.47Å; I397-F663 VanDerWaalsContact CG2-CZ 3.47Å
398	S	45.8	Very low	49.3	Very low	63 Å²	63	83.5 Å²	83.5	44%	0.441	46%	0.456	S	S	.	.	H	α-helix	trans	-67.8	-39.9	173.9	-167.7	0	0	0	0	111.7	T394 T395 E396 Y401 D402	T394-S398 PolarHBondContact O-N 3.34Å; T395-S398 PolarHBondContact O-N 3.32Å; E396-S398 VanDerWaalsContact C-N 3.33Å; E396-S398 PolarHBondContact O-N 3.09Å; S398-Y401 PolarHBondContact O-N 2.96Å; S398-D402 PolarHBondContact O-N 3.32Å; S398-D402 VanDerWaalsContact O-N 3.13Å
399	E	47.6	Very low	49.3	Very low	110 Å²	110	86.5 Å²	86.5	51%	0.514	47%	0.469	S	S	.	.	H	α-helix	trans	-66.5	-38.3	178.1	-72.9	-177.2	-177.8	0	0	112.2	T395 E396 Y401 D402 Q403	T395-E399 PolarHBondContact O-N 3.43Å; E396-E399 PolarHBondContact O-N 2.95Å; E399-Y401 VanDerWaalsContact C-N 3.33Å; E399-Y401 PolarHBondContact O-N 2.94Å; E399-D402 PolarHBondContact O-N 3.34Å; E399-Q403 WeakPolarHBondContact O-CG 3.29Å; E399-Q403 PolarHBondContact O-N 2.94Å
400	V	51.5	Low	50.1	Low	42 Å²	42	87.8 Å²	87.8	26%	0.255	47%	0.474	S	S	.	.	H	α-helix	trans	-63.7	-39.9	175.5	173.7	0	0	0	0	111.1	E396 D402 Q403 Q404	E396-V400 WeakPolarHBondContact O-CG2 3.46Å; E396-V400 PolarHBondContact O-N 3.34Å; V400-D402 VanDerWaalsContact C-N 3.33Å; V400-D402 PolarHBondContact O-N 3.23Å; V400-Q403 PolarHBondContact O-N 2.89Å; V400-Q404 PolarHBondContact O-N 3.19Å
401	Y	46	Very low	50.4	Low	115 Å²	115	88.9 Å²	88.9	45%	0.451	46%	0.462	S	S	.	.	H	α-helix	trans	-62.3	-40.4	175	-170.9	-98.7	0	0	0	112	I397 S398 E399 N405	I397-Y401 PolarHBondContact O-N 3.15Å; S398-Y401 PolarHBondContact O-N 2.96Å; E399-Y401 VanDerWaalsContact C-N 3.33Å; E399-Y401 PolarHBondContact O-N 2.94Å; Y401-N405 WeakPolarHBondContact CD1-ND2 2.68Å; Y401-N405 VanDerWaalsContact CE1-ND2 3.25Å; Y401-N405 WeakPolarHBondContact CE1-ND2 3.35Å; Y401-N405 VanDerWaalsContact O-CG 3.32Å; Y401-N405 PolarHBondContact O-N 3.26Å; Y401-N405 PolarHBondContact O-ND2 2.88Å
402	D	50.2	Low	50.9	Low	97 Å²	97	86.2 Å²	86.2	52%	0.519	44%	0.444	S	S	.	.	H	α-helix	trans	-69.5	-35.2	176.4	-72.8	-24.3	0	0	0	112.6	S398 E399 V400 N405 Q406	S398-D402 PolarHBondContact O-N 3.32Å; S398-D402 VanDerWaalsContact O-N 3.13Å; E399-D402 PolarHBondContact O-N 3.34Å; V400-D402 VanDerWaalsContact C-N 3.33Å; V400-D402 PolarHBondContact O-N 3.23Å; D402-N405 WeakPolarHBondContact O-CB 3.36Å; D402-N405 PolarHBondContact O-N 3.49Å; D402-Q406 PolarHBondContact O-N 3.15Å
403	Q	48.2	Very low	51.7	Low	114 Å²	114	88.2 Å²	88.2	53%	0.533	46%	0.455	S	S	.	.	H	α-helix	trans	-68	-40.6	175.1	-73.7	177.2	24.6	0	0	112.6	E399 V400 N405 Q406 A407	E399-Q403 WeakPolarHBondContact O-CG 3.29Å; E399-Q403 PolarHBondContact O-N 2.94Å; V400-Q403 PolarHBondContact O-N 2.89Å; Q403-N405 VanDerWaalsContact C-N 3.32Å; Q403-N405 PolarHBondContact O-N 2.71Å; Q403-Q406 CarbonylContact O-C 3.59Å; Q403-Q406 WeakPolarHBondContact O-CA 3.44Å; Q403-Q406 WeakPolarHBondContact O-CB 3.36Å; Q403-Q406 PolarHBondContact O-N 3.41Å; Q403-Q406 VanDerWaalsContact O-N 3.07Å; Q403-A407 PolarHBondContact O-N 3.31Å
404	Q	47.5	Very low	52.6	Low	99 Å²	99	89 Å²	89	46%	0.463	45%	0.454	S	S	.	.	H	α-helix	trans	-62.4	-41.8	174.4	-171.1	69.3	42.5	0	0	111	V400 Q406 A407 D408	V400-Q404 PolarHBondContact O-N 3.19Å; Q404-Q406 VanDerWaalsContact C-N 3.26Å; Q404-Q406 PolarHBondContact O-N 3.4Å; Q404-A407 PolarHBondContact O-N 3.01Å; Q404-D408 PolarHBondContact O-N 3.07Å
405	N	54	Low	53.3	Low	50 Å²	50	88.9 Å²	88.9	27%	0.267	45%	0.45	S	S	.	.	H	α-helix	trans	-61.8	-35.2	173.1	-72.9	-42.3	0	0	0	111.8	Y401 D402 Q403 Q409	Y401-N405 WeakPolarHBondContact CD1-ND2 2.68Å; Y401-N405 VanDerWaalsContact CE1-ND2 3.25Å; Y401-N405 WeakPolarHBondContact CE1-ND2 3.35Å; Y401-N405 VanDerWaalsContact O-CG 3.32Å; Y401-N405 PolarHBondContact O-N 3.26Å; Y401-N405 PolarHBondContact O-ND2 2.88Å; D402-N405 WeakPolarHBondContact O-CB 3.36Å; D402-N405 PolarHBondContact O-N 3.49Å; Q403-N405 VanDerWaalsContact C-N 3.32Å; Q403-N405 PolarHBondContact O-N 2.71Å; N405-Q409 VanDerWaalsContact O-CB 3.24Å; N405-Q409 WeakPolarHBondContact O-CB 3.44Å; N405-Q409 PolarHBondContact O-N 3.22Å
406	Q	52.1	Low	53.6	Low	128 Å²	128	90.1 Å²	90.1	60%	0.598	44%	0.444	S	S	*	.	H	α-helix	trans	-70.1	-40.3	175.9	-167.5	175.3	50.6	0	0	112.2	D402 Q403 Q404 Q409 V410	D402-Q406 PolarHBondContact O-N 3.15Å; Q403-Q406 CarbonylContact O-C 3.59Å; Q403-Q406 WeakPolarHBondContact O-CA 3.44Å; Q403-Q406 WeakPolarHBondContact O-CB 3.36Å; Q403-Q406 PolarHBondContact O-N 3.41Å; Q403-Q406 VanDerWaalsContact O-N 3.07Å; Q404-Q406 VanDerWaalsContact C-N 3.26Å; Q404-Q406 PolarHBondContact O-N 3.4Å; Q406-Q409 WeakPolarHBondContact O-CB 3.46Å; Q406-Q409 PolarHBondContact O-N 3.15Å; Q406-V410 HydrophobicContact CG-CG2 4.42Å; Q406-V410 WeakPolarHBondContact O-CB 3.25Å; Q406-V410 VanDerWaalsContact O-CG2 3.26Å; Q406-V410 WeakPolarHBondContact O-CG2 3.34Å; Q406-V410 PolarHBondContact O-N 2.65Å
407	A	56.8	Low	53.6	Low	54 Å²	54	88.2 Å²	88.2	45%	0.446	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-43.9	175.5	0	0	0	0	0	111.7	Q403 Q404 Q409 V410 W411	Q403-A407 PolarHBondContact O-N 3.31Å; Q404-A407 PolarHBondContact O-N 3.01Å; A407-Q409 VanDerWaalsContact C-N 3.31Å; A407-Q409 PolarHBondContact O-N 3.17Å; A407-V410 PolarHBondContact O-N 2.95Å; A407-W411 WeakPolarHBondContact O-CB 3.38Å; A407-W411 PolarHBondContact O-N 3.14Å
408	D	53.5	Low	53.3	Low	91 Å²	91	92.9 Å²	92.9	49%	0.487	47%	0.467	S	S	.	.	H	α-helix	trans	-64	-37.2	174.1	-78	-19.8	0	0	0	111.7	Q404 H412	Q404-D408 PolarHBondContact O-N 3.07Å; D408-H412 VanDerWaalsContact O-CB 3.32Å; D408-H412 WeakPolarHBondContact O-CB 3.45Å; D408-H412 PolarHBondContact O-N 3.45Å
409	Q	63.2	Low	53.2	Low	111 Å²	111	95.9 Å²	95.9	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-67.6	-44.6	175.3	-166.9	68.3	48.6	0	0	112.1	N405 Q406 A407 W411 H412 D413	N405-Q409 VanDerWaalsContact O-CB 3.24Å; N405-Q409 WeakPolarHBondContact O-CB 3.44Å; N405-Q409 PolarHBondContact O-N 3.22Å; Q406-Q409 WeakPolarHBondContact O-CB 3.46Å; Q406-Q409 PolarHBondContact O-N 3.15Å; A407-Q409 VanDerWaalsContact C-N 3.31Å; A407-Q409 PolarHBondContact O-N 3.17Å; Q409-W411 VanDerWaalsContact C-N 3.33Å; Q409-W411 PolarHBondContact O-N 3.04Å; Q409-H412 CarbonylContact O-C 3.52Å; Q409-H412 WeakPolarHBondContact O-CA 3.47Å; Q409-H412 VanDerWaalsContact O-CB 3.29Å; Q409-H412 WeakPolarHBondContact O-CB 3.39Å; Q409-H412 PolarHBondContact O-N 2.8Å; Q409-D413 VanDerWaalsContact O-CG 3.25Å; Q409-D413 PolarHBondContact O-N 3.45Å
410	V	68.3	Low	52.8	Low	88 Å²	88	98.9 Å²	98.9	53%	0.533	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-40.2	176.3	169.4	0	0	0	0	110.6	Q406 A407 H412 D413 F414	Q406-V410 HydrophobicContact CG-CG2 4.42Å; Q406-V410 WeakPolarHBondContact O-CB 3.25Å; Q406-V410 VanDerWaalsContact O-CG2 3.26Å; Q406-V410 WeakPolarHBondContact O-CG2 3.34Å; Q406-V410 PolarHBondContact O-N 2.65Å; A407-V410 PolarHBondContact O-N 2.95Å; V410-H412 VanDerWaalsContact C-N 3.33Å; V410-D413 PolarHBondContact O-N 3.44Å; V410-F414 WeakPolarHBondContact O-CB 3.37Å; V410-F414 PolarHBondContact O-N 2.88Å
411	W	49.3	Very low	52.3	Low	130 Å²	130	105.8 Å²	105.8	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-37.5	174.8	-163.9	-121.3	0	0	0	111.6	A407 Q409 F414 I415	A407-W411 WeakPolarHBondContact O-CB 3.38Å; A407-W411 PolarHBondContact O-N 3.14Å; Q409-W411 VanDerWaalsContact C-N 3.33Å; Q409-W411 PolarHBondContact O-N 3.04Å; W411-F414 HydrophobicContact CD2-CD1 4.36Å; W411-F414 AromaticContact CE3-CD1 3.62Å; W411-F414 HydrophobicContact CE3-CD1 3.62Å; W411-F414 HydrophobicContact CE3-CE1 4.38Å; W411-F414 HydrophobicContact CE3-CG 4.48Å; W411-F414 AromaticContact CH2-CD1 3.87Å; W411-F414 HydrophobicContact CH2-CD1 3.87Å; W411-F414 AromaticContact CH2-CE1 3.81Å; W411-F414 HydrophobicContact CH2-CE1 3.81Å; W411-F414 AromaticContact CZ3-CD1 3.33Å; W411-F414 HydrophobicContact CZ3-CD1 3.33Å; W411-F414 AromaticContact CZ3-CE1 3.66Å; W411-F414 HydrophobicContact CZ3-CE1 3.66Å; W411-F414 HydrophobicContact CZ3-CG 4.44Å; W411-F414 PolarHBondContact O-N 3.3Å; W411-I415 HydrophobicContact CD2-CD1 4.4Å; W411-I415 HydrophobicContact CZ2-CD1 4.07Å; W411-I415 WeakPolarHBondContact O-CG1 3.5Å; W411-I415 PolarHBondContact O-N 3.27Å
412	H	52.4	Low	51.9	Low	84 Å²	84	107.1 Å²	107.1	39%	0.389	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-49	171.6	-111	-72.6	0	0	0	112.4	D408 Q409 V410 F414 I415 Y416	D408-H412 VanDerWaalsContact O-CB 3.32Å; D408-H412 WeakPolarHBondContact O-CB 3.45Å; D408-H412 PolarHBondContact O-N 3.45Å; Q409-H412 CarbonylContact O-C 3.52Å; Q409-H412 WeakPolarHBondContact O-CA 3.47Å; Q409-H412 VanDerWaalsContact O-CB 3.29Å; Q409-H412 WeakPolarHBondContact O-CB 3.39Å; Q409-H412 PolarHBondContact O-N 2.8Å; V410-H412 VanDerWaalsContact C-N 3.33Å; H412-F414 VanDerWaalsContact C-N 3.27Å; H412-F414 PolarHBondContact O-N 3.34Å; H412-I415 PolarHBondContact O-N 3.09Å; H412-Y416 AromaticContact ND1-CD2 3.95Å; H412-Y416 WeakPolarHBondContact O-CD2 3.35Å; H412-Y416 PolarHBondContact O-N 2.94Å
413	D	64	Low	51.4	Low	88 Å²	88	107.5 Å²	107.5	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-38.2	178.4	-67.5	-11.5	0	0	0	110.2	Q409 V410 D417	Q409-D413 VanDerWaalsContact O-CG 3.25Å; Q409-D413 PolarHBondContact O-N 3.45Å; V410-D413 PolarHBondContact O-N 3.44Å; D413-D417 WeakPolarHBondContact O-CB 3.24Å; D413-D417 PolarHBondContact O-N 3.04Å
414	F	65.8	Low	50.8	Low	63 Å²	63	111.1 Å²	111.1	28%	0.276	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-47	178	172.2	-119.1	0	0	0	113.4	V410 W411 H412 Y416 Q483	V410-F414 WeakPolarHBondContact O-CB 3.37Å; V410-F414 PolarHBondContact O-N 2.88Å; W411-F414 HydrophobicContact CD2-CD1 4.36Å; W411-F414 AromaticContact CE3-CD1 3.62Å; W411-F414 HydrophobicContact CE3-CD1 3.62Å; W411-F414 HydrophobicContact CE3-CE1 4.38Å; W411-F414 HydrophobicContact CE3-CG 4.48Å; W411-F414 AromaticContact CH2-CD1 3.87Å; W411-F414 HydrophobicContact CH2-CD1 3.87Å; W411-F414 AromaticContact CH2-CE1 3.81Å; W411-F414 HydrophobicContact CH2-CE1 3.81Å; W411-F414 AromaticContact CZ3-CD1 3.33Å; W411-F414 HydrophobicContact CZ3-CD1 3.33Å; W411-F414 AromaticContact CZ3-CE1 3.66Å; W411-F414 HydrophobicContact CZ3-CE1 3.66Å; W411-F414 HydrophobicContact CZ3-CG 4.44Å; W411-F414 PolarHBondContact O-N 3.3Å; H412-F414 VanDerWaalsContact C-N 3.27Å; H412-F414 PolarHBondContact O-N 3.34Å; F414-Y416 VanDerWaalsContact C-N 3.33Å; F414-Y416 PolarHBondContact O-N 2.96Å; F414-Q483 HydrophobicContact CE1-CG 4.14Å; F414-Q483 HydrophobicContact CE2-CB 4.45Å; F414-Q483 HydrophobicContact CE2-CG 3.76Å; F414-Q483 HydrophobicContact CZ-CB 3.98Å; F414-Q483 HydrophobicContact CZ-CG 3.38Å
415	I	61	Low	50.5	Low	81 Å²	81	112.4 Å²	112.4	42%	0.415	56%	0.558	S	S	.	*	H	α-helix	trans	-71	-30.4	-176	-69	-171.5	0	0	0	111.9	W411 H412	W411-I415 HydrophobicContact CD2-CD1 4.4Å; W411-I415 HydrophobicContact CZ2-CD1 4.07Å; W411-I415 WeakPolarHBondContact O-CG1 3.5Å; W411-I415 PolarHBondContact O-N 3.27Å; H412-I415 PolarHBondContact O-N 3.09Å
416	Y	52.2	Low	49.6	Very low	129 Å²	129	119.4 Å²	119.4	51%	0.506	59%	0.586	S	S	.	*	H	α-helix	trans	-117.7	-16.6	-165.6	-64.8	-75.6	0	0	0	115.5	H412 F414 T418	H412-Y416 AromaticContact ND1-CD2 3.95Å; H412-Y416 WeakPolarHBondContact O-CD2 3.35Å; H412-Y416 PolarHBondContact O-N 2.94Å; F414-Y416 VanDerWaalsContact C-N 3.33Å; F414-Y416 PolarHBondContact O-N 2.96Å; Y416-T418 VanDerWaalsContact C-N 3.32Å; Y416-T418 PolarHBondContact O-N 3.09Å
417	D	45.2	Very low	48.9	Very low	86 Å²	86	122.6 Å²	122.6	46%	0.46	60%	0.598	S	S	.	*			trans	-80.9	80.4	179.4	-155.6	5	0	0	0	112	D413 N419	D413-D417 WeakPolarHBondContact O-CB 3.24Å; D413-D417 PolarHBondContact O-N 3.04Å; D417-N419 PolarHBondContact O-N 3.5Å; D417-N419 PolarHBondContact OD1-N 3.18Å
418	T	44.3	Very low	47.7	Very low	127 Å²	127	130.3 Å²	130.3	78%	0.779	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	3.9	168.7	52.2	0	0	0	0	113.2	Y416	Y416-T418 VanDerWaalsContact C-N 3.32Å; Y416-T418 PolarHBondContact O-N 3.09Å
419	N	43.3	Very low	46.7	Very low	126 Å²	126	133.8 Å²	133.8	67%	0.674	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	18.8	-175.9	-75	-46.7	0	0	0	114.9	D417 K421	D417-N419 PolarHBondContact O-N 3.5Å; D417-N419 PolarHBondContact OD1-N 3.18Å; N419-K421 VanDerWaalsContact C-N 3.3Å; N419-K421 PolarHBondContact O-N 3Å
420	Y	39.9	Very low	45.5	Very low	173 Å²	173	136.2 Å²	136.2	68%	0.678	65%	0.646	S	S	*	*			trans	-62.4	89.5	174.6	-164.3	-93.2	0	0	0	111.8	Q422	Y420-Q422 PolarHBondContact O-N 2.7Å
421	K	40.4	Very low	44.1	Very low	187 Å²	187	141.3 Å²	141.3	81%	0.813	66%	0.664	S	S	*	*			trans	-67.6	111.8	168.8	-73.4	-177.5	180	176.6	0	107.1	N419 T423	N419-K421 VanDerWaalsContact C-N 3.3Å; N419-K421 PolarHBondContact O-N 3Å; K421-T423 PolarHBondContact O-N 3.35Å
422	Q	39	Very low	43.6	Very low	144 Å²	144	143.4 Å²	143.4	67%	0.673	68%	0.684	S	S	*	*			trans	-49.3	102.8	173.8	-68.2	176.2	12.6	0	0	111	Y420 K424	Y420-Q422 PolarHBondContact O-N 2.7Å; Q422-K424 PolarHBondContact O-N 3.18Å; Q422-K424 VanDerWaalsContact O-N 3.14Å
423	T	38.5	Very low	42.6	Very low	105 Å²	105	143.1 Å²	143.1	64%	0.644	70%	0.704	S	S	*	*			trans	-68.3	102.9	157.1	35.2	0	0	0	0	107.1	K421 T425	K421-T423 PolarHBondContact O-N 3.35Å; T423-T425 PolarHBondContact O-N 3.48Å
424	K	37.1	Very low	41.3	Very low	189 Å²	189	144 Å²	144	82%	0.822	72%	0.717	S	S	*	*			trans	-65.2	96.1	171.8	-73.5	-179.2	177.3	177.4	0	109.4	Q422	Q422-K424 PolarHBondContact O-N 3.18Å; Q422-K424 VanDerWaalsContact O-N 3.14Å
425	T	40.3	Very low	40	Very low	127 Å²	127	146.3 Å²	146.3	78%	0.779	74%	0.736	S	S	*	*			trans	-86	110.5	160.5	39	0	0	0	0	109	T423 F427	T423-T425 PolarHBondContact O-N 3.48Å; T425-F427 PolarHBondContact O-N 3.15Å
426	K	34.4	Very low	39	Very low	196 Å²	196	149.5 Å²	149.5	85%	0.852	75%	0.754	S	S	*	*			trans	-70.9	116.8	170.6	-69.5	174.4	175.9	175.8	0	108.7
427	F	37	Very low	38.4	Very low	195 Å²	195	148.1 Å²	148.1	86%	0.855	76%	0.763	S	S	*	*			trans	-138.3	97.5	156.2	-92.4	-79.9	0	0	0	111.7	T425	T425-F427 PolarHBondContact O-N 3.15Å
428	R	32.7	Very low	38.2	Very low	216 Å²	216	151.3 Å²	151.3	82%	0.815	78%	0.78	S	S	*	*			trans	7.5	107	142	-163.8	173.9	-170.1	169.6	1.2	116.9
429	N	31.9	Very low	37.9	Very low	164 Å²	164	152 Å²	152	88%	0.877	78%	0.779	S	S	*	*			trans	-70.3	131.4	162.2	-78.2	-25.3	0	0	0	110.9
430	Q	38.3	Very low	37.7	Very low	162 Å²	162	150.9 Å²	150.9	76%	0.757	78%	0.781	S	S	*	*			trans	-129.5	112.4	152.3	-72.3	-175.1	45.2	0	0	106.4
431	Q	38.6	Very low	37.7	Very low	196 Å²	196	149.8 Å²	149.8	92%	0.916	79%	0.786	S	S	*	*			trans	-157.6	129.5	143.5	-113.9	174.2	9.5	0	0	111.2
432	L	38.7	Very low	37.6	Very low	174 Å²	174	149.4 Å²	149.4	91%	0.911	79%	0.787	S	S	*	*			trans	-62.5	150.5	-175.4	-70.7	133.4	0	0	0	115.3
433	G	32.5	Very low	37.7	Very low	78 Å²	78	148.8 Å²	148.8	80%	0.804	80%	0.798	S	S	*	*			trans	75.8	136.3	150.8	0	0	0	0	0	115.8
434	S	37.3	Very low	37.6	Very low	107 Å²	107	146.6 Å²	146.6	75%	0.748	80%	0.797	S	S	*	*			cis	-164.8	130.9	16.6	-144.5	0	0	0	0	109.3
435	T	37.2	Very low	37.7	Very low	110 Å²	110	144.1 Å²	144.1	68%	0.675	80%	0.797	S	S	*	*			trans	39.8	122.3	139	63.9	0	0	0	0	123.4
436	N	40.4	Very low	37.7	Very low	148 Å²	148	145.2 Å²	145.2	79%	0.791	80%	0.798	S	S	*	*				115	123.9	121.2	-70.8	-8.2	0	0	0	122
437	S	38.7	Very low	37.9	Very low	101 Å²	101	141 Å²	141	71%	0.706	79%	0.793	S	S	*	*			trans	93.1	107.7	145.1	83.6	0	0	0	0	118.4
438	L	41.8	Very low	38	Very low	153 Å²	153	135.4 Å²	135.4	80%	0.801	78%	0.778	S	S	*	*				80	115.1	93.8	-74.7	170.1	0	0	0	110.9
439	N	38.4	Very low	38.4	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	77%	0.773	S	S	*	*				-176.5	138.8	61	-79.1	-43.2	0	0	0	106.8
440	S	38.4	Very low	38.9	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	76%	0.76	S	S	*	*				97.1	137	59	-168.2	0	0	0	0	114.5
441	L	39.7	Very low	38.9	Very low	150 Å²	150	133.2 Å²	133.2	79%	0.785	76%	0.763	S	S	*	*			trans	91	103.6	166.8	-57.9	163.5	0	0	0	117.6
442	Q	39.6	Very low	38.8	Very low	178 Å²	178	129.6 Å²	129.6	83%	0.832	76%	0.758	S	S	*	*				76.8	118	61.7	-84	-168.8	-22.7	0	0	116.5
443	S	39.5	Very low	39	Very low	131 Å²	131	126.7 Å²	126.7	92%	0.916	75%	0.749	S	S	*	*			trans	167.5	129.3	141.4	-71.2	0	0	0	0	107.4
444	G	37.1	Very low	39.6	Very low	60 Å²	60	129.9 Å²	129.9	62%	0.619	75%	0.754	S	S	*	*			cis	129.9	110.7	9.5	0	0	0	0	0	109.7
445	T	40.2	Very low	39.8	Very low	136 Å²	136	130.5 Å²	130.5	83%	0.834	76%	0.755	S	S	*	*			trans	68.6	147.6	145.3	54.3	0	0	0	0	120.8
446	L	39	Very low	39.7	Very low	151 Å²	151	130.7 Å²	130.7	79%	0.791	76%	0.761	S	S	*	*			cis	-169.7	153.2	12.6	-106	154.3	0	0	0	112.2
447	S	38.2	Very low	39.7	Very low	107 Å²	107	129.2 Å²	129.2	75%	0.748	76%	0.762	S	S	*	*			trans	56.1	152	136.1	-127.7	0	0	0	0	122.6
448	S	40.2	Very low	39.7	Very low	78 Å²	78	128.8 Å²	128.8	55%	0.545	76%	0.759	S	S	.	*			cis	-166.8	148	3.9	-145.3	0	0	0	0	110.7
449	E	40.5	Very low	39.6	Very low	150 Å²	150	128.4 Å²	128.4	70%	0.701	76%	0.756	S	S	*	*			trans	50.6	151.2	135.7	-70	174.8	124.7	0	0	122.8
450	Q	43.5	Very low	39.7	Very low	129 Å²	129	130 Å²	130	60%	0.603	76%	0.761	S	S	*	*			cis	-172.4	152.3	10.4	-118.4	167.1	16.2	0	0	110.2
451	R	38.2	Very low	39.8	Very low	216 Å²	216	134.5 Å²	134.5	82%	0.815	77%	0.768	S	S	*	*			trans	54.4	153.1	150.1	-70.5	177.3	-173.5	166.4	3.9	121.1
452	C	35.1	Very low	39.6	Very low	121 Å²	121	133 Å²	133	82%	0.818	77%	0.77	S	S	*	*			cis	-176.6	160.4	-24.3	-100.2	0	0	0	0	105.6
453	P	43.5	Very low	39.2	Very low	113 Å²	113	133.7 Å²	133.7	73%	0.734	77%	0.773	S	S	*	*			trans	-114.6	163.4	-163.2	39.5	-28.8	0	0	0	115.9
454	T	44.6	Very low	39.1	Very low	145 Å²	145	132.9 Å²	132.9	89%	0.89	77%	0.767	S	S	*	*			trans	-175.9	153.6	140.5	27	0	0	0	0	113
455	P	41.4	Very low	39	Very low	119 Å²	119	138.1 Å²	138.1	77%	0.773	78%	0.78	S	S	*	*			trans	-116.7	163.3	-166.8	40.5	-27.8	0	0	0	115.7
456	S	36.4	Very low	38.8	Very low	115 Å²	115	138.4 Å²	138.4	80%	0.804	78%	0.776	S	S	*	*			trans	176.2	136.7	142	-116.8	0	0	0	0	115.7
457	S	39.5	Very low	38.5	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	78%	0.775	S	S	*	*			trans	68.3	146.9	154.5	89.8	0	0	0	0	118
458	S	38.4	Very low	38.1	Very low	92 Å²	92	143.4 Å²	143.4	64%	0.643	79%	0.786	S	S	*	*			cis	-169.1	163.2	-12.9	63.6	0	0	0	0	107.7
459	I	41.1	Very low	37.9	Very low	146 Å²	146	145 Å²	145	75%	0.749	79%	0.792	S	S	*	*			trans	91	105.7	155	-61.2	162.9	0	0	0	119.3
460	M	40.4	Very low	37.5	Very low	174 Å²	174	147 Å²	147	86%	0.857	80%	0.799	S	S	*	*			trans	58.1	106.6	141.3	-70.5	-176.1	150	0	0	121.1
461	K	39.4	Very low	37.1	Very low	198 Å²	198	150.7 Å²	150.7	86%	0.861	81%	0.813	S	S	*	*				-178.3	124.5	110.1	-97.6	166.6	-176	178.1	0	112.2
462	S	36.1	Very low	36.6	Very low	117 Å²	117	143.6 Å²	143.6	82%	0.818	81%	0.807	S	S	*	*			trans	46.1	118.1	147.6	44.2	0	0	0	0	120.8
463	Q	31.8	Very low	36.5	Very low	194 Å²	194	143.5 Å²	143.5	91%	0.907	80%	0.798	S	S	*	*			trans	-66.8	133.7	-177.8	-64.8	162.6	-24.5	0	0	114
464	S	37.3	Very low	36.4	Very low	114 Å²	114	146.4 Å²	146.4	80%	0.797	80%	0.802	S	S	*	*			trans	-152.4	105.9	152.2	-81.2	0	0	0	0	110.2
465	I	35	Very low	36.4	Very low	170 Å²	170	145.6 Å²	145.6	87%	0.872	79%	0.792	S	S	*	*			trans	47	106.5	147.1	-44.1	179.7	0	0	0	117.8
466	N	34.5	Very low	36.5	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	78%	0.782	S	S	*	*			trans	-66.8	138.4	173.2	-76.9	-51.1	0	0	0	114.4
467	K	33.3	Very low	36.8	Very low	179 Å²	179	145.3 Å²	145.3	78%	0.778	78%	0.778	S	S	*	*			trans	45.7	95.4	132	-63.4	176.4	177.2	175.7	0	117.9
468	L	30.5	Very low	37.1	Very low	185 Å²	185	146.4 Å²	146.4	97%	0.969	77%	0.768	S	S	*	*			trans	-95.4	102.3	150.1	-165	67.6	0	0	0	108.3
469	T	34.4	Very low	37.6	Very low	110 Å²	110	149 Å²	149	68%	0.675	77%	0.768	S	S	*	*			trans	-101.7	123.3	177.6	10.3	0	0	0	0	109.1
470	K	34.1	Very low	38.2	Very low	194 Å²	194	147.1 Å²	147.1	84%	0.843	76%	0.759	S	S	*	*			trans	11.5	111.4	151.9	-68.5	175	174.4	178.5	0	117.1
471	F	33.3	Very low	38.7	Very low	205 Å²	205	144 Å²	144	90%	0.899	74%	0.743	S	S	*	*			trans	-144.4	108.6	141	-99.1	-80.9	0	0	0	108.9
472	G	29	Very low	39.9	Very low	68 Å²	68	139.2 Å²	139.2	70%	0.701	73%	0.727	S	S	*	*			trans	-81.5	138.3	165.8	0	0	0	0	0	109.8
473	N	33.4	Very low	41.1	Very low	118 Å²	118	137.4 Å²	137.4	63%	0.631	71%	0.705	S	S	*	*			trans	-159.5	77.6	161.9	-98	-17.5	0	0	0	108.8	N475 T476	N473-N475 PolarHBondContact O-N 2.89Å; N473-T476 PolarHBondContact O-OG1 3.27Å
474	E	40.9	Very low	42.1	Very low	175 Å²	175	136.2 Å²	136.2	82%	0.818	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-6.7	169.8	-82.1	-177.4	145.2	0	0	113
475	N	44.5	Very low	43.5	Very low	127 Å²	127	134.4 Å²	134.4	68%	0.679	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-8.7	-175.8	-73.1	-16	0	0	0	114.7	N473	N473-N475 PolarHBondContact O-N 2.89Å
476	T	42.8	Very low	45.1	Very low	90 Å²	90	130.6 Å²	130.6	55%	0.552	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-28	178	47.1	0	0	0	0	113.1	N473	N473-T476 PolarHBondContact O-OG1 3.27Å
477	L	43.4	Very low	46.5	Very low	139 Å²	139	125.1 Å²	125.1	73%	0.728	63%	0.627	S	S	*	*	H	α-helix	trans	-72.1	-39.5	178.7	-116.4	88.7	0	0	0	113	K479 N480 E481	L477-K479 VanDerWaalsContact C-N 3.26Å; L477-K479 PolarHBondContact O-N 3.35Å; L477-N480 PolarHBondContact O-N 2.88Å; L477-E481 PolarHBondContact O-N 3.02Å
478	K	46.4	Very low	48	Very low	139 Å²	139	119.1 Å²	119.1	60%	0.604	60%	0.603	S	S	*	*	H	α-helix	trans	-65.9	-24.8	-178.2	-71.1	-177.7	178	176.2	0	113.8	N482	K478-N482 PolarHBondContact O-ND2 2.96Å
479	K	48.6	Very low	49.8	Very low	147 Å²	147	114.7 Å²	114.7	64%	0.639	58%	0.58	S	S	*	*	H	α-helix	trans	-74.9	-38.3	177.2	-100.7	-175.7	172.6	-173.3	0	112.5	L477 Q483	L477-K479 VanDerWaalsContact C-N 3.26Å; L477-K479 PolarHBondContact O-N 3.35Å; K479-Q483 PolarHBondContact O-N 3.36Å
480	N	52.9	Low	51.5	Low	106 Å²	106	113.6 Å²	113.6	57%	0.567	57%	0.57	S	S	*	*	H	α-helix	trans	-70.1	-33.1	176.9	-100	-0.9	0	0	0	112.7	L477 Q483 W484	L477-N480 PolarHBondContact O-N 2.88Å; N480-Q483 PolarHBondContact O-N 2.99Å; N480-W484 PolarHBondContact O-N 3.22Å
481	E	50.5	Low	53.1	Low	109 Å²	109	109.6 Å²	109.6	51%	0.509	56%	0.557	S	S	.	*	H	α-helix	trans	-69.9	-40.2	-178.7	-157.2	170.9	-163.1	0	0	112.3	L477 Q483 W484 I485	L477-E481 PolarHBondContact O-N 3.02Å; E481-Q483 PolarHBondContact O-N 2.72Å; E481-W484 PolarHBondContact O-N 3.43Å; E481-I485 WeakPolarHBondContact O-CG1 3.47Å; E481-I485 PolarHBondContact O-N 3.42Å
482	N	64.4	Low	54.6	Low	97 Å²	97	105.7 Å²	105.7	52%	0.519	54%	0.541	S	S	.	.	H	α-helix	trans	-64.4	-30.2	174.2	-70.2	-18.6	0	0	0	112.3	K478 N486	K478-N482 PolarHBondContact O-ND2 2.96Å; N482-N486 WeakPolarHBondContact O-CB 3.39Å; N482-N486 PolarHBondContact O-N 2.8Å; N482-N486 PolarHBondContact O-ND2 3.19Å; N482-N486 PolarHBondContact O-OD1 2.9Å
483	Q	61.7	Low	56.8	Low	79 Å²	79	108.1 Å²	108.1	37%	0.369	53%	0.533	S	S	.	.	H	α-helix	trans	-74	-37.4	-179	-157	158.3	1.3	0	0	112.2	F414 K479 N480 E481 N486 S487	F414-Q483 HydrophobicContact CE1-CG 4.14Å; F414-Q483 HydrophobicContact CE2-CB 4.45Å; F414-Q483 HydrophobicContact CE2-CG 3.76Å; F414-Q483 HydrophobicContact CZ-CB 3.98Å; F414-Q483 HydrophobicContact CZ-CG 3.38Å; K479-Q483 PolarHBondContact O-N 3.36Å; N480-Q483 PolarHBondContact O-N 2.99Å; E481-Q483 PolarHBondContact O-N 2.72Å; Q483-N486 PolarHBondContact O-N 3.24Å; Q483-S487 PolarHBondContact O-N 2.7Å; Q483-S487 PolarHBondContact O-OG 3.45Å; Q483-S487 VanDerWaalsContact O-OG 3.08Å
484	W	54.2	Low	58.3	Low	169 Å²	169	107.6 Å²	107.6	64%	0.64	53%	0.529	S	S	*	.	H	α-helix	trans	-67	-40.3	173.6	-179.5	74.3	0	0	0	112.7	N480 E481 N486 S487 I488	N480-W484 PolarHBondContact O-N 3.22Å; E481-W484 PolarHBondContact O-N 3.43Å; W484-N486 VanDerWaalsContact C-N 3.31Å; W484-N486 PolarHBondContact O-N 3.45Å; W484-S487 PolarHBondContact O-N 2.77Å; W484-I488 HydrophobicContact CD2-CD1 3.76Å; W484-I488 HydrophobicContact CE3-CD1 4.04Å; W484-I488 HydrophobicContact CH2-CD1 3.5Å; W484-I488 VanDerWaalsContact CH2-CD1 3.5Å; W484-I488 HydrophobicContact CZ2-CD1 3.16Å; W484-I488 HydrophobicContact CZ2-CG1 4.45Å; W484-I488 HydrophobicContact CZ3-CD1 3.91Å; W484-I488 PolarHBondContact O-N 3.22Å
485	I	65.3	Low	59.7	Low	76 Å²	76	101.7 Å²	101.7	39%	0.39	51%	0.507	S	S	.	.	H	α-helix	trans	-62.8	-41.7	174.3	-65.2	170.2	0	0	0	110.2	E481 I488 N489	E481-I485 WeakPolarHBondContact O-CG1 3.47Å; E481-I485 PolarHBondContact O-N 3.42Å; I485-I488 PolarHBondContact O-N 3.04Å; I485-N489 WeakPolarHBondContact O-CB 3.47Å; I485-N489 VanDerWaalsContact O-CG 3.25Å; I485-N489 PolarHBondContact O-N 3.03Å; I485-N489 PolarHBondContact O-ND2 2.96Å
486	N	68.9	Low	61	Low	90 Å²	90	103.2 Å²	103.2	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-47.8	174.7	-69.7	-10.2	0	0	0	111.4	N482 Q483 W484 I488 N489 D490	N482-N486 WeakPolarHBondContact O-CB 3.39Å; N482-N486 PolarHBondContact O-N 2.8Å; N482-N486 PolarHBondContact O-ND2 3.19Å; N482-N486 PolarHBondContact O-OD1 2.9Å; Q483-N486 PolarHBondContact O-N 3.24Å; W484-N486 VanDerWaalsContact C-N 3.31Å; W484-N486 PolarHBondContact O-N 3.45Å; N486-I488 VanDerWaalsContact C-N 3.32Å; N486-I488 PolarHBondContact O-N 3.04Å; N486-N489 CarbonylContact O-C 3.53Å; N486-N489 WeakPolarHBondContact O-CA 3.4Å; N486-N489 WeakPolarHBondContact O-CB 3.24Å; N486-N489 PolarHBondContact O-N 3Å; N486-N489 VanDerWaalsContact O-N 3.09Å; N486-D490 WeakPolarHBondContact O-CB 3.12Å; N486-D490 PolarHBondContact O-N 2.81Å
487	S	63.4	Low	62.4	Low	25 Å²	25	103.5 Å²	103.5	18%	0.175	50%	0.503	C	S	.	.	H	α-helix	trans	-61.4	-36.8	177.6	-59	0	0	0	0	113.3	Q483 W484 D490 I491	Q483-S487 PolarHBondContact O-N 2.7Å; Q483-S487 PolarHBondContact O-OG 3.45Å; Q483-S487 VanDerWaalsContact O-OG 3.08Å; W484-S487 PolarHBondContact O-N 2.77Å; S487-D490 PolarHBondContact O-N 3.03Å; S487-I491 VanDerWaalsContact O-CG1 3.25Å; S487-I491 WeakPolarHBondContact O-CG1 3.46Å; S487-I491 PolarHBondContact O-N 2.57Å
488	I	64.6	Low	63.7	Low	54 Å²	54	100.4 Å²	100.4	28%	0.277	49%	0.49	S	S	.	.	H	α-helix	trans	-67.2	-42.2	173.9	-76.2	-179.1	0	0	0	111.1	W484 I485 N486 D490 I491 H492	W484-I488 HydrophobicContact CD2-CD1 3.76Å; W484-I488 HydrophobicContact CE3-CD1 4.04Å; W484-I488 HydrophobicContact CH2-CD1 3.5Å; W484-I488 VanDerWaalsContact CH2-CD1 3.5Å; W484-I488 HydrophobicContact CZ2-CD1 3.16Å; W484-I488 HydrophobicContact CZ2-CG1 4.45Å; W484-I488 HydrophobicContact CZ3-CD1 3.91Å; W484-I488 PolarHBondContact O-N 3.22Å; I485-I488 PolarHBondContact O-N 3.04Å; N486-I488 VanDerWaalsContact C-N 3.32Å; N486-I488 PolarHBondContact O-N 3.04Å; I488-D490 VanDerWaalsContact C-N 3.28Å; I488-D490 PolarHBondContact O-N 2.67Å; I488-I491 PolarHBondContact O-N 3Å; I488-H492 WeakPolarHBondContact O-CB 3.21Å; I488-H492 PolarHBondContact O-CD2 3.5Å; I488-H492 VanDerWaalsContact O-CD2 3.26Å; I488-H492 PolarHBondContact O-N 3.09Å
489	N	69.3	Low	64.7	Low	91 Å²	91	98.4 Å²	98.4	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-36.9	174.6	-71.8	-29.5	0	0	0	111.3	I485 N486 H492 K493	I485-N489 WeakPolarHBondContact O-CB 3.47Å; I485-N489 VanDerWaalsContact O-CG 3.25Å; I485-N489 PolarHBondContact O-N 3.03Å; I485-N489 PolarHBondContact O-ND2 2.96Å; N486-N489 CarbonylContact O-C 3.53Å; N486-N489 WeakPolarHBondContact O-CA 3.4Å; N486-N489 WeakPolarHBondContact O-CB 3.24Å; N486-N489 PolarHBondContact O-N 3Å; N486-N489 VanDerWaalsContact O-N 3.09Å; N489-H492 PolarHBondContact O-N 3.3Å; N489-K493 WeakPolarHBondContact O-CB 3.45Å; N489-K493 PolarHBondContact O-N 2.91Å
490	D	70.5	Confident	66.1	Low	87 Å²	87	95.1 Å²	95.1	47%	0.465	48%	0.481	S	S	.	.	H	α-helix	trans	-67.2	-42.6	175.7	-64.2	-27.9	0	0	0	111.2	N486 S487 I488 K493 L494	N486-D490 WeakPolarHBondContact O-CB 3.12Å; N486-D490 PolarHBondContact O-N 2.81Å; S487-D490 PolarHBondContact O-N 3.03Å; I488-D490 VanDerWaalsContact C-N 3.28Å; I488-D490 PolarHBondContact O-N 2.67Å; D490-K493 PolarHBondContact O-N 3.41Å; D490-L494 WeakPolarHBondContact O-CB 3.15Å; D490-L494 WeakPolarHBondContact O-CG 3.06Å; D490-L494 PolarHBondContact O-N 2.94Å
491	I	67.3	Low	67.2	Low	111 Å²	111	96.4 Å²	96.4	57%	0.569	48%	0.483	S	S	*	.	H	α-helix	trans	-63	-44.6	173.4	-68.9	163.7	0	0	0	111	S487 I488 K493 L494 S495	S487-I491 VanDerWaalsContact O-CG1 3.25Å; S487-I491 WeakPolarHBondContact O-CG1 3.46Å; S487-I491 PolarHBondContact O-N 2.57Å; I488-I491 PolarHBondContact O-N 3Å; I491-K493 VanDerWaalsContact C-N 3.32Å; I491-K493 PolarHBondContact O-N 3.46Å; I491-L494 PolarHBondContact O-N 3.45Å; I491-S495 WeakPolarHBondContact O-CB 3.42Å; I491-S495 PolarHBondContact O-N 3.41Å
492	H	65.4	Low	68.2	Low	122 Å²	122	94.9 Å²	94.9	57%	0.565	48%	0.478	S	S	*	.	H	α-helix	trans	-64.1	-38.7	176	-86.9	-70.6	0	0	0	111.6	I488 N489 S495 K496	I488-H492 WeakPolarHBondContact O-CB 3.21Å; I488-H492 PolarHBondContact O-CD2 3.5Å; I488-H492 VanDerWaalsContact O-CD2 3.26Å; I488-H492 PolarHBondContact O-N 3.09Å; N489-H492 PolarHBondContact O-N 3.3Å; H492-S495 WeakPolarHBondContact CA-OG 3.26Å; H492-S495 PolarHBondContact O-N 3.47Å; H492-S495 PolarHBondContact O-OG 3Å; H492-K496 WeakPolarHBondContact O-CB 3.35Å; H492-K496 PolarHBondContact O-N 3.31Å
493	K	74.3	Confident	68.6	Low	120 Å²	120	94 Å²	94	52%	0.522	48%	0.476	S	S	.	.	H	α-helix	trans	-64.3	-48.7	175.2	-176.2	-178.7	168.8	-167.4	0	111.1	N489 D490 I491 S495 K496 E497	N489-K493 WeakPolarHBondContact O-CB 3.45Å; N489-K493 PolarHBondContact O-N 2.91Å; D490-K493 PolarHBondContact O-N 3.41Å; I491-K493 VanDerWaalsContact C-N 3.32Å; I491-K493 PolarHBondContact O-N 3.46Å; K493-S495 VanDerWaalsContact C-N 3.34Å; K493-S495 PolarHBondContact O-N 2.96Å; K493-K496 CarbonylContact O-C 3.47Å; K493-K496 WeakPolarHBondContact O-CB 3.35Å; K493-K496 PolarHBondContact O-N 3.3Å; K493-E497 WeakPolarHBondContact CE-OE1 3.44Å; K493-E497 HydrophobicContact CG-CG 4.5Å; K493-E497 IonicContact NZ-OE1 2.97Å; K493-E497 WeakPolarHBondContact O-CB 3.45Å; K493-E497 WeakPolarHBondContact O-CG 3.16Å; K493-E497 PolarHBondContact O-N 2.93Å
494	L	65.7	Low	69.4	Low	107 Å²	107	95.8 Å²	95.8	56%	0.56	48%	0.484	S	S	*	.	H	α-helix	trans	-58.3	-43.1	174	-76.9	165.2	0	0	0	111.8	D490 I491 K496 E497 T498	D490-L494 WeakPolarHBondContact O-CB 3.15Å; D490-L494 WeakPolarHBondContact O-CG 3.06Å; D490-L494 PolarHBondContact O-N 2.94Å; I491-L494 PolarHBondContact O-N 3.45Å; L494-K496 VanDerWaalsContact C-N 3.27Å; L494-K496 PolarHBondContact O-N 3.04Å; L494-E497 PolarHBondContact O-N 3.18Å; L494-T498 WeakPolarHBondContact O-CB 3.48Å; L494-T498 WeakPolarHBondContact O-CG2 3.22Å; L494-T498 PolarHBondContact O-N 3.42Å; L494-T498 PolarHBondContact O-OG1 3.47Å
495	S	69.3	Low	70.4	Confident	50 Å²	50	92.9 Å²	92.9	35%	0.35	48%	0.478	S	S	.	.	H	α-helix	trans	-64.1	-33.4	175.9	78.5	0	0	0	0	112.4	I491 H492 K493 T498 L499	I491-S495 WeakPolarHBondContact O-CB 3.42Å; I491-S495 PolarHBondContact O-N 3.41Å; H492-S495 WeakPolarHBondContact CA-OG 3.26Å; H492-S495 PolarHBondContact O-N 3.47Å; H492-S495 PolarHBondContact O-OG 3Å; K493-S495 VanDerWaalsContact C-N 3.34Å; K493-S495 PolarHBondContact O-N 2.96Å; S495-T498 VanDerWaalsContact CA-OG1 3.31Å; S495-T498 WeakPolarHBondContact CA-OG1 3.36Å; S495-T498 PolarHBondContact O-OG1 3.3Å; S495-T498 VanDerWaalsContact O-OG1 3.08Å; S495-L499 WeakPolarHBondContact O-CB 3.32Å; S495-L499 WeakPolarHBondContact O-CD1 3.46Å; S495-L499 WeakPolarHBondContact O-CG 3.4Å; S495-L499 PolarHBondContact O-N 2.91Å; S495-L499 VanDerWaalsContact O-N 3.13Å
496	K	71.4	Confident	70.7	Confident	159 Å²	159	91.6 Å²	91.6	69%	0.691	47%	0.471	S	S	*	.	H	α-helix	trans	-77.9	-38.7	178.5	-172.6	-179.5	176.3	-174.2	0	111.4	H492 K493 L494 S500	H492-K496 WeakPolarHBondContact O-CB 3.35Å; H492-K496 PolarHBondContact O-N 3.31Å; K493-K496 CarbonylContact O-C 3.47Å; K493-K496 WeakPolarHBondContact O-CB 3.35Å; K493-K496 PolarHBondContact O-N 3.3Å; L494-K496 VanDerWaalsContact C-N 3.27Å; L494-K496 PolarHBondContact O-N 3.04Å; K496-S500 VanDerWaalsContact O-CB 3.3Å; K496-S500 WeakPolarHBondContact O-CB 3.42Å; K496-S500 PolarHBondContact O-N 2.88Å
497	E	73.1	Confident	71	Confident	97 Å²	97	92 Å²	92	45%	0.453	47%	0.471	S	S	.	.	H	α-helix	trans	-65.4	-49.6	174.9	-76.7	172.1	174.2	0	0	110.6	K493 L494 L499 S500 E501	K493-E497 WeakPolarHBondContact CE-OE1 3.44Å; K493-E497 HydrophobicContact CG-CG 4.5Å; K493-E497 IonicContact NZ-OE1 2.97Å; K493-E497 WeakPolarHBondContact O-CB 3.45Å; K493-E497 WeakPolarHBondContact O-CG 3.16Å; K493-E497 PolarHBondContact O-N 2.93Å; L494-E497 PolarHBondContact O-N 3.18Å; E497-L499 VanDerWaalsContact C-N 3.32Å; E497-L499 PolarHBondContact O-N 3.28Å; E497-S500 CarbonylContact O-C 3.57Å; E497-S500 WeakPolarHBondContact O-CA 3.43Å; E497-S500 WeakPolarHBondContact O-CB 3.3Å; E497-S500 PolarHBondContact O-N 3.32Å; E497-E501 WeakPolarHBondContact O-CB 3.25Å; E497-E501 PolarHBondContact O-N 3.15Å
498	T	70.2	Confident	71.7	Confident	73 Å²	73	93.2 Å²	93.2	45%	0.448	48%	0.477	S	S	.	.	H	α-helix	trans	-58.8	-40.3	174.3	43.5	0	0	0	0	112.8	L494 S495 L502	L494-T498 WeakPolarHBondContact O-CB 3.48Å; L494-T498 WeakPolarHBondContact O-CG2 3.22Å; L494-T498 PolarHBondContact O-N 3.42Å; L494-T498 PolarHBondContact O-OG1 3.47Å; S495-T498 VanDerWaalsContact CA-OG1 3.31Å; S495-T498 WeakPolarHBondContact CA-OG1 3.36Å; S495-T498 PolarHBondContact O-OG1 3.3Å; S495-T498 VanDerWaalsContact O-OG1 3.08Å; T498-L502 WeakPolarHBondContact O-CB 3.38Å; T498-L502 PolarHBondContact O-N 3.13Å
499	L	68.5	Low	72.1	Confident	98 Å²	98	96.4 Å²	96.4	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-39.5	172.6	-75.9	171.6	0	0	0	112.4	S495 E497 E501 V503	S495-L499 WeakPolarHBondContact O-CB 3.32Å; S495-L499 WeakPolarHBondContact O-CD1 3.46Å; S495-L499 WeakPolarHBondContact O-CG 3.4Å; S495-L499 PolarHBondContact O-N 2.91Å; S495-L499 VanDerWaalsContact O-N 3.13Å; E497-L499 VanDerWaalsContact C-N 3.32Å; E497-L499 PolarHBondContact O-N 3.28Å; L499-E501 VanDerWaalsContact C-N 3.34Å; L499-V503 VanDerWaalsContact O-CG2 3.23Å; L499-V503 WeakPolarHBondContact O-CG2 3.45Å; L499-V503 PolarHBondContact O-N 3.31Å
500	S	76.7	Confident	72	Confident	78 Å²	78	97.1 Å²	97.1	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-65.2	-39.8	177.3	-167.7	0	0	0	0	111.6	K496 E497 V503 H504	K496-S500 VanDerWaalsContact O-CB 3.3Å; K496-S500 WeakPolarHBondContact O-CB 3.42Å; K496-S500 PolarHBondContact O-N 2.88Å; E497-S500 CarbonylContact O-C 3.57Å; E497-S500 WeakPolarHBondContact O-CA 3.43Å; E497-S500 WeakPolarHBondContact O-CB 3.3Å; E497-S500 PolarHBondContact O-N 3.32Å; S500-V503 PolarHBondContact O-N 3.38Å; S500-H504 WeakPolarHBondContact O-CB 3.41Å; S500-H504 PolarHBondContact O-N 3.47Å
501	E	75.9	Confident	72.2	Confident	132 Å²	132	98 Å²	98	62%	0.617	50%	0.496	S	S	*	.	H	α-helix	trans	-68.8	-43	177.9	-169.4	167.8	-151.3	0	0	111.3	E497 L499 V503 H504 Q505	E497-E501 WeakPolarHBondContact O-CB 3.25Å; E497-E501 PolarHBondContact O-N 3.15Å; L499-E501 VanDerWaalsContact C-N 3.34Å; E501-V503 VanDerWaalsContact C-N 3.32Å; E501-V503 PolarHBondContact O-N 3.26Å; E501-H504 PolarHBondContact O-N 3.22Å; E501-Q505 WeakPolarHBondContact O-CB 3.26Å; E501-Q505 PolarHBondContact O-N 3.05Å
502	L	71.1	Confident	72.6	Confident	77 Å²	77	98.5 Å²	98.5	40%	0.403	50%	0.495	S	S	.	.	H	α-helix	trans	-58.9	-41.6	171.2	-108.7	133.9	0	0	0	112.3	T498 I506	T498-L502 WeakPolarHBondContact O-CB 3.38Å; T498-L502 PolarHBondContact O-N 3.13Å; L502-I506 WeakPolarHBondContact O-CD1 3.5Å; L502-I506 VanDerWaalsContact O-CG1 3.22Å; L502-I506 WeakPolarHBondContact O-CG1 3.46Å; L502-I506 PolarHBondContact O-N 3.02Å; L502-I506 VanDerWaalsContact O-N 3.16Å
503	V	74.2	Confident	72.4	Confident	80 Å²	80	99.1 Å²	99.1	49%	0.485	50%	0.498	S	S	.	.	H	α-helix	trans	-64.4	-44.9	175.9	168.8	0	0	0	0	110.7	L499 S500 E501 I506 E507	L499-V503 VanDerWaalsContact O-CG2 3.23Å; L499-V503 WeakPolarHBondContact O-CG2 3.45Å; L499-V503 PolarHBondContact O-N 3.31Å; S500-V503 PolarHBondContact O-N 3.38Å; E501-V503 VanDerWaalsContact C-N 3.32Å; E501-V503 PolarHBondContact O-N 3.26Å; V503-I506 PolarHBondContact O-N 2.71Å; V503-E507 WeakPolarHBondContact O-CG 3.04Å; V503-E507 PolarHBondContact O-N 3.49Å
504	H	77	Confident	72.1	Confident	115 Å²	115	96.7 Å²	96.7	53%	0.532	49%	0.493	S	S	.	.	H	α-helix	trans	-67.7	-38	-179.3	-152.9	45.1	0	0	0	112.4	S500 E501 I506 E507 V508	S500-H504 WeakPolarHBondContact O-CB 3.41Å; S500-H504 PolarHBondContact O-N 3.47Å; E501-H504 PolarHBondContact O-N 3.22Å; H504-I506 VanDerWaalsContact C-N 3.29Å; H504-I506 PolarHBondContact O-N 3.09Å; H504-E507 IonicContact CE1-OE2 2.65Å; H504-E507 IonicContact ND1-OE2 2.72Å; H504-E507 PolarHBondContact ND1-OE2 3.44Å; H504-E507 PolarHBondContact O-N 3.26Å; H504-V508 WeakPolarHBondContact O-CG2 3.35Å; H504-V508 PolarHBondContact O-N 2.88Å
505	Q	76.4	Confident	72.1	Confident	108 Å²	108	96.8 Å²	96.8	51%	0.505	49%	0.493	S	S	.	.	H	α-helix	trans	-60.2	-40.6	173.3	-173.8	65.8	22	0	0	111.5	E501 V508 E509	E501-Q505 WeakPolarHBondContact O-CB 3.26Å; E501-Q505 PolarHBondContact O-N 3.05Å; Q505-V508 PolarHBondContact O-N 3.4Å; Q505-E509 WeakPolarHBondContact O-CG 3.39Å; Q505-E509 PolarHBondContact O-N 3.35Å
506	I	70.2	Confident	72.1	Confident	50 Å²	50	100.8 Å²	100.8	26%	0.256	51%	0.505	S	S	.	.	H	α-helix	trans	-66	-42.8	176.4	-69	165.4	0	0	0	111	L502 V503 H504 E509 M510 L557 I561	L502-I506 WeakPolarHBondContact O-CD1 3.5Å; L502-I506 VanDerWaalsContact O-CG1 3.22Å; L502-I506 WeakPolarHBondContact O-CG1 3.46Å; L502-I506 PolarHBondContact O-N 3.02Å; L502-I506 VanDerWaalsContact O-N 3.16Å; V503-I506 PolarHBondContact O-N 2.71Å; H504-I506 VanDerWaalsContact C-N 3.29Å; H504-I506 PolarHBondContact O-N 3.09Å; I506-E509 PolarHBondContact O-N 3.39Å; I506-M510 HydrophobicContact CG2-SD 4.43Å; I506-M510 WeakPolarHBondContact O-CG 3.47Å; I506-M510 PolarHBondContact O-N 2.76Å; I506-L557 HydrophobicContact CG2-CD1 3.98Å; I506-I561 HydrophobicContact CD1-CG1 4.36Å
507	E	75.7	Confident	71.5	Confident	99 Å²	99	96.4 Å²	96.4	46%	0.463	49%	0.487	S	S	.	.	H	α-helix	trans	-59.2	-46.4	175.1	-72.4	173.5	165.1	0	0	111.4	V503 H504 E509 M510 D511	V503-E507 WeakPolarHBondContact O-CG 3.04Å; V503-E507 PolarHBondContact O-N 3.49Å; H504-E507 IonicContact CE1-OE2 2.65Å; H504-E507 IonicContact ND1-OE2 2.72Å; H504-E507 PolarHBondContact ND1-OE2 3.44Å; H504-E507 PolarHBondContact O-N 3.26Å; E507-E509 PolarHBondContact O-N 3.49Å; E507-M510 WeakPolarHBondContact O-CB 3.31Å; E507-M510 PolarHBondContact O-N 3.43Å; E507-D511 PolarHBondContact O-N 2.82Å
508	V	77.7	Confident	71	Confident	50 Å²	50	94.4 Å²	94.4	30%	0.303	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-39.8	178.2	171.4	0	0	0	0	112	H504 Q505 D511 K512	H504-V508 WeakPolarHBondContact O-CG2 3.35Å; H504-V508 PolarHBondContact O-N 2.88Å; Q505-V508 PolarHBondContact O-N 3.4Å; V508-D511 PolarHBondContact O-N 3.45Å; V508-K512 HydrophobicContact CG1-CD 4.35Å; V508-K512 WeakPolarHBondContact O-CG 3.44Å; V508-K512 PolarHBondContact O-N 2.8Å; V508-K512 VanDerWaalsContact O-N 3.12Å
509	E	73.9	Confident	70.3	Confident	120 Å²	120	97.1 Å²	97.1	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-67.7	-35.7	174.8	-72	-151.3	155.7	0	0	112.5	Q505 I506 E507 K512 E513	Q505-E509 WeakPolarHBondContact O-CG 3.39Å; Q505-E509 PolarHBondContact O-N 3.35Å; I506-E509 PolarHBondContact O-N 3.39Å; E507-E509 PolarHBondContact O-N 3.49Å; E509-K512 PolarHBondContact O-N 3.44Å; E509-E513 PolarHBondContact O-N 2.66Å
510	M	66.7	Low	69.7	Low	106 Å²	106	97.8 Å²	97.8	52%	0.522	49%	0.494	S	S	.	.	H	α-helix	trans	-63.1	-42	173.8	-78	-173.9	52.2	0	0	112.5	I506 E507 E513 T514	I506-M510 HydrophobicContact CG2-SD 4.43Å; I506-M510 WeakPolarHBondContact O-CG 3.47Å; I506-M510 PolarHBondContact O-N 2.76Å; E507-M510 WeakPolarHBondContact O-CB 3.31Å; E507-M510 PolarHBondContact O-N 3.43Å; M510-E513 PolarHBondContact O-N 3.43Å; M510-T514 WeakPolarHBondContact O-CB 3.4Å; M510-T514 WeakPolarHBondContact O-CG2 3.44Å; M510-T514 PolarHBondContact O-N 2.72Å; M510-T514 PolarHBondContact O-OG1 3.5Å
511	D	75.2	Confident	68.5	Low	105 Å²	105	100.4 Å²	100.4	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-66.6	-38.1	177.2	-74.1	-13.8	0	0	0	111.6	E507 V508 T514 L515	E507-D511 PolarHBondContact O-N 2.82Å; V508-D511 PolarHBondContact O-N 3.45Å; D511-T514 VanDerWaalsContact CA-OG1 3.31Å; D511-T514 WeakPolarHBondContact CA-OG1 3.42Å; D511-T514 PolarHBondContact O-OG1 2.95Å; D511-L515 WeakPolarHBondContact O-CB 3.03Å; D511-L515 WeakPolarHBondContact O-CD1 3.48Å; D511-L515 WeakPolarHBondContact O-CG 3.36Å; D511-L515 PolarHBondContact O-N 3.15Å; D511-L515 VanDerWaalsContact O-N 3.09Å
512	K	76.2	Confident	67.3	Low	122 Å²	122	100.9 Å²	100.9	53%	0.53	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-40	174.8	-73.7	174.5	-176.3	172.1	0	112.7	V508 E509 K516	V508-K512 HydrophobicContact CG1-CD 4.35Å; V508-K512 WeakPolarHBondContact O-CG 3.44Å; V508-K512 PolarHBondContact O-N 2.8Å; V508-K512 VanDerWaalsContact O-N 3.12Å; E509-K512 PolarHBondContact O-N 3.44Å; K512-K516 WeakPolarHBondContact O-CG 3.41Å; K512-K516 PolarHBondContact O-N 2.83Å
513	E	61.7	Low	66.4	Low	136 Å²	136	102.3 Å²	102.3	64%	0.636	51%	0.514	S	S	*	.	H	α-helix	trans	-72.7	-38.2	177	-95.1	-166.6	159.9	0	0	112.8	E509 M510 L515 K516 E517	E509-E513 PolarHBondContact O-N 2.66Å; M510-E513 PolarHBondContact O-N 3.43Å; E513-L515 VanDerWaalsContact C-N 3.32Å; E513-L515 PolarHBondContact O-N 3.49Å; E513-K516 PolarHBondContact O-N 3.18Å; E513-E517 WeakPolarHBondContact O-CB 3.48Å; E513-E517 PolarHBondContact O-N 3.43Å
514	T	67.3	Low	65.2	Low	68 Å²	68	103.9 Å²	103.9	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-36.7	176.5	45.6	0	0	0	0	112	M510 D511 E517 S518	M510-T514 WeakPolarHBondContact O-CB 3.4Å; M510-T514 WeakPolarHBondContact O-CG2 3.44Å; M510-T514 PolarHBondContact O-N 2.72Å; M510-T514 PolarHBondContact O-OG1 3.5Å; D511-T514 VanDerWaalsContact CA-OG1 3.31Å; D511-T514 WeakPolarHBondContact CA-OG1 3.42Å; D511-T514 PolarHBondContact O-OG1 2.95Å; T514-E517 PolarHBondContact O-N 2.72Å; T514-S518 WeakPolarHBondContact O-CB 3.42Å; T514-S518 PolarHBondContact O-N 3.44Å; T514-S518 PolarHBondContact O-OG 3.33Å
515	L	66.4	Low	63.5	Low	109 Å²	109	109.6 Å²	109.6	57%	0.571	54%	0.541	S	S	*	.	H	α-helix	trans	-60.2	-49.6	170	-77.8	164.7	0	0	0	111.5	D511 E513 E517 S518 E519	D511-L515 WeakPolarHBondContact O-CB 3.03Å; D511-L515 WeakPolarHBondContact O-CD1 3.48Å; D511-L515 WeakPolarHBondContact O-CG 3.36Å; D511-L515 PolarHBondContact O-N 3.15Å; D511-L515 VanDerWaalsContact O-N 3.09Å; E513-L515 VanDerWaalsContact C-N 3.32Å; E513-L515 PolarHBondContact O-N 3.49Å; L515-E517 VanDerWaalsContact C-N 3.34Å; L515-E517 PolarHBondContact O-N 3.21Å; L515-S518 PolarHBondContact O-N 3.41Å; L515-S518 PolarHBondContact O-OG 3.48Å; L515-E519 PolarHBondContact O-N 2.76Å
516	K	69	Low	61.8	Low	135 Å²	135	107.6 Å²	107.6	59%	0.587	55%	0.549	S	S	*	.	H	α-helix	trans	-61.3	-38.5	177.2	-71.7	176.8	-178.9	179.9	0	113.1	K512 E513 E519 L520	K512-K516 WeakPolarHBondContact O-CG 3.41Å; K512-K516 PolarHBondContact O-N 2.83Å; E513-K516 PolarHBondContact O-N 3.18Å; K516-E519 PolarHBondContact O-N 2.77Å; K516-L520 WeakPolarHBondContact O-CD1 3.09Å; K516-L520 WeakPolarHBondContact O-CG 3.22Å; K516-L520 PolarHBondContact O-N 2.9Å
517	E	59.2	Low	60.5	Low	67 Å²	67	113.7 Å²	113.7	31%	0.313	58%	0.577	S	S	.	*	H	α-helix	trans	-70.4	-33.9	177.8	-157.1	-174.7	151.6	0	0	111.8	E513 T514 L515 K521 K553	E513-E517 WeakPolarHBondContact O-CB 3.48Å; E513-E517 PolarHBondContact O-N 3.43Å; T514-E517 PolarHBondContact O-N 2.72Å; L515-E517 VanDerWaalsContact C-N 3.34Å; L515-E517 PolarHBondContact O-N 3.21Å; E517-K521 HydrophobicContact CG-CD 4.48Å; E517-K521 WeakPolarHBondContact O-CB 3.29Å; E517-K521 WeakPolarHBondContact O-CG 3.32Å; E517-K521 PolarHBondContact O-N 2.92Å; E517-K521 WeakPolarHBondContact OE1-CE 3.49Å; E517-K521 IonicContact OE1-NZ 3.87Å; E517-K521 PolarHBondContact OE1-NZ 3.48Å; E517-K553 IonicContact OE2-NZ 3.79Å; E517-K553 PolarHBondContact OE2-NZ 2.75Å
518	S	61.8	Low	59	Low	54 Å²	54	117 Å²	117	38%	0.378	60%	0.596	S	S	.	*	H	α-helix	trans	-69.4	-37.5	174.6	74.3	0	0	0	0	112.5	T514 L515 K521 L522	T514-S518 WeakPolarHBondContact O-CB 3.42Å; T514-S518 PolarHBondContact O-N 3.44Å; T514-S518 PolarHBondContact O-OG 3.33Å; L515-S518 PolarHBondContact O-N 3.41Å; L515-S518 PolarHBondContact O-OG 3.48Å; S518-K521 PolarHBondContact O-N 3.08Å; S518-L522 WeakPolarHBondContact O-CG 3.05Å; S518-L522 PolarHBondContact O-N 3.18Å
519	E	56.6	Low	57.2	Low	130 Å²	130	120.7 Å²	120.7	61%	0.607	62%	0.618	S	S	*	*	H	α-helix	trans	-65.1	-46.1	172.9	-73.6	-176.2	156.1	0	0	111.4	L515 K516 K521 L522 T523	L515-E519 PolarHBondContact O-N 2.76Å; K516-E519 PolarHBondContact O-N 2.77Å; E519-K521 VanDerWaalsContact C-N 3.31Å; E519-K521 PolarHBondContact O-N 3.45Å; E519-L522 PolarHBondContact O-N 3.32Å; E519-L522 VanDerWaalsContact O-N 3.15Å; E519-T523 WeakPolarHBondContact O-CG2 3.38Å; E519-T523 PolarHBondContact O-N 3.18Å; E519-T523 VanDerWaalsContact O-N 3.16Å
520	L	54.3	Low	55.5	Low	112 Å²	112	120 Å²	120	59%	0.586	63%	0.627	S	S	*	*	H	α-helix	trans	-64.1	-31.6	177.8	-78.9	160.6	0	0	0	113.6	K516 T523 T524	K516-L520 WeakPolarHBondContact O-CD1 3.09Å; K516-L520 WeakPolarHBondContact O-CG 3.22Å; K516-L520 PolarHBondContact O-N 2.9Å; L520-T523 PolarHBondContact O-OG1 2.99Å; L520-T524 PolarHBondContact O-N 3.03Å; L520-T524 PolarHBondContact O-OG1 2.85Å
521	K	52.6	Low	54.5	Low	134 Å²	134	124.8 Å²	124.8	58%	0.583	65%	0.645	S	S	*	*	H	α-helix	trans	-74.6	-27.5	175.7	-79.1	170.5	171.8	164.5	0	112.7	E517 S518 E519	E517-K521 HydrophobicContact CG-CD 4.48Å; E517-K521 WeakPolarHBondContact O-CB 3.29Å; E517-K521 WeakPolarHBondContact O-CG 3.32Å; E517-K521 PolarHBondContact O-N 2.92Å; E517-K521 WeakPolarHBondContact OE1-CE 3.49Å; E517-K521 IonicContact OE1-NZ 3.87Å; E517-K521 PolarHBondContact OE1-NZ 3.48Å; S518-K521 PolarHBondContact O-N 3.08Å; E519-K521 VanDerWaalsContact C-N 3.31Å; E519-K521 PolarHBondContact O-N 3.45Å
522	L	50.8	Low	52.6	Low	142 Å²	142	125.2 Å²	125.2	74%	0.743	65%	0.653	S	S	*	*	H	α-helix	trans	-77.9	-30	175	-71.9	167.9	0	0	0	112.3	S518 E519	S518-L522 WeakPolarHBondContact O-CG 3.05Å; S518-L522 PolarHBondContact O-N 3.18Å; E519-L522 PolarHBondContact O-N 3.32Å; E519-L522 VanDerWaalsContact O-N 3.15Å
523	T	50.8	Low	50.9	Low	107 Å²	107	126.6 Å²	126.6	66%	0.656	67%	0.665	S	S	*	*	H	α-helix	trans	-82.8	-18.4	179.6	63.2	0	0	0	0	114.2	E519 L520	E519-T523 WeakPolarHBondContact O-CG2 3.38Å; E519-T523 PolarHBondContact O-N 3.18Å; E519-T523 VanDerWaalsContact O-N 3.16Å; L520-T523 PolarHBondContact O-OG1 2.99Å
524	T	48.8	Very low	49.9	Very low	112 Å²	112	129 Å²	129	69%	0.687	68%	0.676	S	S	*	*	H	α-helix	trans	-99.9	-9.4	-174.5	-44.1	0	0	0	0	113.7	L520	L520-T524 PolarHBondContact O-N 3.03Å; L520-T524 PolarHBondContact O-OG1 2.85Å
525	R	41.7	Very low	48.7	Very low	235 Å²	235	135.1 Å²	135.1	89%	0.887	70%	0.697	S	S	*	*	S	Bend	trans	-93.6	0.5	-179.3	-158.6	170.8	179.2	175.6	0.1	114.6
526	G	40.2	Very low	47.4	Very low	66 Å²	66	141.6 Å²	141.6	68%	0.68	71%	0.714	S	S	*	*	S	Bend	trans	-94.6	-0.9	-175.4	0	0	0	0	0	116.9
527	Q	44	Very low	45.9	Very low	179 Å²	179	140.4 Å²	140.4	84%	0.836	72%	0.72	S	S	*	*			trans	-136.5	65.4	-172.4	-72.6	-173.2	-13.9	0	0	113.2
528	I	44	Very low	44.7	Very low	168 Å²	168	143.4 Å²	143.4	86%	0.862	74%	0.743	S	S	*	*			trans	-138.2	119.9	153.8	-52.5	178.8	0	0	0	108.6
529	T	40.9	Very low	43.7	Very low	127 Å²	127	150.4 Å²	150.4	78%	0.779	77%	0.766	S	S	*	*			trans	-79	133	-169.9	43.2	0	0	0	0	112.9
530	S	36.9	Very low	42.9	Very low	107 Å²	107	149.6 Å²	149.6	75%	0.748	78%	0.775	S	S	*	*			trans	3.3	115	151.8	58.3	0	0	0	0	120
531	K	46	Very low	41.8	Very low	206 Å²	206	152.7 Å²	152.7	90%	0.896	79%	0.786	S	S	*	*			trans	-149.1	130.6	132.4	-71.8	-164.1	179.2	174.6	0	110.2
532	P	35.4	Very low	41.3	Very low	113 Å²	113	152.2 Å²	152.2	73%	0.734	79%	0.794	S	S	*	*			trans	-92.8	179.3	177.5	37.5	-31.2	0	0	0	111.6
533	I	41.1	Very low	40.5	Very low	152 Å²	152	152.2 Å²	152.2	78%	0.779	79%	0.794	S	S	*	*			trans	104	124.9	173.7	-56.2	155.1	0	0	0	111.5
534	E	40.9	Very low	40	Very low	187 Å²	187	155.4 Å²	155.4	87%	0.874	80%	0.802	S	S	*	*			cis	-159	159.3	3.7	-133.6	175.3	151.5	0	0	109.2
535	K	41.1	Very low	39.4	Very low	196 Å²	196	156.2 Å²	156.2	85%	0.852	81%	0.806	S	S	*	*			trans	-78.4	146.3	-176.4	-62	170.3	176.7	175.5	0	112.4
536	R	39.6	Very low	39.3	Very low	245 Å²	245	150.1 Å²	150.1	93%	0.925	80%	0.798	S	S	*	*			trans	-162.7	149.8	130.8	-105.6	170.6	-159.8	-175.1	7	112.6
537	P	36.8	Very low	39.4	Very low	110 Å²	110	157 Å²	157	71%	0.714	81%	0.809	S	S	*	*			trans	-114.9	154	-154.9	34.7	-18.8	0	0	0	116
538	V	35.3	Very low	39	Very low	130 Å²	130	155.7 Å²	155.7	79%	0.788	80%	0.803	S	S	*	*			trans	61.4	114.6	138.4	-177.4	0	0	0	0	119.6
539	K	40.7	Very low	38.6	Very low	201 Å²	201	158.1 Å²	158.1	87%	0.874	81%	0.807	S	S	*	*			trans	162	124.4	140.4	-86	158.3	-168.9	-172.3	0	105
540	S	39.2	Very low	38.7	Very low	112 Å²	112	157.4 Å²	157.4	78%	0.783	81%	0.808	S	S	*	*			cis	-165.9	138.9	36.9	43.5	0	0	0	0	109.6	V542	S540-V542 PolarHBondContact O-N 3.37Å
541	H	32.1	Very low	39.3	Very low	178 Å²	178	154.9 Å²	154.9	82%	0.824	79%	0.79	S	S	*	*			trans	-64.2	120.2	171	-112.4	-48.1	0	0	0	111.2
542	V	41.7	Very low	39.8	Very low	123 Å²	123	151.5 Å²	151.5	75%	0.745	78%	0.777	S	S	*	*			trans	-126.4	119.7	149.5	179.8	0	0	0	0	105.9	S540 E544	S540-V542 PolarHBondContact O-N 3.37Å; V542-E544 VanDerWaalsContact C-N 3.34Å; V542-E544 PolarHBondContact O-N 3.41Å
543	N	34.4	Very low	40.5	Very low	142 Å²	142	151.7 Å²	151.7	76%	0.759	77%	0.766	S	S	*	*			trans	-69.1	88.7	179.7	-69.1	-31.8	0	0	0	109.4
544	E	38.7	Very low	41.1	Very low	175 Å²	175	151.8 Å²	151.8	82%	0.818	76%	0.761	S	S	*	*			trans	-81.9	115.3	160	-78.1	-173.5	159.7	0	0	108.5	V542 P546	V542-E544 VanDerWaalsContact C-N 3.34Å; V542-E544 PolarHBondContact O-N 3.41Å; E544-P546 WeakPolarHBondContact O-CD 3.5Å
545	V	36.8	Very low	41.9	Very low	128 Å²	128	149.2 Å²	149.2	78%	0.776	75%	0.751	S	S	*	*			trans	-53.1	122.8	170.6	176	0	0	0	0	108.4	K547	V545-K547 PolarHBondContact O-N 2.86Å
546	P	39.6	Very low	43.4	Very low	108 Å²	108	143.9 Å²	143.9	70%	0.701	73%	0.732	S	S	*	*			trans	-61.9	106.3	177.9	-19.9	31	0	0	0	109.6	E544 E548	E544-P546 WeakPolarHBondContact O-CD 3.5Å; P546-E548 PolarHBondContact O-N 3.19Å
547	K	41.7	Very low	44.6	Very low	210 Å²	210	134.6 Å²	134.6	91%	0.913	70%	0.7	S	S	*	*			trans	-79.8	58.7	175.2	-149.9	176.4	-169.5	177.6	0	108.3	V545	V545-K547 PolarHBondContact O-N 2.86Å
548	E	36.1	Very low	46.3	Very low	152 Å²	152	132.1 Å²	132.1	71%	0.71	68%	0.683	S	S	*	*			trans	-133.5	71.8	-168.3	-70.4	-169.8	169.6	0	0	112	P546	P546-E548 PolarHBondContact O-N 3.19Å
549	F	36.3	Very low	48.2	Very low	218 Å²	218	129.4 Å²	129.4	96%	0.956	66%	0.664	S	S	*	*			trans	-151	50.7	152.1	-81.3	-69.7	0	0	0	110.6
550	S	41.9	Very low	49.8	Very low	113 Å²	113	123.9 Å²	123.9	79%	0.79	64%	0.644	S	S	*	*			trans	-101.8	65.2	158.5	-165.9	0	0	0	0	108	H552	S550-H552 PolarHBondContact O-N 3.26Å
551	S	50.3	Low	51.4	Low	54 Å²	54	122 Å²	122	38%	0.378	62%	0.624	S	S	.	*			trans	-68.3	124.9	174.5	177	0	0	0	0	108	K553 F554	S551-K553 PolarHBondContact O-N 2.9Å; S551-K553 WeakPolarHBondContact OG-CB 3.43Å; S551-K553 WeakPolarHBondContact OG-CG 3.42Å; S551-K553 PolarHBondContact OG-N 3.13Å; S551-F554 PolarHBondContact O-N 3.43Å
552	H	55.2	Low	53.5	Low	135 Å²	135	120.1 Å²	120.1	63%	0.625	61%	0.61	S	S	*	*	H	α-helix	trans	-40	-28.8	169.1	179	-25.8	0	0	0	112.6	S550 F554 M555 N556	S550-H552 PolarHBondContact O-N 3.26Å; H552-F554 PolarHBondContact O-N 2.88Å; H552-M555 PolarHBondContact O-N 3.43Å; H552-N556 PolarHBondContact CE1-ND2 2.98Å; H552-N556 PolarHBondContact CE1-OD1 2.9Å; H552-N556 PolarHBondContact ND1-ND2 3.44Å; H552-N556 PolarHBondContact O-N 2.88Å; H552-N556 VanDerWaalsContact O-N 3.12Å
553	K	51.6	Low	55.1	Low	116 Å²	116	120.9 Å²	120.9	50%	0.504	60%	0.603	S	S	.	*	H	α-helix	trans	-60.9	-39.2	177.5	-58.6	-175.2	179.2	-169.5	0	113.7	E517 S551 N556 L557	E517-K553 IonicContact OE2-NZ 3.79Å; E517-K553 PolarHBondContact OE2-NZ 2.75Å; S551-K553 PolarHBondContact O-N 2.9Å; S551-K553 WeakPolarHBondContact OG-CB 3.43Å; S551-K553 WeakPolarHBondContact OG-CG 3.42Å; S551-K553 PolarHBondContact OG-N 3.13Å; K553-N556 PolarHBondContact O-N 3.46Å; K553-L557 PolarHBondContact O-N 3.14Å
554	F	53.7	Low	57	Low	155 Å²	155	116.6 Å²	116.6	68%	0.68	58%	0.579	S	S	*	*	H	α-helix	trans	-73.9	-35.3	-179.8	-147.6	-89.3	0	0	0	112.2	S551 H552 N556 L557	S551-F554 PolarHBondContact O-N 3.43Å; H552-F554 PolarHBondContact O-N 2.88Å; F554-N556 VanDerWaalsContact C-N 3.29Å; F554-N556 PolarHBondContact O-N 3.45Å; F554-L557 PolarHBondContact O-N 3.35Å
555	M	58	Low	58.7	Low	133 Å²	133	112.6 Å²	112.6	66%	0.655	56%	0.562	S	S	*	*	H	α-helix	trans	-64.6	-34.4	172.6	-73.5	-81.4	-97.3	0	0	111.6	H552 N559	H552-M555 PolarHBondContact O-N 3.43Å; M555-N559 PolarHBondContact O-ND2 2.84Å; M555-N559 VanDerWaalsContact O-ND2 3.14Å
556	N	71.4	Confident	60.6	Low	83 Å²	83	109.4 Å²	109.4	44%	0.444	55%	0.546	S	S	.	.	H	α-helix	trans	-77.8	-32.7	176.5	-83.5	-0.7	0	0	0	113.7	H552 K553 F554 V558 N559 N560	H552-N556 PolarHBondContact CE1-ND2 2.98Å; H552-N556 PolarHBondContact CE1-OD1 2.9Å; H552-N556 PolarHBondContact ND1-ND2 3.44Å; H552-N556 PolarHBondContact O-N 2.88Å; H552-N556 VanDerWaalsContact O-N 3.12Å; K553-N556 PolarHBondContact O-N 3.46Å; F554-N556 VanDerWaalsContact C-N 3.29Å; F554-N556 PolarHBondContact O-N 3.45Å; N556-V558 PolarHBondContact O-N 3.4Å; N556-N559 CarbonylContact O-C 3.57Å; N556-N559 WeakPolarHBondContact O-CB 3.43Å; N556-N559 PolarHBondContact O-N 3.35Å; N556-N559 VanDerWaalsContact O-N 3.15Å; N556-N560 WeakPolarHBondContact O-CB 3.32Å; N556-N560 PolarHBondContact O-N 3.25Å
557	L	66.1	Low	62.2	Low	51 Å²	51	105.9 Å²	105.9	27%	0.267	52%	0.521	S	S	.	.	H	α-helix	trans	-59.2	-48.5	-179.6	179.4	64	0	0	0	111.6	I506 K553 F554 N559 N560 I561	I506-L557 HydrophobicContact CG2-CD1 3.98Å; K553-L557 PolarHBondContact O-N 3.14Å; F554-L557 PolarHBondContact O-N 3.35Å; L557-N559 VanDerWaalsContact C-N 3.25Å; L557-N559 PolarHBondContact O-N 3.49Å; L557-N560 PolarHBondContact O-N 3.47Å; L557-N560 VanDerWaalsContact O-N 3.09Å; L557-I561 HydrophobicContact CD1-CD1 4.09Å; L557-I561 HydrophobicContact CD1-CG1 4.31Å; L557-I561 HydrophobicContact CG-CD1 3.96Å; L557-I561 WeakPolarHBondContact O-CG1 3.45Å; L557-I561 PolarHBondContact O-N 2.93Å
558	V	72.5	Confident	63.6	Low	57 Å²	57	98.6 Å²	98.6	35%	0.345	49%	0.494	S	S	.	.	H	α-helix	trans	-60.7	-38.9	177.3	179.6	0	0	0	0	110.8	N556 R562	N556-V558 PolarHBondContact O-N 3.4Å; V558-R562 VanDerWaalsContact CG1-CZ 3.45Å; V558-R562 WeakPolarHBondContact O-CB 3.38Å; V558-R562 VanDerWaalsContact O-CG 3.28Å; V558-R562 WeakPolarHBondContact O-CG 3.45Å; V558-R562 PolarHBondContact O-N 3.08Å
559	N	73.7	Confident	65.4	Low	73 Å²	73	95.6 Å²	95.6	39%	0.39	49%	0.486	S	S	.	.	H	α-helix	trans	-68.3	-36.2	176	-70.2	-28.5	0	0	0	112.3	M555 N556 L557 R562 K563	M555-N559 PolarHBondContact O-ND2 2.84Å; M555-N559 VanDerWaalsContact O-ND2 3.14Å; N556-N559 CarbonylContact O-C 3.57Å; N556-N559 WeakPolarHBondContact O-CB 3.43Å; N556-N559 PolarHBondContact O-N 3.35Å; N556-N559 VanDerWaalsContact O-N 3.15Å; L557-N559 VanDerWaalsContact C-N 3.25Å; L557-N559 PolarHBondContact O-N 3.49Å; N559-R562 PolarHBondContact OD1-NH1 2.93Å; N559-K563 WeakPolarHBondContact O-CB 3.03Å; N559-K563 VanDerWaalsContact O-CG 3.29Å; N559-K563 WeakPolarHBondContact O-CG 3.29Å; N559-K563 PolarHBondContact O-N 3.35Å
560	N	74.6	Confident	67.2	Low	85 Å²	85	88 Å²	88	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-68	-47.4	176	-164.5	-12.5	0	0	0	111	N556 L557 R562 K563 Q564	N556-N560 WeakPolarHBondContact O-CB 3.32Å; N556-N560 PolarHBondContact O-N 3.25Å; L557-N560 PolarHBondContact O-N 3.47Å; L557-N560 VanDerWaalsContact O-N 3.09Å; N560-R562 VanDerWaalsContact C-N 3.34Å; N560-R562 PolarHBondContact O-N 3.48Å; N560-K563 WeakPolarHBondContact O-CA 3.4Å; N560-K563 WeakPolarHBondContact O-CB 3.35Å; N560-K563 PolarHBondContact O-N 3.3Å; N560-K563 VanDerWaalsContact O-N 3.08Å; N560-Q564 WeakPolarHBondContact O-CG 3.31Å; N560-Q564 PolarHBondContact O-N 3.49Å
561	I	73.1	Confident	68.5	Low	72 Å²	72	85.2 Å²	85.2	37%	0.369	43%	0.43	S	S	.	.	H	α-helix	trans	-59.4	-45	175.2	-65.5	169.3	0	0	0	110.8	I506 L557 K563 Q564 L565	I506-I561 HydrophobicContact CD1-CG1 4.36Å; L557-I561 HydrophobicContact CD1-CD1 4.09Å; L557-I561 HydrophobicContact CD1-CG1 4.31Å; L557-I561 HydrophobicContact CG-CD1 3.96Å; L557-I561 WeakPolarHBondContact O-CG1 3.45Å; L557-I561 PolarHBondContact O-N 2.93Å; I561-K563 VanDerWaalsContact C-N 3.32Å; I561-K563 PolarHBondContact O-N 3.28Å; I561-Q564 PolarHBondContact O-N 3.47Å; I561-L565 HydrophobicContact CG2-CD1 3.91Å; I561-L565 HydrophobicContact CG2-CG 4.34Å; I561-L565 WeakPolarHBondContact O-CB 3.36Å; I561-L565 WeakPolarHBondContact O-CG 3.38Å; I561-L565 PolarHBondContact O-N 2.87Å
562	R	76.4	Confident	69.6	Low	140 Å²	140	86.8 Å²	86.8	53%	0.528	43%	0.434	S	S	.	.	H	α-helix	trans	-60.7	-40.1	174.8	-77.1	-179.8	-168.1	143.1	-1.8	112.2	V558 N559 N560 S566	V558-R562 VanDerWaalsContact CG1-CZ 3.45Å; V558-R562 WeakPolarHBondContact O-CB 3.38Å; V558-R562 VanDerWaalsContact O-CG 3.28Å; V558-R562 WeakPolarHBondContact O-CG 3.45Å; V558-R562 PolarHBondContact O-N 3.08Å; N559-R562 PolarHBondContact OD1-NH1 2.93Å; N560-R562 VanDerWaalsContact C-N 3.34Å; N560-R562 PolarHBondContact O-N 3.48Å; R562-S566 VanDerWaalsContact O-CB 3.31Å; R562-S566 WeakPolarHBondContact O-CB 3.44Å; R562-S566 PolarHBondContact O-N 3.3Å
563	K	75.7	Confident	70.4	Confident	139 Å²	139	82.8 Å²	82.8	60%	0.604	42%	0.424	S	S	*	.	H	α-helix	trans	-62.6	-48.6	175.1	-79.9	177.3	177.2	-173.4	0	111.1	N559 N560 I561 L565 S566 I567	N559-K563 WeakPolarHBondContact O-CB 3.03Å; N559-K563 VanDerWaalsContact O-CG 3.29Å; N559-K563 WeakPolarHBondContact O-CG 3.29Å; N559-K563 PolarHBondContact O-N 3.35Å; N560-K563 WeakPolarHBondContact O-CA 3.4Å; N560-K563 WeakPolarHBondContact O-CB 3.35Å; N560-K563 PolarHBondContact O-N 3.3Å; N560-K563 VanDerWaalsContact O-N 3.08Å; I561-K563 VanDerWaalsContact C-N 3.32Å; I561-K563 PolarHBondContact O-N 3.28Å; K563-L565 PolarHBondContact O-N 3.44Å; K563-S566 WeakPolarHBondContact O-CB 3.49Å; K563-S566 PolarHBondContact O-N 3.48Å; K563-I567 VanDerWaalsContact O-CG1 3.26Å; K563-I567 WeakPolarHBondContact O-CG1 3.37Å; K563-I567 PolarHBondContact O-N 2.81Å
564	Q	74.1	Confident	71.4	Confident	52 Å²	52	80.3 Å²	80.3	24%	0.243	42%	0.416	C	S	.	.	H	α-helix	trans	-61	-45.2	177.9	-68.1	-64.3	-17.4	0	0	112	N560 I561 S566 I567 V568	N560-Q564 WeakPolarHBondContact O-CG 3.31Å; N560-Q564 PolarHBondContact O-N 3.49Å; I561-Q564 PolarHBondContact O-N 3.47Å; Q564-S566 VanDerWaalsContact C-N 3.33Å; Q564-S566 PolarHBondContact O-N 2.78Å; Q564-I567 WeakPolarHBondContact O-CB 3.46Å; Q564-I567 PolarHBondContact O-N 3.21Å; Q564-V568 WeakPolarHBondContact O-CG2 3.48Å; Q564-V568 PolarHBondContact O-N 3.44Å
565	L	74.2	Confident	72.3	Confident	90 Å²	90	79.4 Å²	79.4	47%	0.471	41%	0.411	S	S	.	.	H	α-helix	trans	-63.7	-37.7	175.5	-72.9	173.5	0	0	0	112.5	I561 K563 I567 V568 T569	I561-L565 HydrophobicContact CG2-CD1 3.91Å; I561-L565 HydrophobicContact CG2-CG 4.34Å; I561-L565 WeakPolarHBondContact O-CB 3.36Å; I561-L565 WeakPolarHBondContact O-CG 3.38Å; I561-L565 PolarHBondContact O-N 2.87Å; K563-L565 PolarHBondContact O-N 3.44Å; L565-I567 VanDerWaalsContact C-N 3.34Å; L565-V568 PolarHBondContact O-N 3.2Å; L565-T569 WeakPolarHBondContact O-CB 3.46Å; L565-T569 PolarHBondContact O-N 2.68Å; L565-T569 PolarHBondContact O-OG1 3.5Å
566	S	76	Confident	73.2	Confident	62 Å²	62	77.8 Å²	77.8	43%	0.434	41%	0.405	S	S	.	.	H	α-helix	trans	-61.2	-45.4	173.6	-169	0	0	0	0	110.7	R562 K563 Q564 T569 D570	R562-S566 VanDerWaalsContact O-CB 3.31Å; R562-S566 WeakPolarHBondContact O-CB 3.44Å; R562-S566 PolarHBondContact O-N 3.3Å; K563-S566 WeakPolarHBondContact O-CB 3.49Å; K563-S566 PolarHBondContact O-N 3.48Å; Q564-S566 VanDerWaalsContact C-N 3.33Å; Q564-S566 PolarHBondContact O-N 2.78Å; S566-T569 WeakPolarHBondContact O-CB 3.2Å; S566-T569 PolarHBondContact O-N 3.39Å; S566-D570 VanDerWaalsContact O-CG 3.29Å; S566-D570 PolarHBondContact O-N 2.89Å
567	I	72.8	Confident	73.4	Confident	34 Å²	34	78.5 Å²	78.5	17%	0.174	41%	0.405	C	S	.	.	H	α-helix	trans	-60	-49.7	178.4	-67.2	161.7	0	0	0	110.6	K563 Q564 L565 T569 D570 E571	K563-I567 VanDerWaalsContact O-CG1 3.26Å; K563-I567 WeakPolarHBondContact O-CG1 3.37Å; K563-I567 PolarHBondContact O-N 2.81Å; Q564-I567 WeakPolarHBondContact O-CB 3.46Å; Q564-I567 PolarHBondContact O-N 3.21Å; L565-I567 VanDerWaalsContact C-N 3.34Å; I567-T569 VanDerWaalsContact C-N 3.27Å; I567-T569 PolarHBondContact O-N 3.04Å; I567-D570 PolarHBondContact O-N 3.41Å; I567-D570 VanDerWaalsContact O-N 3.15Å; I567-E571 HydrophobicContact CG2-CG 4.5Å; I567-E571 WeakPolarHBondContact O-CG 3.46Å; I567-E571 PolarHBondContact O-N 2.85Å
568	V	72.5	Confident	73.9	Confident	57 Å²	57	79.3 Å²	79.3	35%	0.345	41%	0.41	S	S	.	.	H	α-helix	trans	-62.1	-36.7	178.1	173.5	0	0	0	0	111.7	Q564 L565 N572	Q564-V568 WeakPolarHBondContact O-CG2 3.48Å; Q564-V568 PolarHBondContact O-N 3.44Å; L565-V568 PolarHBondContact O-N 3.2Å; V568-N572 WeakPolarHBondContact O-CB 3.24Å; V568-N572 PolarHBondContact O-N 3.34Å; V568-N572 PolarHBondContact O-ND2 3.36Å; V568-N572 VanDerWaalsContact O-ND2 3.15Å
569	T	74	Confident	73.8	Confident	88 Å²	88	85 Å²	85	54%	0.54	43%	0.426	S	S	.	.	H	α-helix	trans	-65.4	-42.6	175.9	-57.1	0	0	0	0	111	L565 S566 I567 N572 A573	L565-T569 WeakPolarHBondContact O-CB 3.46Å; L565-T569 PolarHBondContact O-N 2.68Å; L565-T569 PolarHBondContact O-OG1 3.5Å; S566-T569 WeakPolarHBondContact O-CB 3.2Å; S566-T569 PolarHBondContact O-N 3.39Å; I567-T569 VanDerWaalsContact C-N 3.27Å; I567-T569 PolarHBondContact O-N 3.04Å; T569-N572 PolarHBondContact O-N 2.73Å; T569-A573 WeakPolarHBondContact O-CB 3.29Å; T569-A573 PolarHBondContact O-N 2.85Å
570	D	72.8	Confident	73.8	Confident	59 Å²	59	85.3 Å²	85.3	32%	0.316	43%	0.427	S	S	.	.	H	α-helix	trans	-67.9	-41.6	178.4	-70.4	-32	0	0	0	111.8	S566 I567 N572 A573 I574	S566-D570 VanDerWaalsContact O-CG 3.29Å; S566-D570 PolarHBondContact O-N 2.89Å; I567-D570 PolarHBondContact O-N 3.41Å; I567-D570 VanDerWaalsContact O-N 3.15Å; D570-N572 PolarHBondContact O-N 3.26Å; D570-A573 WeakPolarHBondContact O-CB 3.48Å; D570-A573 PolarHBondContact O-N 3.06Å; D570-I574 WeakPolarHBondContact O-CG1 3.36Å; D570-I574 PolarHBondContact O-N 2.73Å
571	E	70.8	Confident	73.7	Confident	55 Å²	55	84.8 Å²	84.8	26%	0.257	42%	0.421	S	S	.	.	H	α-helix	trans	-59.2	-45.6	173.5	-74.6	174.8	-172.9	0	0	111.6	I567 A573 I574 K575 R679	I567-E571 HydrophobicContact CG2-CG 4.5Å; I567-E571 WeakPolarHBondContact O-CG 3.46Å; I567-E571 PolarHBondContact O-N 2.85Å; E571-A573 VanDerWaalsContact C-N 3.32Å; E571-A573 PolarHBondContact O-N 2.83Å; E571-I574 PolarHBondContact O-N 2.78Å; E571-K575 WeakPolarHBondContact O-CG 3.28Å; E571-K575 PolarHBondContact O-N 3.3Å; E571-R679 IonicContact OE1-NH1 3.06Å
572	N	72.2	Confident	73.6	Confident	87 Å²	87	85 Å²	85	47%	0.465	42%	0.42	S	S	.	.	H	α-helix	trans	-66.1	-34.5	175.9	-75.1	-32.3	0	0	0	112.4	V568 T569 D570 L576	V568-N572 WeakPolarHBondContact O-CB 3.24Å; V568-N572 PolarHBondContact O-N 3.34Å; V568-N572 PolarHBondContact O-ND2 3.36Å; V568-N572 VanDerWaalsContact O-ND2 3.15Å; T569-N572 PolarHBondContact O-N 2.73Å; D570-N572 PolarHBondContact O-N 3.26Å; N572-L576 WeakPolarHBondContact O-CB 3.34Å; N572-L576 PolarHBondContact O-N 3.48Å
573	A	72.1	Confident	73.2	Confident	50 Å²	50	82.9 Å²	82.9	41%	0.413	42%	0.417	S	S	.	.	H	α-helix	trans	-65.9	-39.3	174.6	0	0	0	0	0	111.9	T569 D570 E571 L576 Q577	T569-A573 WeakPolarHBondContact O-CB 3.29Å; T569-A573 PolarHBondContact O-N 2.85Å; D570-A573 WeakPolarHBondContact O-CB 3.48Å; D570-A573 PolarHBondContact O-N 3.06Å; E571-A573 VanDerWaalsContact C-N 3.32Å; E571-A573 PolarHBondContact O-N 2.83Å; A573-L576 PolarHBondContact O-N 3.12Å; A573-Q577 WeakPolarHBondContact O-CB 3.4Å; A573-Q577 PolarHBondContact O-N 3.37Å
574	I	72.5	Confident	73.1	Confident	65 Å²	65	82.5 Å²	82.5	33%	0.333	42%	0.415	S	S	.	.	H	α-helix	trans	-65.8	-49.2	174.6	-66.1	165	0	0	0	110.4	D570 E571 L576 Q577 D578	D570-I574 WeakPolarHBondContact O-CG1 3.36Å; D570-I574 PolarHBondContact O-N 2.73Å; E571-I574 PolarHBondContact O-N 2.78Å; I574-L576 PolarHBondContact O-N 3.33Å; I574-Q577 WeakPolarHBondContact O-CA 3.39Å; I574-Q577 WeakPolarHBondContact O-CB 3.23Å; I574-Q577 PolarHBondContact O-N 2.96Å; I574-D578 PolarHBondContact O-N 3.11Å
575	K	72.9	Confident	73.2	Confident	135 Å²	135	85.8 Å²	85.8	59%	0.587	43%	0.431	S	S	*	.	H	α-helix	trans	-55.3	-40.5	175.6	-72.8	177.7	-179.3	178.2	0	111.9	E571 R579	E571-K575 WeakPolarHBondContact O-CG 3.28Å; E571-K575 PolarHBondContact O-N 3.3Å; K575-R579 WeakPolarHBondContact O-CB 3.28Å; K575-R579 PolarHBondContact O-N 2.86Å; K575-R579 VanDerWaalsContact O-N 3.13Å
576	L	75.8	Confident	73.1	Confident	100 Å²	100	81.7 Å²	81.7	52%	0.524	41%	0.41	S	S	.	.	H	α-helix	trans	-65.9	-43.7	174.5	-179.9	65	0	0	0	111.6	N572 A573 I574 R579 L580	N572-L576 WeakPolarHBondContact O-CB 3.34Å; N572-L576 PolarHBondContact O-N 3.48Å; A573-L576 PolarHBondContact O-N 3.12Å; I574-L576 PolarHBondContact O-N 3.33Å; L576-R579 WeakPolarHBondContact O-CB 3.39Å; L576-R579 PolarHBondContact O-N 2.84Å; L576-L580 HydrophobicContact CD1-CG 4.37Å; L576-L580 HydrophobicContact CG-CD1 4.19Å; L576-L580 HydrophobicContact CG-CG 4.36Å; L576-L580 WeakPolarHBondContact O-CB 3.22Å; L576-L580 VanDerWaalsContact O-CG 3.29Å; L576-L580 WeakPolarHBondContact O-CG 3.09Å; L576-L580 PolarHBondContact O-N 2.85Å
577	Q	77.4	Confident	73.1	Confident	97 Å²	97	85.5 Å²	85.5	45%	0.453	42%	0.418	S	S	.	.	H	α-helix	trans	-61	-45	178.3	-176.7	63	21.4	0	0	111.8	A573 I574 R579 L580 E581	A573-Q577 WeakPolarHBondContact O-CB 3.4Å; A573-Q577 PolarHBondContact O-N 3.37Å; I574-Q577 WeakPolarHBondContact O-CA 3.39Å; I574-Q577 WeakPolarHBondContact O-CB 3.23Å; I574-Q577 PolarHBondContact O-N 2.96Å; Q577-R579 VanDerWaalsContact C-N 3.3Å; Q577-R579 PolarHBondContact O-N 3.12Å; Q577-L580 PolarHBondContact O-N 3.23Å; Q577-L580 VanDerWaalsContact O-N 3.12Å; Q577-E581 PolarHBondContact O-N 3.26Å
578	D	75.1	Confident	73.4	Confident	69 Å²	69	87.7 Å²	87.7	37%	0.369	44%	0.435	S	S	.	.	H	α-helix	trans	-60.2	-43	176.3	-69.3	-15.7	0	0	0	110.8	I574 L580 E581 F582 S670	I574-D578 PolarHBondContact O-N 3.11Å; D578-L580 VanDerWaalsContact C-N 3.34Å; D578-L580 PolarHBondContact O-N 3.46Å; D578-E581 PolarHBondContact O-N 3.34Å; D578-F582 VanDerWaalsContact O-CB 3.29Å; D578-F582 WeakPolarHBondContact O-CB 3.5Å; D578-F582 PolarHBondContact O-N 2.92Å; D578-S670 WeakPolarHBondContact OD2-CB 3.3Å
579	R	71.3	Confident	73.4	Confident	177 Å²	177	88.4 Å²	88.4	67%	0.668	43%	0.434	S	S	*	.	H	α-helix	trans	-63.4	-38.5	174.4	-174.2	175.9	178.3	140.9	1.9	112.4	K575 L576 Q577 M583	K575-R579 WeakPolarHBondContact O-CB 3.28Å; K575-R579 PolarHBondContact O-N 2.86Å; K575-R579 VanDerWaalsContact O-N 3.13Å; L576-R579 WeakPolarHBondContact O-CB 3.39Å; L576-R579 PolarHBondContact O-N 2.84Å; Q577-R579 VanDerWaalsContact C-N 3.3Å; Q577-R579 PolarHBondContact O-N 3.12Å; R579-M583 WeakPolarHBondContact O-CG 3.4Å; R579-M583 PolarHBondContact O-N 3.08Å
580	L	72.4	Confident	73.3	Confident	79 Å²	79	84.4 Å²	84.4	41%	0.414	41%	0.409	S	S	.	.	H	α-helix	trans	-69.7	-41.9	177.7	-72.6	178	0	0	0	111.9	L576 Q577 D578 M583 K584	L576-L580 HydrophobicContact CD1-CG 4.37Å; L576-L580 HydrophobicContact CG-CD1 4.19Å; L576-L580 HydrophobicContact CG-CG 4.36Å; L576-L580 WeakPolarHBondContact O-CB 3.22Å; L576-L580 VanDerWaalsContact O-CG 3.29Å; L576-L580 WeakPolarHBondContact O-CG 3.09Å; L576-L580 PolarHBondContact O-N 2.85Å; Q577-L580 PolarHBondContact O-N 3.23Å; Q577-L580 VanDerWaalsContact O-N 3.12Å; D578-L580 VanDerWaalsContact C-N 3.34Å; D578-L580 PolarHBondContact O-N 3.46Å; L580-M583 HydrophobicContact CD2-CE 3.78Å; L580-M583 PolarHBondContact O-N 3.34Å; L580-K584 VanDerWaalsContact O-CB 3.31Å; L580-K584 WeakPolarHBondContact O-CB 3.46Å; L580-K584 PolarHBondContact O-N 3.34Å
581	E	73.2	Confident	73.5	Confident	73 Å²	73	84.7 Å²	84.7	34%	0.341	42%	0.415	S	S	.	.	H	α-helix	trans	-63.9	-42	173.4	-76.3	-65.7	163.6	0	0	110.9	Q577 D578 M583 K584 Q585	Q577-E581 PolarHBondContact O-N 3.26Å; D578-E581 PolarHBondContact O-N 3.34Å; E581-M583 PolarHBondContact O-N 2.86Å; E581-K584 WeakPolarHBondContact O-CB 3.49Å; E581-K584 PolarHBondContact O-N 3.49Å; E581-K584 VanDerWaalsContact O-N 3.11Å; E581-K584 IonicContact OE1-NZ 2.84Å; E581-K584 PolarHBondContact OE1-NZ 3.39Å; E581-K584 IonicContact OE2-NZ 3.88Å; E581-K584 PolarHBondContact OE2-NZ 3.07Å; E581-Q585 WeakPolarHBondContact O-CG 3.29Å; E581-Q585 PolarHBondContact O-N 3.2Å
582	F	70.5	Confident	73.9	Confident	76 Å²	76	87.3 Å²	87.3	33%	0.333	43%	0.431	S	S	.	.	H	α-helix	trans	-57.4	-48.2	172	179.6	-104.5	0	0	0	111.9	D578 K584 Q585 I586 T621 L624	D578-F582 VanDerWaalsContact O-CB 3.29Å; D578-F582 WeakPolarHBondContact O-CB 3.5Å; D578-F582 PolarHBondContact O-N 2.92Å; F582-K584 VanDerWaalsContact C-N 3.29Å; F582-K584 PolarHBondContact O-N 3.11Å; F582-Q585 PolarHBondContact O-N 3.43Å; F582-I586 HydrophobicContact CD1-CD1 3.53Å; F582-I586 HydrophobicContact CD2-CD1 4.24Å; F582-I586 HydrophobicContact CE1-CD1 3.16Å; F582-I586 HydrophobicContact CE2-CD1 3.91Å; F582-I586 HydrophobicContact CG-CD1 4.08Å; F582-I586 HydrophobicContact CZ-CD1 3.38Å; F582-I586 WeakPolarHBondContact O-CG1 3.48Å; F582-I586 PolarHBondContact O-N 2.77Å; F582-I586 VanDerWaalsContact O-N 3.12Å; F582-T621 HydrophobicContact CE1-CG2 4.21Å; F582-L624 HydrophobicContact CE2-CB 4.31Å
583	M	67.9	Low	73.9	Confident	97 Å²	97	84.5 Å²	84.5	48%	0.478	42%	0.419	S	S	.	.	H	α-helix	trans	-63.2	-34.9	175.1	-73.3	-160.5	-32.6	0	0	112.7	R579 L580 E581 I586 K587	R579-M583 WeakPolarHBondContact O-CG 3.4Å; R579-M583 PolarHBondContact O-N 3.08Å; L580-M583 HydrophobicContact CD2-CE 3.78Å; L580-M583 PolarHBondContact O-N 3.34Å; E581-M583 PolarHBondContact O-N 2.86Å; M583-I586 PolarHBondContact O-N 2.99Å; M583-K587 VanDerWaalsContact O-CB 3.3Å; M583-K587 WeakPolarHBondContact O-CB 3.37Å; M583-K587 PolarHBondContact O-N 3.36Å
584	K	75.3	Confident	74.2	Confident	130 Å²	130	84.4 Å²	84.4	57%	0.565	41%	0.409	S	S	*	.	H	α-helix	trans	-67.5	-37.1	179.2	-177.1	-176.9	165.2	-157.5	0	111.7	L580 E581 F582 P588	L580-K584 VanDerWaalsContact O-CB 3.31Å; L580-K584 WeakPolarHBondContact O-CB 3.46Å; L580-K584 PolarHBondContact O-N 3.34Å; E581-K584 WeakPolarHBondContact O-CB 3.49Å; E581-K584 PolarHBondContact O-N 3.49Å; E581-K584 VanDerWaalsContact O-N 3.11Å; E581-K584 IonicContact OE1-NZ 2.84Å; E581-K584 PolarHBondContact OE1-NZ 3.39Å; E581-K584 IonicContact OE2-NZ 3.88Å; E581-K584 PolarHBondContact OE2-NZ 3.07Å; F582-K584 VanDerWaalsContact C-N 3.29Å; F582-K584 PolarHBondContact O-N 3.11Å; K584-P588 WeakPolarHBondContact O-CD 3.43Å
585	Q	76.4	Confident	74.4	Confident	122 Å²	122	87.9 Å²	87.9	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-67.6	-38.5	172.8	-69.7	179.5	5	0	0	112.2	E581 F582 P588	E581-Q585 WeakPolarHBondContact O-CG 3.29Å; E581-Q585 PolarHBondContact O-N 3.2Å; F582-Q585 PolarHBondContact O-N 3.43Å; Q585-P588 VanDerWaalsContact O-CD 3.31Å; Q585-P588 WeakPolarHBondContact O-CD 3.38Å; Q585-P588 WeakPolarHBondContact O-CG 3.46Å
586	I	72.2	Confident	74.5	Confident	4 Å²	4	86.6 Å²	86.6	2%	0.021	42%	0.419	C	S	.	.	H	α-helix	trans	-73.6	-36.5	179.6	-71.5	168.9	0	0	0	112.8	F582 M583 E589 I590 A620 T621 L624	F582-I586 HydrophobicContact CD1-CD1 3.53Å; F582-I586 HydrophobicContact CD2-CD1 4.24Å; F582-I586 HydrophobicContact CE1-CD1 3.16Å; F582-I586 HydrophobicContact CE2-CD1 3.91Å; F582-I586 HydrophobicContact CG-CD1 4.08Å; F582-I586 HydrophobicContact CZ-CD1 3.38Å; F582-I586 WeakPolarHBondContact O-CG1 3.48Å; F582-I586 PolarHBondContact O-N 2.77Å; F582-I586 VanDerWaalsContact O-N 3.12Å; M583-I586 PolarHBondContact O-N 2.99Å; I586-E589 PolarHBondContact O-N 3.44Å; I586-E589 VanDerWaalsContact O-N 3.11Å; I586-I590 HydrophobicContact CG2-CD1 3.24Å; I586-I590 HydrophobicContact CG2-CG1 3.62Å; I586-I590 PolarHBondContact O-N 3.48Å; I586-A620 HydrophobicContact CG2-CB 3.84Å; I586-T621 HydrophobicContact CD1-CG2 3.79Å; I586-L624 HydrophobicContact CB-CD1 4.22Å; I586-L624 HydrophobicContact CD1-CD1 4.27Å; I586-L624 HydrophobicContact CG1-CB 4.41Å; I586-L624 HydrophobicContact CG1-CD1 3.26Å; I586-L624 HydrophobicContact CG1-CG 4.42Å
587	K	75.6	Confident	74.3	Confident	141 Å²	141	85.4 Å²	85.4	61%	0.613	41%	0.413	S	S	*	.	H	α-helix	trans	-50.8	-47.4	-173.1	-168.4	176.6	-178.1	-178.7	0	114.1	M583 I590 C591	M583-K587 VanDerWaalsContact O-CB 3.3Å; M583-K587 WeakPolarHBondContact O-CB 3.37Å; M583-K587 PolarHBondContact O-N 3.36Å; K587-I590 PolarHBondContact O-N 3.14Å; K587-C591 WeakPolarHBondContact O-CB 3.36Å; K587-C591 PolarHBondContact O-N 2.75Å; K587-C591 PolarHBondContact O-SG 2.98Å
588	P	78	Confident	74.2	Confident	81 Å²	81	83.6 Å²	83.6	53%	0.526	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-42.5	177.7	24.5	-34.6	0	0	0	112.7	K584 Q585 I590 C591 L592	K584-P588 WeakPolarHBondContact O-CD 3.43Å; Q585-P588 VanDerWaalsContact O-CD 3.31Å; Q585-P588 WeakPolarHBondContact O-CD 3.38Å; Q585-P588 WeakPolarHBondContact O-CG 3.46Å; P588-I590 VanDerWaalsContact C-N 3.34Å; P588-I590 PolarHBondContact O-N 2.87Å; P588-C591 PolarHBondContact O-N 3.02Å; P588-L592 WeakPolarHBondContact O-CB 3.41Å; P588-L592 PolarHBondContact O-N 3.04Å
589	E	73.1	Confident	74.3	Confident	72 Å²	72	82.7 Å²	82.7	34%	0.336	40%	0.404	S	S	.	.	H	α-helix	trans	-60	-44.7	178.1	-64.6	-170.6	162	0	0	111	I586 L592 A593 L624 K627	I586-E589 PolarHBondContact O-N 3.44Å; I586-E589 VanDerWaalsContact O-N 3.11Å; E589-L592 PolarHBondContact O-N 3.26Å; E589-A593 WeakPolarHBondContact O-CB 3.46Å; E589-A593 PolarHBondContact O-N 3.33Å; E589-L624 WeakPolarHBondContact OE2-CD1 3.45Å; E589-K627 IonicContact OE1-NZ 3.93Å; E589-K627 PolarHBondContact OE1-NZ 2.92Å
590	I	72.9	Confident	74.4	Confident	3 Å²	3	81 Å²	81	2%	0.015	41%	0.413	C	S	.	.	H	α-helix	trans	-65.8	-41.6	176.2	-66.1	-176.8	0	0	0	111.6	I586 K587 P588 L592 A593 K594 Y617 A620	I586-I590 HydrophobicContact CG2-CD1 3.24Å; I586-I590 HydrophobicContact CG2-CG1 3.62Å; I586-I590 PolarHBondContact O-N 3.48Å; K587-I590 PolarHBondContact O-N 3.14Å; P588-I590 VanDerWaalsContact C-N 3.34Å; P588-I590 PolarHBondContact O-N 2.87Å; I590-L592 VanDerWaalsContact C-N 3.33Å; I590-A593 PolarHBondContact O-N 2.72Å; I590-K594 HydrophobicContact CG2-CD 4.02Å; I590-K594 HydrophobicContact CG2-CG 4.44Å; I590-K594 WeakPolarHBondContact O-CB 3.2Å; I590-K594 VanDerWaalsContact O-CG 3.29Å; I590-K594 WeakPolarHBondContact O-CG 3.25Å; I590-K594 PolarHBondContact O-N 2.78Å; I590-Y617 HydrophobicContact CD1-CD1 3.11Å; I590-Y617 HydrophobicContact CD1-CD2 4.33Å; I590-Y617 HydrophobicContact CD1-CE1 3.36Å; I590-Y617 HydrophobicContact CD1-CG 3.65Å; I590-A620 HydrophobicContact CD1-CB 3.98Å; I590-A620 HydrophobicContact CG1-CB 3.57Å
591	C	76.9	Confident	74.5	Confident	65 Å²	65	85.1 Å²	85.1	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-62.6	-42	178	-76.2	0	0	0	0	111.4	K587 P588 K594 Y595	K587-C591 WeakPolarHBondContact O-CB 3.36Å; K587-C591 PolarHBondContact O-N 2.75Å; K587-C591 PolarHBondContact O-SG 2.98Å; P588-C591 PolarHBondContact O-N 3.02Å; C591-K594 PolarHBondContact O-N 2.99Å; C591-Y595 WeakPolarHBondContact O-CB 3.34Å; C591-Y595 PolarHBondContact O-N 2.88Å
592	L	77.4	Confident	74.6	Confident	111 Å²	111	83.4 Å²	83.4	58%	0.581	43%	0.431	S	S	*	.	H	α-helix	trans	-65.5	-45.4	177.1	-166.1	113	0	0	0	111.3	P588 E589 I590 K594 Y595 N596	P588-L592 WeakPolarHBondContact O-CB 3.41Å; P588-L592 PolarHBondContact O-N 3.04Å; E589-L592 PolarHBondContact O-N 3.26Å; I590-L592 VanDerWaalsContact C-N 3.33Å; L592-K594 VanDerWaalsContact C-N 3.31Å; L592-K594 PolarHBondContact O-N 3.41Å; L592-Y595 PolarHBondContact O-N 3.07Å; L592-N596 PolarHBondContact O-N 3.05Å
593	A	73.5	Confident	75	Confident	27 Å²	27	88.5 Å²	88.5	22%	0.223	45%	0.45	C	S	.	.	H	α-helix	trans	-60.1	-40	174.8	0	0	0	0	0	112.1	E589 I590 N597	E589-A593 WeakPolarHBondContact O-CB 3.46Å; E589-A593 PolarHBondContact O-N 3.33Å; I590-A593 PolarHBondContact O-N 2.72Å; A593-N597 PolarHBondContact O-N 3.11Å; A593-N597 PolarHBondContact O-ND2 3.46Å
594	K	77.3	Confident	75.6	Confident	48 Å²	48	89.2 Å²	89.2	21%	0.209	46%	0.459	C	S	.	.	H	α-helix	trans	-64	-46.6	173.7	-76.6	171.7	-179	171.8	0	111.5	I590 C591 L592 N597 I598 A615	I590-K594 HydrophobicContact CG2-CD 4.02Å; I590-K594 HydrophobicContact CG2-CG 4.44Å; I590-K594 WeakPolarHBondContact O-CB 3.2Å; I590-K594 VanDerWaalsContact O-CG 3.29Å; I590-K594 WeakPolarHBondContact O-CG 3.25Å; I590-K594 PolarHBondContact O-N 2.78Å; C591-K594 PolarHBondContact O-N 2.99Å; L592-K594 VanDerWaalsContact C-N 3.31Å; L592-K594 PolarHBondContact O-N 3.41Å; K594-N597 PolarHBondContact O-N 3.36Å; K594-I598 VanDerWaalsContact O-CG1 3.3Å; K594-I598 WeakPolarHBondContact O-CG1 3.43Å; K594-I598 PolarHBondContact O-N 2.96Å; K594-A615 VanDerWaalsContact CE-CB 3.42Å
595	Y	77.7	Confident	75.8	Confident	138 Å²	138	88.4 Å²	88.4	54%	0.541	46%	0.457	S	S	.	.	H	α-helix	trans	-60.3	-48.6	-178	179.6	-104.1	0	0	0	112.1	F175 C591 L592 N597 I598	F175-Y595 HydrophobicContact CD1-CE2 4.4Å; F175-Y595 HydrophobicContact CE1-CD2 4.01Å; F175-Y595 AromaticContact CE1-CE2 3.47Å; F175-Y595 HydrophobicContact CE1-CE2 3.47Å; F175-Y595 VanDerWaalsContact CE1-CE2 3.47Å; F175-Y595 HydrophobicContact CZ-CD2 4.39Å; F175-Y595 AromaticContact CZ-CE2 3.9Å; F175-Y595 HydrophobicContact CZ-CE2 3.9Å; C591-Y595 WeakPolarHBondContact O-CB 3.34Å; C591-Y595 PolarHBondContact O-N 2.88Å; L592-Y595 PolarHBondContact O-N 3.07Å; Y595-N597 PolarHBondContact O-N 3.35Å; Y595-N597 VanDerWaalsContact O-N 3.16Å; Y595-I598 PolarHBondContact O-N 3.25Å
596	N	75.7	Confident	75.8	Confident	109 Å²	109	85 Å²	85	58%	0.583	45%	0.445	S	S	*	.	H	α-helix	trans	-64.4	-21.1	-179.1	-68.7	-15.8	0	0	0	113.6	L592	L592-N596 PolarHBondContact O-N 3.05Å
597	N	70.4	Confident	76.1	Confident	75 Å²	75	85.3 Å²	85.3	40%	0.401	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	8.1	-178.4	-73	-72.4	0	0	0	113.8	A593 K594 Y595 P599 M614	A593-N597 PolarHBondContact O-N 3.11Å; A593-N597 PolarHBondContact O-ND2 3.46Å; K594-N597 PolarHBondContact O-N 3.36Å; Y595-N597 PolarHBondContact O-N 3.35Å; Y595-N597 VanDerWaalsContact O-N 3.16Å; N597-P599 VanDerWaalsContact O-CD 3.28Å; N597-P599 WeakPolarHBondContact O-CD 3.08Å; N597-M614 HydrophobicContact CB-CB 4.28Å; N597-M614 HydrophobicContact CB-CG 3.88Å
598	I	76.3	Confident	76.1	Confident	59 Å²	59	82.9 Å²	82.9	30%	0.303	44%	0.44	S	S	.	.	S	Bend	trans	-70.9	115.9	171.6	-59.8	179.3	0	0	0	107.5	K594 Y595 V600 A607 M611	K594-I598 VanDerWaalsContact O-CG1 3.3Å; K594-I598 WeakPolarHBondContact O-CG1 3.43Å; K594-I598 PolarHBondContact O-N 2.96Å; Y595-I598 PolarHBondContact O-N 3.25Å; I598-V600 PolarHBondContact O-N 2.97Å; I598-V600 VanDerWaalsContact O-N 3.15Å; I598-A607 HydrophobicContact CG2-CB 4.26Å; I598-M611 HydrophobicContact CD1-CG 4.47Å; I598-M611 HydrophobicContact CD1-SD 3.84Å; I598-M611 HydrophobicContact CG1-CG 3.96Å; I598-M611 HydrophobicContact CG1-SD 3.99Å
599	P	75.5	Confident	76.1	Confident	49 Å²	49	83.6 Å²	83.6	32%	0.318	44%	0.437	S	S	.	.			trans	-69.9	119	-178.7	-3.1	17.1	0	0	0	109	N597 N601 S602	N597-P599 VanDerWaalsContact O-CD 3.28Å; N597-P599 WeakPolarHBondContact O-CD 3.08Å; P599-N601 PolarHBondContact O-N 3.04Å; P599-S602 WeakPolarHBondContact CB-OG 3.37Å; P599-S602 VanDerWaalsContact CG-OG 3.23Å; P599-S602 WeakPolarHBondContact CG-OG 3.45Å; P599-S602 PolarHBondContact O-N 3.41Å; P599-S602 PolarHBondContact O-OG 3.42Å; P599-S602 VanDerWaalsContact O-OG 3.09Å
600	V	73.4	Confident	76	Confident	142 Å²	142	81.5 Å²	81.5	86%	0.861	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.9	-171.2	-172.8	0	0	0	0	113.1	I598	I598-V600 PolarHBondContact O-N 2.97Å; I598-V600 VanDerWaalsContact O-N 3.15Å
601	N	75.1	Confident	75.9	Confident	165 Å²	165	84.1 Å²	84.1	88%	0.882	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.5	29.8	-177.8	-75.7	-12.4	0	0	0	114.3	P599	P599-N601 PolarHBondContact O-N 3.04Å
602	S	75	Confident	75.7	Confident	37 Å²	37	90.4 Å²	90.4	26%	0.259	46%	0.457	S	S	.	.	S	Bend	trans	-108.4	150.4	-179.3	68	0	0	0	0	113.7	P599	P599-S602 WeakPolarHBondContact CB-OG 3.37Å; P599-S602 VanDerWaalsContact CG-OG 3.23Å; P599-S602 WeakPolarHBondContact CG-OG 3.45Å; P599-S602 PolarHBondContact O-N 3.41Å; P599-S602 PolarHBondContact O-OG 3.42Å; P599-S602 VanDerWaalsContact O-OG 3.09Å
603	Y	79.6	Confident	75.3	Confident	184 Å²	184	93.2 Å²	93.2	72%	0.722	46%	0.46	S	S	*	.			trans	-57.6	145.8	170	-63.8	-76.8	0	0	0	110.9	H605 V606 A607	Y603-H605 VanDerWaalsContact CB-CE1 3.48Å; Y603-H605 WeakPolarHBondContact CB-CE1 3.26Å; Y603-H605 WeakPolarHBondContact CB-ND1 3.29Å; Y603-H605 PolarHBondContact O-N 2.84Å; Y603-V606 WeakPolarHBondContact O-CA 3.49Å; Y603-V606 WeakPolarHBondContact O-CB 3.19Å; Y603-V606 PolarHBondContact O-N 3.36Å; Y603-A607 PolarHBondContact O-N 3.04Å
604	T	80	Confident	74.9	Confident	111 Å²	111	95.1 Å²	95.1	68%	0.681	47%	0.465	S	S	*	.	H	α-helix	trans	-51.1	-37.2	-176	52.1	0	0	0	0	113.9	A607 M608	T604-A607 PolarHBondContact O-N 3.06Å; T604-M608 WeakPolarHBondContact O-CB 3.35Å; T604-M608 VanDerWaalsContact O-CG 3.25Å; T604-M608 WeakPolarHBondContact O-CG 3.4Å; T604-M608 PolarHBondContact O-N 3.23Å
605	H	78.9	Confident	74	Confident	113 Å²	113	94 Å²	94	52%	0.523	47%	0.465	S	S	.	.	H	α-helix	trans	-67.5	-35.5	177.2	72.6	-83.5	0	0	0	113.3	Y603 M608 Q609	Y603-H605 VanDerWaalsContact CB-CE1 3.48Å; Y603-H605 WeakPolarHBondContact CB-CE1 3.26Å; Y603-H605 WeakPolarHBondContact CB-ND1 3.29Å; Y603-H605 PolarHBondContact O-N 2.84Å; H605-M608 HydrophobicContact CB-CE 4.47Å; H605-Q609 WeakPolarHBondContact O-CB 3.29Å; H605-Q609 PolarHBondContact O-N 3.42Å
606	V	77.9	Confident	73.2	Confident	51 Å²	51	90.3 Å²	90.3	31%	0.309	45%	0.454	S	S	.	.	H	α-helix	trans	-72	-42.7	175.4	-178.1	0	0	0	0	110.2	Y603 M608 Q609 S610	Y603-V606 WeakPolarHBondContact O-CA 3.49Å; Y603-V606 WeakPolarHBondContact O-CB 3.19Å; Y603-V606 PolarHBondContact O-N 3.36Å; V606-M608 PolarHBondContact O-N 2.87Å; V606-Q609 PolarHBondContact O-N 2.87Å; V606-S610 WeakPolarHBondContact O-CB 3.4Å; V606-S610 PolarHBondContact O-N 3.42Å; V606-S610 PolarHBondContact O-OG 3.33Å
607	A	77.9	Confident	72.7	Confident	11 Å²	11	90.8 Å²	90.8	9%	0.091	45%	0.449	C	S	.	.	H	α-helix	trans	-59.9	-44.8	172.9	0	0	0	0	0	111.4	I598 Y603 T604 S610 M611	I598-A607 HydrophobicContact CG2-CB 4.26Å; Y603-A607 PolarHBondContact O-N 3.04Å; T604-A607 PolarHBondContact O-N 3.06Å; A607-S610 PolarHBondContact O-N 3.39Å; A607-M611 WeakPolarHBondContact O-CB 3.27Å; A607-M611 WeakPolarHBondContact O-CG 3.35Å; A607-M611 PolarHBondContact O-N 2.93Å
608	M	75.6	Confident	72	Confident	89 Å²	89	90.9 Å²	90.9	44%	0.438	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-41.3	175.5	-76.7	-170.5	-64.7	0	0	112.7	T604 H605 V606 S610 M611 R612	T604-M608 WeakPolarHBondContact O-CB 3.35Å; T604-M608 VanDerWaalsContact O-CG 3.25Å; T604-M608 WeakPolarHBondContact O-CG 3.4Å; T604-M608 PolarHBondContact O-N 3.23Å; H605-M608 HydrophobicContact CB-CE 4.47Å; V606-M608 PolarHBondContact O-N 2.87Å; M608-S610 VanDerWaalsContact C-N 3.34Å; M608-M611 HydrophobicContact CB-CE 4.43Å; M608-M611 HydrophobicContact CG-CE 3.97Å; M608-M611 PolarHBondContact O-N 3.49Å; M608-R612 WeakPolarHBondContact O-CB 3.31Å; M608-R612 WeakPolarHBondContact O-CG 3.42Å; M608-R612 PolarHBondContact O-N 3.15Å
609	Q	77	Confident	71.4	Confident	97 Å²	97	93.6 Å²	93.6	45%	0.453	46%	0.459	S	S	.	.	H	α-helix	trans	-67.4	-37.1	176.4	-167	171.3	26.8	0	0	111.5	H605 V606 R612 R613	H605-Q609 WeakPolarHBondContact O-CB 3.29Å; H605-Q609 PolarHBondContact O-N 3.42Å; V606-Q609 PolarHBondContact O-N 2.87Å; Q609-R612 PolarHBondContact O-N 3.01Å; Q609-R613 WeakPolarHBondContact O-CB 3.38Å; Q609-R613 WeakPolarHBondContact O-CG 3.24Å; Q609-R613 PolarHBondContact O-N 3.41Å
610	S	72	Confident	70.7	Confident	28 Å²	28	91.7 Å²	91.7	20%	0.196	45%	0.447	C	S	.	.	H	α-helix	trans	-65.4	-45.9	174.2	-55.9	0	0	0	0	111	V606 A607 M608 R612 R613 M614	V606-S610 WeakPolarHBondContact O-CB 3.4Å; V606-S610 PolarHBondContact O-N 3.42Å; V606-S610 PolarHBondContact O-OG 3.33Å; A607-S610 PolarHBondContact O-N 3.39Å; M608-S610 VanDerWaalsContact C-N 3.34Å; S610-R612 VanDerWaalsContact C-N 3.29Å; S610-R612 PolarHBondContact O-N 2.93Å; S610-R613 PolarHBondContact O-N 3.36Å; S610-M614 VanDerWaalsContact O-CB 3.27Å; S610-M614 WeakPolarHBondContact O-CB 3.47Å; S610-M614 VanDerWaalsContact O-CG 3.27Å; S610-M614 WeakPolarHBondContact O-CG 3.13Å; S610-M614 PolarHBondContact O-N 3.47Å
611	M	71.5	Confident	70.2	Confident	58 Å²	58	86.7 Å²	86.7	29%	0.286	42%	0.417	S	S	.	.	H	α-helix	trans	-60.9	-33.8	173.5	-75.6	-170.7	-68.9	0	0	113.3	I598 A607 M608 A615	I598-M611 HydrophobicContact CD1-CG 4.47Å; I598-M611 HydrophobicContact CD1-SD 3.84Å; I598-M611 HydrophobicContact CG1-CG 3.96Å; I598-M611 HydrophobicContact CG1-SD 3.99Å; A607-M611 WeakPolarHBondContact O-CB 3.27Å; A607-M611 WeakPolarHBondContact O-CG 3.35Å; A607-M611 PolarHBondContact O-N 2.93Å; M608-M611 HydrophobicContact CB-CE 4.43Å; M608-M611 HydrophobicContact CG-CE 3.97Å; M608-M611 PolarHBondContact O-N 3.49Å; M611-A615 WeakPolarHBondContact O-CB 3.32Å; M611-A615 PolarHBondContact O-N 2.86Å
612	R	71.8	Confident	69.7	Low	197 Å²	197	79.9 Å²	79.9	74%	0.743	39%	0.386	S	S	*	.	H	α-helix	trans	-72.4	-42.6	174.9	-75.6	176.9	-175.9	173.8	1.9	111.9	M608 Q609 S610 M614 A615	M608-R612 WeakPolarHBondContact O-CB 3.31Å; M608-R612 WeakPolarHBondContact O-CG 3.42Å; M608-R612 PolarHBondContact O-N 3.15Å; Q609-R612 PolarHBondContact O-N 3.01Å; S610-R612 VanDerWaalsContact C-N 3.29Å; S610-R612 PolarHBondContact O-N 2.93Å; R612-M614 VanDerWaalsContact C-N 3.33Å; R612-A615 WeakPolarHBondContact O-CB 3.28Å; R612-A615 PolarHBondContact O-N 2.96Å
613	R	68.8	Low	69.1	Low	169 Å²	169	82 Å²	82	64%	0.638	39%	0.391	S	S	*	.	H	α-helix	trans	-67.9	-32.7	175.8	-72.5	177.5	-178.4	166.1	1.5	112.6	Q609 S610	Q609-R613 WeakPolarHBondContact O-CB 3.38Å; Q609-R613 WeakPolarHBondContact O-CG 3.24Å; Q609-R613 PolarHBondContact O-N 3.41Å; S610-R613 PolarHBondContact O-N 3.36Å
614	M	64.8	Low	68	Low	68 Å²	68	74.4 Å²	74.4	34%	0.335	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	5.5	177.1	-62.9	-63.2	113.6	0	0	112.9	N597 S610 R612 L616	N597-M614 HydrophobicContact CB-CB 4.28Å; N597-M614 HydrophobicContact CB-CG 3.88Å; S610-M614 VanDerWaalsContact O-CB 3.27Å; S610-M614 WeakPolarHBondContact O-CB 3.47Å; S610-M614 VanDerWaalsContact O-CG 3.27Å; S610-M614 WeakPolarHBondContact O-CG 3.13Å; S610-M614 PolarHBondContact O-N 3.47Å; R612-M614 VanDerWaalsContact C-N 3.33Å; M614-L616 PolarHBondContact O-N 2.93Å
615	A	59.4	Low	67	Low	25 Å²	25	70.6 Å²	70.6	21%	0.207	34%	0.341	C	S	.	.			trans	-70.5	73.3	165.9	0	0	0	0	0	107.6	K594 M611 R612 Y617	K594-A615 VanDerWaalsContact CE-CB 3.42Å; M611-A615 WeakPolarHBondContact O-CB 3.32Å; M611-A615 PolarHBondContact O-N 2.86Å; R612-A615 WeakPolarHBondContact O-CB 3.28Å; R612-A615 PolarHBondContact O-N 2.96Å; A615-Y617 HydrophobicContact CB-CD2 4.01Å; A615-Y617 HydrophobicContact CB-CE2 4.13Å; A615-Y617 PolarHBondContact O-N 3.47Å
616	L	60.9	Low	66.2	Low	59 Å²	59	71.2 Å²	71.2	31%	0.309	34%	0.343	S	S	.	.			trans	-71.8	50	179.4	-71.4	173.3	0	0	0	109.8	M614 D618 K619 A620	M614-L616 PolarHBondContact O-N 2.93Å; L616-D618 PolarHBondContact O-N 3.2Å; L616-K619 HydrophobicContact CB-CB 3.93Å; L616-K619 HydrophobicContact CD1-CB 4.42Å; L616-K619 HydrophobicContact CD1-CD 4.13Å; L616-K619 HydrophobicContact CD2-CB 4.02Å; L616-K619 HydrophobicContact CG-CB 4.35Å; L616-K619 PolarHBondContact O-N 2.98Å; L616-A620 VanDerWaalsContact O-CB 3.25Å; L616-A620 WeakPolarHBondContact O-CB 3.43Å; L616-A620 PolarHBondContact O-N 3.09Å
617	Y	64.3	Low	65.2	Low	119 Å²	119	73.5 Å²	73.5	47%	0.467	35%	0.348	S	S	.	.	H	α-helix	trans	-51.9	-43.7	168.3	-78.5	-79.5	0	0	0	108.3	I590 A615 K619 A620 T621	I590-Y617 HydrophobicContact CD1-CD1 3.11Å; I590-Y617 HydrophobicContact CD1-CD2 4.33Å; I590-Y617 HydrophobicContact CD1-CE1 3.36Å; I590-Y617 HydrophobicContact CD1-CG 3.65Å; A615-Y617 HydrophobicContact CB-CD2 4.01Å; A615-Y617 HydrophobicContact CB-CE2 4.13Å; A615-Y617 PolarHBondContact O-N 3.47Å; Y617-K619 PolarHBondContact O-N 3.22Å; Y617-A620 PolarHBondContact O-N 2.79Å; Y617-T621 VanDerWaalsContact O-CB 3.27Å; Y617-T621 WeakPolarHBondContact O-CB 3.31Å; Y617-T621 WeakPolarHBondContact O-CG2 3.46Å; Y617-T621 PolarHBondContact O-N 3.45Å; Y617-T621 PolarHBondContact O-OG1 2.96Å
618	D	55.6	Low	63.9	Low	78 Å²	78	76.9 Å²	76.9	42%	0.417	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-40.5	179.7	-51.1	-25.6	0	0	0	114.3	L616 T621 G622	L616-D618 PolarHBondContact O-N 3.2Å; D618-T621 WeakPolarHBondContact CA-OG1 3.47Å; D618-T621 PolarHBondContact O-OG1 2.97Å; D618-G622 VanDerWaalsContact O-CA 3.29Å; D618-G622 WeakPolarHBondContact O-CA 3.44Å; D618-G622 PolarHBondContact O-N 3.41Å
619	K	64.8	Low	62.7	Low	115 Å²	115	79.5 Å²	79.5	50%	0.5	38%	0.376	S	S	.	.	H	α-helix	trans	-76.3	-36.1	177.7	-167.3	-179.9	169.7	-178.7	0	110.7	L616 Y617 E623	L616-K619 HydrophobicContact CB-CB 3.93Å; L616-K619 HydrophobicContact CD1-CB 4.42Å; L616-K619 HydrophobicContact CD1-CD 4.13Å; L616-K619 HydrophobicContact CD2-CB 4.02Å; L616-K619 HydrophobicContact CG-CB 4.35Å; L616-K619 PolarHBondContact O-N 2.98Å; Y617-K619 PolarHBondContact O-N 3.22Å; K619-E623 WeakPolarHBondContact CE-OE1 3.35Å; K619-E623 HydrophobicContact CG-CG 4.15Å; K619-E623 IonicContact NZ-OE1 2.72Å; K619-E623 WeakPolarHBondContact O-CA 3.47Å; K619-E623 WeakPolarHBondContact O-CB 3.2Å; K619-E623 WeakPolarHBondContact O-CG 3.38Å; K619-E623 PolarHBondContact O-N 2.87Å
620	A	60.4	Low	61.3	Low	9 Å²	9	82.7 Å²	82.7	7%	0.074	39%	0.391	C	S	.	.	H	α-helix	trans	-74.8	-41.7	178.7	0	0	0	0	0	111.9	I586 I590 L616 Y617 L624	I586-A620 HydrophobicContact CG2-CB 3.84Å; I590-A620 HydrophobicContact CD1-CB 3.98Å; I590-A620 HydrophobicContact CG1-CB 3.57Å; L616-A620 VanDerWaalsContact O-CB 3.25Å; L616-A620 WeakPolarHBondContact O-CB 3.43Å; L616-A620 PolarHBondContact O-N 3.09Å; Y617-A620 PolarHBondContact O-N 2.79Å; A620-L624 VanDerWaalsContact O-CB 3.26Å; A620-L624 WeakPolarHBondContact O-CB 3.38Å; A620-L624 PolarHBondContact O-N 2.82Å
621	T	61.8	Low	60.2	Low	38 Å²	38	89.3 Å²	89.3	23%	0.233	42%	0.416	C	S	.	.	H	α-helix	trans	-67.8	-40.8	171.9	58.7	0	0	0	0	110.6	F582 I586 Y617 D618 S625	F582-T621 HydrophobicContact CE1-CG2 4.21Å; I586-T621 HydrophobicContact CD1-CG2 3.79Å; Y617-T621 VanDerWaalsContact O-CB 3.27Å; Y617-T621 WeakPolarHBondContact O-CB 3.31Å; Y617-T621 WeakPolarHBondContact O-CG2 3.46Å; Y617-T621 PolarHBondContact O-N 3.45Å; Y617-T621 PolarHBondContact O-OG1 2.96Å; D618-T621 WeakPolarHBondContact CA-OG1 3.47Å; D618-T621 PolarHBondContact O-OG1 2.97Å; T621-S625 WeakPolarHBondContact O-CB 3.31Å; T621-S625 PolarHBondContact O-N 3.46Å; T621-S625 PolarHBondContact O-OG 2.83Å
622	G	65	Low	59.2	Low	21 Å²	21	91.5 Å²	91.5	22%	0.216	43%	0.429	C	S	.	.	H	α-helix	trans	-64.4	-47.1	175.2	0	0	0	0	0	112.3	D618 S625 K626	D618-G622 VanDerWaalsContact O-CA 3.29Å; D618-G622 WeakPolarHBondContact O-CA 3.44Å; D618-G622 PolarHBondContact O-N 3.41Å; G622-S625 PolarHBondContact O-N 3.24Å; G622-S625 PolarHBondContact O-OG 2.92Å; G622-K626 WeakPolarHBondContact O-CB 3.13Å; G622-K626 WeakPolarHBondContact O-CG 3.3Å; G622-K626 PolarHBondContact O-N 3.31Å
623	E	61.9	Low	58.9	Low	81 Å²	81	85.8 Å²	85.8	38%	0.379	42%	0.424	S	S	.	.	H	α-helix	trans	-70.9	-32.2	177.2	-76.2	-173.4	-176.4	0	0	112.7	K619 K626 K627	K619-E623 WeakPolarHBondContact CE-OE1 3.35Å; K619-E623 HydrophobicContact CG-CG 4.15Å; K619-E623 IonicContact NZ-OE1 2.72Å; K619-E623 WeakPolarHBondContact O-CA 3.47Å; K619-E623 WeakPolarHBondContact O-CB 3.2Å; K619-E623 WeakPolarHBondContact O-CG 3.38Å; K619-E623 PolarHBondContact O-N 2.87Å; E623-K626 CarbonylContact O-C 3.46Å; E623-K626 PolarHBondContact O-N 3.34Å; E623-K627 WeakPolarHBondContact O-CB 2.81Å; E623-K627 VanDerWaalsContact O-CG 3.25Å; E623-K627 WeakPolarHBondContact O-CG 3.25Å; E623-K627 PolarHBondContact O-N 3.36Å
624	L	58.2	Low	59.2	Low	25 Å²	25	79.4 Å²	79.4	13%	0.131	40%	0.404	C	S	.	.	H	α-helix	trans	-77.6	-32.4	172	-86.8	158.2	0	0	0	112.7	F582 I586 E589 A620 K626 K627 S628	F582-L624 HydrophobicContact CE2-CB 4.31Å; I586-L624 HydrophobicContact CB-CD1 4.22Å; I586-L624 HydrophobicContact CD1-CD1 4.27Å; I586-L624 HydrophobicContact CG1-CB 4.41Å; I586-L624 HydrophobicContact CG1-CD1 3.26Å; I586-L624 HydrophobicContact CG1-CG 4.42Å; E589-L624 WeakPolarHBondContact OE2-CD1 3.45Å; A620-L624 VanDerWaalsContact O-CB 3.26Å; A620-L624 WeakPolarHBondContact O-CB 3.38Å; A620-L624 PolarHBondContact O-N 2.82Å; L624-K626 VanDerWaalsContact C-N 3.27Å; L624-K626 PolarHBondContact O-N 2.9Å; L624-K627 HydrophobicContact CD2-CB 4.38Å; L624-K627 HydrophobicContact CD2-CD 4.04Å; L624-K627 HydrophobicContact CG-CD 4.42Å; L624-K627 PolarHBondContact O-N 3.2Å; L624-S628 WeakPolarHBondContact O-CA 3.49Å; L624-S628 WeakPolarHBondContact O-CB 3.4Å; L624-S628 PolarHBondContact O-N 3.42Å
625	S	58	Low	59.9	Low	32 Å²	32	77.3 Å²	77.3	22%	0.224	40%	0.397	C	S	.	.	H	α-helix	trans	-63.3	-38.9	166.4	85.1	0	0	0	0	110	T621 G622 S628 R629	T621-S625 WeakPolarHBondContact O-CB 3.31Å; T621-S625 PolarHBondContact O-N 3.46Å; T621-S625 PolarHBondContact O-OG 2.83Å; G622-S625 PolarHBondContact O-N 3.24Å; G622-S625 PolarHBondContact O-OG 2.92Å; S625-S628 PolarHBondContact O-N 3.34Å; S625-R629 VanDerWaalsContact O-CB 3.24Å; S625-R629 WeakPolarHBondContact O-CB 3.36Å; S625-R629 WeakPolarHBondContact O-CD 3.44Å; S625-R629 WeakPolarHBondContact O-CG 3.41Å; S625-R629 PolarHBondContact O-N 2.81Å
626	K	62.6	Low	61	Low	126 Å²	126	80.4 Å²	80.4	55%	0.548	41%	0.41	S	S	.	.	H	α-helix	trans	-68.6	-43.6	173.8	-73.9	171.6	-176	-177.8	0	111.7	G622 E623 L624 S628 R629 Q630	G622-K626 WeakPolarHBondContact O-CB 3.13Å; G622-K626 WeakPolarHBondContact O-CG 3.3Å; G622-K626 PolarHBondContact O-N 3.31Å; E623-K626 CarbonylContact O-C 3.46Å; E623-K626 PolarHBondContact O-N 3.34Å; L624-K626 VanDerWaalsContact C-N 3.27Å; L624-K626 PolarHBondContact O-N 2.9Å; K626-S628 VanDerWaalsContact C-N 3.29Å; K626-S628 PolarHBondContact O-N 3.45Å; K626-R629 CarbonylContact O-C 3.26Å; K626-R629 PolarHBondContact O-N 2.88Å; K626-Q630 VanDerWaalsContact O-CB 3.29Å; K626-Q630 WeakPolarHBondContact O-CB 3.48Å; K626-Q630 PolarHBondContact O-N 2.95Å; K626-Q630 PolarHBondContact O-OE1 3.14Å
627	K	56.7	Low	62.2	Low	99 Å²	99	78.3 Å²	78.3	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-64.6	-34.2	174.4	-75.5	173	-178	175.9	0	111.2	E589 E623 L624 K631	E589-K627 IonicContact OE1-NZ 3.93Å; E589-K627 PolarHBondContact OE1-NZ 2.92Å; E623-K627 WeakPolarHBondContact O-CB 2.81Å; E623-K627 VanDerWaalsContact O-CG 3.25Å; E623-K627 WeakPolarHBondContact O-CG 3.25Å; E623-K627 PolarHBondContact O-N 3.36Å; L624-K627 HydrophobicContact CD2-CB 4.38Å; L624-K627 HydrophobicContact CD2-CD 4.04Å; L624-K627 HydrophobicContact CG-CD 4.42Å; L624-K627 PolarHBondContact O-N 3.2Å; K627-K631 VanDerWaalsContact O-CB 3.29Å; K627-K631 WeakPolarHBondContact O-CB 3.19Å; K627-K631 WeakPolarHBondContact O-CG 3.4Å; K627-K631 PolarHBondContact O-N 3.06Å
628	S	51.1	Low	63.3	Low	82 Å²	82	73.4 Å²	73.4	57%	0.573	38%	0.379	S	S	*	.	H	α-helix	trans	-70.9	-38.4	172.5	-173.9	0	0	0	0	111.5	L624 S625 K626 K631	L624-S628 WeakPolarHBondContact O-CA 3.49Å; L624-S628 WeakPolarHBondContact O-CB 3.4Å; L624-S628 PolarHBondContact O-N 3.42Å; S625-S628 PolarHBondContact O-N 3.34Å; K626-S628 VanDerWaalsContact C-N 3.29Å; K626-S628 PolarHBondContact O-N 3.45Å; S628-K631 CarbonylContact O-C 3.55Å; S628-K631 VanDerWaalsContact O-C 3.26Å; S628-K631 VanDerWaalsContact O-O 3.13Å
629	R	49.5	Very low	64.7	Low	144 Å²	144	71.6 Å²	71.6	54%	0.543	37%	0.372	S	S	.	.	H	α-helix	trans	-72.6	-31.1	173.2	-70.4	166.9	-157.1	-149.6	6	112.3	S625 K626 N632	S625-R629 VanDerWaalsContact O-CB 3.24Å; S625-R629 WeakPolarHBondContact O-CB 3.36Å; S625-R629 WeakPolarHBondContact O-CD 3.44Å; S625-R629 WeakPolarHBondContact O-CG 3.41Å; S625-R629 PolarHBondContact O-N 2.81Å; K626-R629 CarbonylContact O-C 3.26Å; K626-R629 PolarHBondContact O-N 2.88Å; R629-N632 PolarHBondContact O-N 3.2Å; R629-N632 PolarHBondContact O-ND2 3.49Å; R629-N632 PolarHBondContact O-OD1 2.9Å
630	Q	47.4	Very low	65.5	Low	163 Å²	163	66.3 Å²	66.3	76%	0.762	35%	0.35	S	S	*	.	H	α-helix	trans	-79	-32.4	176.1	-123.6	96.7	27.8	0	0	110.4	K626 N632	K626-Q630 VanDerWaalsContact O-CB 3.29Å; K626-Q630 WeakPolarHBondContact O-CB 3.48Å; K626-Q630 PolarHBondContact O-N 2.95Å; K626-Q630 PolarHBondContact O-OE1 3.14Å; Q630-N632 PolarHBondContact O-N 2.96Å
631	K	49	Very low	66.7	Low	167 Å²	167	66.3 Å²	66.3	73%	0.726	35%	0.348	S	S	*	.			trans	-77.9	57.1	159.4	-70.1	-175.8	178.3	-176.5	0	109.7	K627 S628 A633	K627-K631 VanDerWaalsContact O-CB 3.29Å; K627-K631 WeakPolarHBondContact O-CB 3.19Å; K627-K631 WeakPolarHBondContact O-CG 3.4Å; K627-K631 PolarHBondContact O-N 3.06Å; S628-K631 CarbonylContact O-C 3.55Å; S628-K631 VanDerWaalsContact O-C 3.26Å; S628-K631 VanDerWaalsContact O-O 3.13Å; K631-A633 PolarHBondContact O-N 2.89Å
632	N	52	Low	67.9	Low	104 Å²	104	66.4 Å²	66.4	56%	0.556	35%	0.347	S	S	*	.			trans	-64.9	49.6	150.3	-79.7	-18.9	0	0	0	109.1	R629 Q630 V634	R629-N632 PolarHBondContact O-N 3.2Å; R629-N632 PolarHBondContact O-ND2 3.49Å; R629-N632 PolarHBondContact O-OD1 2.9Å; Q630-N632 PolarHBondContact O-N 2.96Å; N632-V634 VanDerWaalsContact C-N 3.26Å; N632-V634 PolarHBondContact O-N 3.36Å
633	A	63.7	Low	68.7	Low	78 Å²	78	68.9 Å²	68.9	65%	0.645	36%	0.358	S	S	*	.			trans	-71.9	96.2	169.5	0	0	0	0	0	104.1	K631 A635	K631-A633 PolarHBondContact O-N 2.89Å; A633-A635 PolarHBondContact O-N 2.87Å
634	V	75.3	Confident	69.6	Low	34 Å²	34	65.6 Å²	65.6	21%	0.206	34%	0.343	C	S	.	.			trans	-45.6	130.7	167.9	179	0	0	0	0	107.5	N632 L636 Y638 A665 Q666	N632-V634 VanDerWaalsContact C-N 3.26Å; N632-V634 PolarHBondContact O-N 3.36Å; V634-L636 PolarHBondContact O-N 3.03Å; V634-Y638 HydrophobicContact CG1-CD1 3.21Å; V634-Y638 HydrophobicContact CG1-CE1 3.96Å; V634-Y638 HydrophobicContact CG1-CG 3.76Å; V634-A665 HydrophobicContact CG1-CB 3.79Å; V634-Q666 HydrophobicContact CG2-CG 4.27Å
635	A	80.4	Confident	70.8	Confident	24 Å²	24	64.4 Å²	64.4	20%	0.198	34%	0.337	C	S	.	.			trans	-52.4	137.1	-174.4	0	0	0	0	0	110.7	A633 W637 Y638 S639 A665	A633-A635 PolarHBondContact O-N 2.87Å; A635-W637 VanDerWaalsContact CB-CD1 3.45Å; A635-W637 HydrophobicContact CB-CG 4.29Å; A635-W637 PolarHBondContact O-N 3.01Å; A635-Y638 WeakPolarHBondContact O-CB 3.44Å; A635-Y638 PolarHBondContact O-N 3.4Å; A635-S639 PolarHBondContact O-N 3.14Å; A635-A665 HydrophobicContact CB-CB 4.34Å; A635-A665 WeakPolarHBondContact CB-O 3.32Å; A635-A665 PolarHBondContact N-O 3.11Å
636	L	81.8	Confident	71.7	Confident	90 Å²	90	66.1 Å²	66.1	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-54.1	-32	-172.8	-68.1	173.3	0	0	0	113.1	V634 Y638 S639 D640	V634-L636 PolarHBondContact O-N 3.03Å; L636-Y638 VanDerWaalsContact C-N 3.27Å; L636-Y638 PolarHBondContact O-N 3.28Å; L636-S639 PolarHBondContact O-N 3.42Å; L636-D640 PolarHBondContact O-N 3.08Å
637	W	86.6	Confident	72.3	Confident	16 Å²	16	64.2 Å²	64.2	6%	0.061	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-30.6	177.4	65.1	-101.8	0	0	0	113.2	M364 A635 I641 L661 A665 F700 R704 I705	M364-W637 HydrophobicContact CE-CZ2 4.13Å; A635-W637 VanDerWaalsContact CB-CD1 3.45Å; A635-W637 HydrophobicContact CB-CG 4.29Å; A635-W637 PolarHBondContact O-N 3.01Å; W637-I641 HydrophobicContact CE3-CD1 3.67Å; W637-I641 HydrophobicContact CZ3-CD1 3.73Å; W637-I641 WeakPolarHBondContact O-CG1 3.45Å; W637-I641 PolarHBondContact O-N 3.16Å; W637-I641 VanDerWaalsContact O-N 3.09Å; W637-L661 HydrophobicContact CH2-CD2 3.74Å; W637-L661 HydrophobicContact CZ3-CD2 3.58Å; W637-A665 HydrophobicContact CH2-CB 3.85Å; W637-A665 HydrophobicContact CZ2-CB 3.58Å; W637-F700 HydrophobicContact CB-CZ 4.46Å; W637-F700 AromaticContact CE3-CE1 3.91Å; W637-F700 HydrophobicContact CE3-CE1 3.91Å; W637-F700 HydrophobicContact CE3-CZ 4.13Å; W637-R704 HydrophobicContact CB-CB 3.97Å; W637-I705 HydrophobicContact CD2-CD1 4.12Å; W637-I705 HydrophobicContact CD2-CG1 4.17Å; W637-I705 HydrophobicContact CE3-CD1 4.44Å; W637-I705 HydrophobicContact CG-CG1 4.13Å; W637-I705 HydrophobicContact CZ2-CD1 4.14Å
638	Y	87.9	Confident	73.3	Confident	16 Å²	16	59.7 Å²	59.7	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-76.6	-36.6	177.6	178	-89.4	0	0	0	110.7	V634 A635 L636 D640 I641 L642 L658 L661 K662 A665	V634-Y638 HydrophobicContact CG1-CD1 3.21Å; V634-Y638 HydrophobicContact CG1-CE1 3.96Å; V634-Y638 HydrophobicContact CG1-CG 3.76Å; A635-Y638 WeakPolarHBondContact O-CB 3.44Å; A635-Y638 PolarHBondContact O-N 3.4Å; L636-Y638 VanDerWaalsContact C-N 3.27Å; L636-Y638 PolarHBondContact O-N 3.28Å; Y638-D640 VanDerWaalsContact C-N 3.3Å; Y638-D640 PolarHBondContact O-N 3.48Å; Y638-I641 PolarHBondContact O-N 3.08Å; Y638-L642 HydrophobicContact CD1-CD1 3.79Å; Y638-L642 HydrophobicContact CD1-CG 4.04Å; Y638-L642 HydrophobicContact CE1-CD1 3.27Å; Y638-L642 HydrophobicContact CE1-CD2 4.23Å; Y638-L642 HydrophobicContact CE1-CG 3.71Å; Y638-L642 WeakPolarHBondContact O-CB 3.42Å; Y638-L642 WeakPolarHBondContact O-CG 3.38Å; Y638-L642 PolarHBondContact O-N 3.32Å; Y638-L658 HydrophobicContact CE2-CD2 4.43Å; Y638-L658 PolarHBondContact OH-O 3.41Å; Y638-L661 HydrophobicContact CD2-CB 4.22Å; Y638-L661 HydrophobicContact CE2-CB 3.96Å; Y638-K662 HydrophobicContact CE1-CB 4.31Å; Y638-K662 HydrophobicContact CE1-CG 4.24Å; Y638-K662 HydrophobicContact CE2-CB 4.09Å; Y638-A665 HydrophobicContact CD1-CB 4.49Å; Y638-A665 HydrophobicContact CD2-CB 4.02Å; Y638-A665 HydrophobicContact CG-CB 3.78Å
639	S	83.6	Confident	74.5	Confident	40 Å²	40	59.4 Å²	59.4	28%	0.28	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-38.4	170.7	-58.2	0	0	0	0	111.9	A635 L636 L642 T643	A635-S639 PolarHBondContact O-N 3.14Å; L636-S639 PolarHBondContact O-N 3.42Å; S639-L642 PolarHBondContact O-N 3.29Å; S639-T643 WeakPolarHBondContact O-CB 3.47Å; S639-T643 PolarHBondContact O-N 2.76Å; S639-T643 PolarHBondContact O-OG1 3.37Å
640	D	83	Confident	75.9	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-60.6	-52.6	173.4	-69.8	-29.7	0	0	0	111.1	T278 R281 R282 L636 Y638 L642 T643 D644 R704	T278-D640 WeakPolarHBondContact CG2-OD1 3.37Å; R281-D640 IonicContact NH1-OD2 2.77Å; R282-D640 IonicContact NE-OD1 2.82Å; R282-D640 PolarHBondContact NH2-O 3.5Å; L636-D640 PolarHBondContact O-N 3.08Å; Y638-D640 VanDerWaalsContact C-N 3.3Å; Y638-D640 PolarHBondContact O-N 3.48Å; D640-L642 VanDerWaalsContact C-N 3.3Å; D640-L642 PolarHBondContact O-N 2.97Å; D640-T643 PolarHBondContact O-N 3.31Å; D640-T643 VanDerWaalsContact O-N 3.09Å; D640-D644 PolarHBondContact O-N 3.22Å; D640-R704 IonicContact OD2-NH1 3.74Å; D640-R704 PolarHBondContact OD2-NH1 3.48Å
641	I	85.9	Confident	77.5	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-55.7	-46.3	176.9	-71.7	175.2	0	0	0	110.9	W637 Y638 T643 D644 L645 L658 F700	W637-I641 HydrophobicContact CE3-CD1 3.67Å; W637-I641 HydrophobicContact CZ3-CD1 3.73Å; W637-I641 WeakPolarHBondContact O-CG1 3.45Å; W637-I641 PolarHBondContact O-N 3.16Å; W637-I641 VanDerWaalsContact O-N 3.09Å; Y638-I641 PolarHBondContact O-N 3.08Å; I641-T643 VanDerWaalsContact C-N 3.31Å; I641-T643 PolarHBondContact O-N 3.5Å; I641-D644 PolarHBondContact O-N 2.9Å; I641-L645 HydrophobicContact CG2-CD1 3.44Å; I641-L645 VanDerWaalsContact CG2-CD1 3.44Å; I641-L645 HydrophobicContact CG2-CG 4.23Å; I641-L645 WeakPolarHBondContact O-CB 3.27Å; I641-L645 WeakPolarHBondContact O-CG 3.42Å; I641-L645 PolarHBondContact O-N 2.84Å; I641-L658 HydrophobicContact CG2-CD2 4.17Å; I641-F700 HydrophobicContact CD1-CE1 3.75Å; I641-F700 HydrophobicContact CD1-CE2 4.07Å; I641-F700 HydrophobicContact CD1-CZ 3.36Å; I641-F700 HydrophobicContact CG1-CE1 4.38Å; I641-F700 HydrophobicContact CG1-CE2 3.84Å; I641-F700 HydrophobicContact CG1-CZ 3.5Å; I641-F700 VanDerWaalsContact CG1-CZ 3.5Å
642	L	85.4	Confident	79.2	Confident	40 Å²	40	48.8 Å²	48.8	21%	0.209	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-44.5	179	-76.9	-174.1	0	0	0	110.3	Y638 S639 D640 D644 L645 S646 K649 L658	Y638-L642 HydrophobicContact CD1-CD1 3.79Å; Y638-L642 HydrophobicContact CD1-CG 4.04Å; Y638-L642 HydrophobicContact CE1-CD1 3.27Å; Y638-L642 HydrophobicContact CE1-CD2 4.23Å; Y638-L642 HydrophobicContact CE1-CG 3.71Å; Y638-L642 WeakPolarHBondContact O-CB 3.42Å; Y638-L642 WeakPolarHBondContact O-CG 3.38Å; Y638-L642 PolarHBondContact O-N 3.32Å; S639-L642 PolarHBondContact O-N 3.29Å; D640-L642 VanDerWaalsContact C-N 3.3Å; D640-L642 PolarHBondContact O-N 2.97Å; L642-D644 VanDerWaalsContact C-N 3.26Å; L642-D644 PolarHBondContact O-N 3.18Å; L642-L645 CarbonylContact O-C 3.58Å; L642-L645 PolarHBondContact O-N 3.39Å; L642-S646 PolarHBondContact O-N 3.47Å; L642-K649 VanDerWaalsContact C-NZ 3.32Å; L642-K649 HydrophobicContact CD2-CD 4.3Å; L642-K649 HydrophobicContact CD2-CG 4.22Å; L642-K649 WeakPolarHBondContact O-CE 3.29Å; L642-K649 PolarHBondContact O-NZ 3.3Å; L642-L658 HydrophobicContact CD2-CD1 4.05Å; L642-L658 HydrophobicContact CD2-CD2 4.32Å
643	T	82.7	Confident	80.8	Confident	73 Å²	73	48.7 Å²	48.7	45%	0.448	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-38.9	-178.9	-55.2	0	0	0	0	111.1	R282 S639 D640 I641	R282-T643 VanDerWaalsContact NH2-CB 3.27Å; S639-T643 WeakPolarHBondContact O-CB 3.47Å; S639-T643 PolarHBondContact O-N 2.76Å; S639-T643 PolarHBondContact O-OG1 3.37Å; D640-T643 PolarHBondContact O-N 3.31Å; D640-T643 VanDerWaalsContact O-N 3.09Å; I641-T643 VanDerWaalsContact C-N 3.31Å; I641-T643 PolarHBondContact O-N 3.5Å
644	D	81.2	Confident	81.8	Confident	12 Å²	12	45.1 Å²	45.1	6%	0.064	26%	0.258	C	S	.	.	H	α-helix	trans	-74.1	-26.3	177.7	-60.7	-25	0	0	0	113.5	R282 D308 F309 G310 D640 I641 L642	R282-D644 IonicContact CZ-OD1 3.82Å; R282-D644 IonicContact NH1-OD1 3.35Å; R282-D644 IonicContact NH2-OD1 3.07Å; R282-D644 PolarHBondContact NH2-OD1 2.87Å; R282-D644 IonicContact NH2-OD2 2.93Å; D308-D644 PolarHBondContact N-OD1 2.92Å; F309-D644 HydrophobicContact CD1-CB 3.63Å; F309-D644 HydrophobicContact CE1-CB 3.23Å; F309-D644 HydrophobicContact CG-CB 4.48Å; F309-D644 HydrophobicContact CZ-CB 3.8Å; G310-D644 VanDerWaalsContact CA-O 3.29Å; G310-D644 WeakPolarHBondContact CA-O 3.48Å; D640-D644 PolarHBondContact O-N 3.22Å; I641-D644 PolarHBondContact O-N 2.9Å; L642-D644 VanDerWaalsContact C-N 3.26Å; L642-D644 PolarHBondContact O-N 3.18Å
645	L	82.9	Confident	82.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	22.4	177.3	-67.1	173.6	0	0	0	113.6	F309 I353 I357 I641 L642 D647 L648 K649 F654 L658	F309-L645 HydrophobicContact CE2-CD2 3.54Å; F309-L645 HydrophobicContact CE2-CG 4.27Å; F309-L645 HydrophobicContact CZ-CD2 3.52Å; F309-L645 HydrophobicContact CZ-CG 3.75Å; I353-L645 HydrophobicContact CG2-CD2 4.06Å; I357-L645 HydrophobicContact CD1-CD1 3.44Å; I357-L645 VanDerWaalsContact CD1-CD1 3.44Å; I357-L645 HydrophobicContact CD1-CD2 4.25Å; I357-L645 HydrophobicContact CD1-CG 4.49Å; I641-L645 HydrophobicContact CG2-CD1 3.44Å; I641-L645 VanDerWaalsContact CG2-CD1 3.44Å; I641-L645 HydrophobicContact CG2-CG 4.23Å; I641-L645 WeakPolarHBondContact O-CB 3.27Å; I641-L645 WeakPolarHBondContact O-CG 3.42Å; I641-L645 PolarHBondContact O-N 2.84Å; L642-L645 CarbonylContact O-C 3.58Å; L642-L645 PolarHBondContact O-N 3.39Å; L645-D647 PolarHBondContact O-N 3.02Å; L645-L648 HydrophobicContact CD2-CB 4.28Å; L645-L648 HydrophobicContact CD2-CD1 3.82Å; L645-L648 PolarHBondContact O-N 2.77Å; L645-K649 WeakPolarHBondContact O-CG 3.27Å; L645-K649 PolarHBondContact O-N 2.91Å; L645-F654 HydrophobicContact CD2-CE1 4.48Å; L645-L658 HydrophobicContact CD1-CD1 4.45Å; L645-L658 HydrophobicContact CD1-CD2 4.12Å
646	S	76.7	Confident	82.5	Confident	69 Å²	69	48.4 Å²	48.4	48%	0.483	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-41.8	-176	55.3	0	0	0	0	113.4	L642	L642-S646 PolarHBondContact O-N 3.47Å
647	D	76.1	Confident	82.8	Confident	85 Å²	85	44.1 Å²	44.1	46%	0.455	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-34	-173.2	-57.7	-2.5	0	0	0	112	H314 L645	H314-D647 IonicContact CD2-OD2 3.52Å; H314-D647 IonicContact CE1-OD2 3.89Å; H314-D647 IonicContact NE2-OD2 3.7Å; H314-D647 PolarHBondContact NE2-OD2 3.45Å; L645-D647 PolarHBondContact O-N 3.02Å
648	L	78.2	Confident	82.9	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-88.3	-11.6	-176.7	-62.8	178.3	0	0	0	113.7	L313 R350 L645 S650 E651 F654	L313-L648 HydrophobicContact CD1-CD1 3.45Å; L313-L648 VanDerWaalsContact CD1-CD1 3.45Å; L313-L648 HydrophobicContact CD1-CD2 4.42Å; L313-L648 HydrophobicContact CD1-CG 3.8Å; L313-L648 HydrophobicContact CD2-CD1 4.26Å; L313-L648 HydrophobicContact CG-CD1 4.5Å; R350-L648 HydrophobicContact CG-CD2 4.03Å; L645-L648 HydrophobicContact CD2-CB 4.28Å; L645-L648 HydrophobicContact CD2-CD1 3.82Å; L645-L648 PolarHBondContact O-N 2.77Å; L648-S650 PolarHBondContact O-N 3.37Å; L648-S650 VanDerWaalsContact O-N 3.08Å; L648-E651 PolarHBondContact O-N 2.9Å; L648-E651 VanDerWaalsContact O-N 3.11Å; L648-F654 HydrophobicContact CB-CD1 4.39Å; L648-F654 HydrophobicContact CB-CD2 4.26Å; L648-F654 HydrophobicContact CB-CE1 4.45Å; L648-F654 HydrophobicContact CB-CE2 4.34Å; L648-F654 HydrophobicContact CB-CG 4.29Å; L648-F654 HydrophobicContact CB-CZ 4.44Å; L648-F654 HydrophobicContact CD1-CE1 4.07Å; L648-F654 HydrophobicContact CD1-CE2 4.25Å; L648-F654 HydrophobicContact CD1-CZ 3.79Å; L648-F654 HydrophobicContact CD2-CE2 4.45Å; L648-F654 WeakPolarHBondContact O-CB 3.43Å
649	K	76	Confident	82.8	Confident	77 Å²	77	46.4 Å²	46.4	34%	0.335	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-55.3	-27	178.3	-84.8	173.5	-161.1	169	0	114.4	L642 L645 V655 L658	L642-K649 VanDerWaalsContact C-NZ 3.32Å; L642-K649 HydrophobicContact CD2-CD 4.3Å; L642-K649 HydrophobicContact CD2-CG 4.22Å; L642-K649 WeakPolarHBondContact O-CE 3.29Å; L642-K649 PolarHBondContact O-NZ 3.3Å; L645-K649 WeakPolarHBondContact O-CG 3.27Å; L645-K649 PolarHBondContact O-N 2.91Å; K649-V655 WeakPolarHBondContact O-CG2 3.5Å; K649-L658 HydrophobicContact CG-CD1 4.37Å
650	S	77.7	Confident	83.1	Confident	103 Å²	103	46.2 Å²	46.2	72%	0.72	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-83.1	-15.6	-176.4	64.6	0	0	0	0	113.2	L648	L648-S650 PolarHBondContact O-N 3.37Å; L648-S650 VanDerWaalsContact O-N 3.08Å
651	E	82.7	Confident	83.4	Confident	43 Å²	43	46.1 Å²	46.1	20%	0.201	27%	0.266	C	S	.	.	S	Bend	trans	-75.6	135.1	-177.3	-70.6	-170	-177.5	0	0	111.9	R350 L648 K653 F654 V655	R350-E651 IonicContact CZ-OE1 3.32Å; R350-E651 IonicContact NE-OE1 3.77Å; R350-E651 IonicContact NH1-OE1 2.75Å; R350-E651 PolarHBondContact NH1-OE1 3.46Å; L648-E651 PolarHBondContact O-N 2.9Å; L648-E651 VanDerWaalsContact O-N 3.11Å; E651-K653 VanDerWaalsContact C-N 3.27Å; E651-K653 PolarHBondContact O-N 2.91Å; E651-F654 HydrophobicContact CB-CD2 3.89Å; E651-F654 PolarHBondContact O-N 3.37Å; E651-F654 WeakPolarHBondContact OE2-CD2 3.32Å; E651-F654 WeakPolarHBondContact OE2-CE2 3.5Å; E651-V655 WeakPolarHBondContact O-CG2 3.41Å; E651-V655 PolarHBondContact O-N 3.23Å
652	P	83.4	Confident	83.6	Confident	104 Å²	104	50.3 Å²	50.3	68%	0.675	28%	0.284	S	S	*	.	H	α-helix	trans	-61.3	-34.4	-172.6	23.6	-34	0	0	0	113.3	T656	P652-T656 PolarHBondContact O-N 3.08Å; P652-T656 PolarHBondContact O-OG1 3.15Å
653	K	85	Confident	83.6	Confident	103 Å²	103	51.3 Å²	51.3	45%	0.448	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-51.6	174.8	-69.3	-178.2	-179.7	173.2	0	110.4	D351 F354 E651 V657	D351-K653 IonicContact OD1-NZ 3.83Å; D351-K653 PolarHBondContact OD1-NZ 2.88Å; D351-K653 VanDerWaalsContact OD1-NZ 3.12Å; F354-K653 HydrophobicContact CD2-CB 4.02Å; F354-K653 HydrophobicContact CE2-CB 3.64Å; F354-K653 HydrophobicContact CZ-CB 4.15Å; E651-K653 VanDerWaalsContact C-N 3.27Å; E651-K653 PolarHBondContact O-N 2.91Å; K653-V657 PolarHBondContact O-N 2.91Å
654	F	85.5	Confident	83.9	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.009	27%	0.268	C	S	.	.	H	α-helix	trans	-69.8	-40	-179.2	-73.5	-91.8	0	0	0	112.6	I353 F354 I357 L645 L648 E651 T656 V657 L658	I353-F654 HydrophobicContact CG2-CE1 4.12Å; I353-F654 HydrophobicContact CG2-CZ 4.47Å; F354-F654 HydrophobicContact CB-CE1 4.21Å; F354-F654 HydrophobicContact CB-CE2 4.21Å; F354-F654 HydrophobicContact CB-CZ 3.73Å; F354-F654 HydrophobicContact CD2-CD2 4.45Å; F354-F654 HydrophobicContact CD2-CE1 4.43Å; F354-F654 HydrophobicContact CD2-CE2 4.36Å; F354-F654 HydrophobicContact CD2-CZ 4.35Å; I357-F654 HydrophobicContact CD1-CD1 3.81Å; I357-F654 HydrophobicContact CD1-CE1 3.63Å; L645-F654 HydrophobicContact CD2-CE1 4.48Å; L648-F654 HydrophobicContact CB-CD1 4.39Å; L648-F654 HydrophobicContact CB-CD2 4.26Å; L648-F654 HydrophobicContact CB-CE1 4.45Å; L648-F654 HydrophobicContact CB-CE2 4.34Å; L648-F654 HydrophobicContact CB-CG 4.29Å; L648-F654 HydrophobicContact CB-CZ 4.44Å; L648-F654 HydrophobicContact CD1-CE1 4.07Å; L648-F654 HydrophobicContact CD1-CE2 4.25Å; L648-F654 HydrophobicContact CD1-CZ 3.79Å; L648-F654 HydrophobicContact CD2-CE2 4.45Å; L648-F654 WeakPolarHBondContact O-CB 3.43Å; E651-F654 HydrophobicContact CB-CD2 3.89Å; E651-F654 PolarHBondContact O-N 3.37Å; E651-F654 WeakPolarHBondContact OE2-CD2 3.32Å; E651-F654 WeakPolarHBondContact OE2-CE2 3.5Å; F654-T656 VanDerWaalsContact C-N 3.26Å; F654-T656 PolarHBondContact O-N 3.26Å; F654-V657 PolarHBondContact O-N 3.03Å; F654-L658 HydrophobicContact CB-CD1 4.31Å; F654-L658 VanDerWaalsContact O-CB 3.26Å; F654-L658 WeakPolarHBondContact O-CB 3.35Å; F654-L658 VanDerWaalsContact O-CG 3.22Å; F654-L658 WeakPolarHBondContact O-CG 3.37Å; F654-L658 PolarHBondContact O-N 3.43Å
655	V	85.1	Confident	84.1	Confident	72 Å²	72	47.9 Å²	47.9	44%	0.436	27%	0.266	S	S	.	.	H	α-helix	trans	-54.5	-45.4	177	172.1	0	0	0	0	111	K649 E651 S659	K649-V655 WeakPolarHBondContact O-CG2 3.5Å; E651-V655 WeakPolarHBondContact O-CG2 3.41Å; E651-V655 PolarHBondContact O-N 3.23Å; V655-S659 VanDerWaalsContact O-CB 3.26Å; V655-S659 WeakPolarHBondContact O-CB 3.24Å; V655-S659 PolarHBondContact O-N 3.11Å; V655-S659 PolarHBondContact O-OG 3.28Å
656	T	86.3	Confident	84.2	Confident	56 Å²	56	51.8 Å²	51.8	34%	0.344	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-48.5	-179.8	-54.5	0	0	0	0	111	L388 P652 F654 S659 K660	L388-T656 HydrophobicContact CD2-CG2 4.28Å; P652-T656 PolarHBondContact O-N 3.08Å; P652-T656 PolarHBondContact O-OG1 3.15Å; F654-T656 VanDerWaalsContact C-N 3.26Å; F654-T656 PolarHBondContact O-N 3.26Å; T656-S659 PolarHBondContact O-N 3.3Å; T656-S659 PolarHBondContact O-OG 2.84Å; T656-K660 PolarHBondContact O-N 3.11Å
657	V	87.8	Confident	84.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-46.1	-179	177.6	0	0	0	0	111.8	F354 I357 L361 L388 K653 F654 S659 K660 L661	F354-V657 HydrophobicContact CD2-CG2 4.46Å; F354-V657 HydrophobicContact CE2-CG2 3.57Å; F354-V657 HydrophobicContact CZ-CG2 4.1Å; I357-V657 HydrophobicContact CB-CG1 4.35Å; I357-V657 HydrophobicContact CG2-CG1 3.44Å; I357-V657 VanDerWaalsContact CG2-CG1 3.44Å; L361-V657 HydrophobicContact CD2-CG1 4.18Å; L388-V657 HydrophobicContact CD1-CG2 3.21Å; L388-V657 HydrophobicContact CD2-CG2 3.81Å; L388-V657 HydrophobicContact CG-CG2 4.13Å; K653-V657 PolarHBondContact O-N 2.91Å; F654-V657 PolarHBondContact O-N 3.03Å; V657-S659 VanDerWaalsContact C-N 3.3Å; V657-S659 PolarHBondContact O-N 3.43Å; V657-K660 PolarHBondContact O-N 3.1Å; V657-L661 HydrophobicContact CG1-CD1 3.55Å; V657-L661 WeakPolarHBondContact O-CD1 3.39Å; V657-L661 PolarHBondContact O-N 3.37Å
658	L	88.5	Confident	84.5	Confident	8 Å²	8	48.5 Å²	48.5	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-36.1	179	-69.2	173.4	0	0	0	111.6	Y638 I641 L642 L645 K649 F654 K660 L661 K662	Y638-L658 HydrophobicContact CE2-CD2 4.43Å; Y638-L658 PolarHBondContact OH-O 3.41Å; I641-L658 HydrophobicContact CG2-CD2 4.17Å; L642-L658 HydrophobicContact CD2-CD1 4.05Å; L642-L658 HydrophobicContact CD2-CD2 4.32Å; L645-L658 HydrophobicContact CD1-CD1 4.45Å; L645-L658 HydrophobicContact CD1-CD2 4.12Å; K649-L658 HydrophobicContact CG-CD1 4.37Å; F654-L658 HydrophobicContact CB-CD1 4.31Å; F654-L658 VanDerWaalsContact O-CB 3.26Å; F654-L658 WeakPolarHBondContact O-CB 3.35Å; F654-L658 VanDerWaalsContact O-CG 3.22Å; F654-L658 WeakPolarHBondContact O-CG 3.37Å; F654-L658 PolarHBondContact O-N 3.43Å; L658-K660 VanDerWaalsContact C-N 3.33Å; L658-K660 PolarHBondContact O-N 3.29Å; L658-L661 PolarHBondContact O-N 3.5Å; L658-K662 WeakPolarHBondContact O-CB 3.3Å; L658-K662 PolarHBondContact O-N 2.96Å
659	S	86.3	Confident	84.5	Confident	71 Å²	71	53.3 Å²	53.3	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-62.3	-40.2	174.7	75.7	0	0	0	0	112.3	V655 T656 V657 K662	V655-S659 VanDerWaalsContact O-CB 3.26Å; V655-S659 WeakPolarHBondContact O-CB 3.24Å; V655-S659 PolarHBondContact O-N 3.11Å; V655-S659 PolarHBondContact O-OG 3.28Å; T656-S659 PolarHBondContact O-N 3.3Å; T656-S659 PolarHBondContact O-OG 2.84Å; V657-S659 VanDerWaalsContact C-N 3.3Å; V657-S659 PolarHBondContact O-N 3.43Å; S659-K662 WeakPolarHBondContact O-CB 3.25Å
660	K	88.7	Confident	84.5	Confident	37 Å²	37	52 Å²	52	16%	0.161	30%	0.297	C	S	.	.	H	α-helix	trans	-69.6	-42.5	173.9	-66.9	-174.6	175.4	-172.2	0	111.4	L361 L388 T656 V657 L658 K662 F663 Y664	L361-K660 HydrophobicContact CD1-CB 3.72Å; L361-K660 HydrophobicContact CD2-CB 3.97Å; L361-K660 HydrophobicContact CD2-CD 3.94Å; L388-K660 HydrophobicContact CD2-CD 4.15Å; T656-K660 PolarHBondContact O-N 3.11Å; V657-K660 PolarHBondContact O-N 3.1Å; L658-K660 VanDerWaalsContact C-N 3.33Å; L658-K660 PolarHBondContact O-N 3.29Å; K660-K662 VanDerWaalsContact C-N 3.28Å; K660-K662 PolarHBondContact O-N 3.15Å; K660-F663 WeakPolarHBondContact O-CB 3.43Å; K660-F663 PolarHBondContact O-N 3.23Å; K660-Y664 WeakPolarHBondContact O-CD2 3.28Å
661	L	90.3	Very high	84.6	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-35	175.5	-98.4	118.7	0	0	0	112.8	I357 V360 L361 W637 Y638 V657 L658 F663 Y664 A665	I357-L661 HydrophobicContact CG2-CD1 3.55Å; V360-L661 HydrophobicContact CG1-CD2 3.92Å; L361-L661 HydrophobicContact CB-CD1 3.83Å; L361-L661 HydrophobicContact CB-CG 4.38Å; L361-L661 HydrophobicContact CD1-CD1 4.17Å; L361-L661 HydrophobicContact CD1-CG 4.11Å; L361-L661 HydrophobicContact CG-CD1 4.48Å; W637-L661 HydrophobicContact CH2-CD2 3.74Å; W637-L661 HydrophobicContact CZ3-CD2 3.58Å; Y638-L661 HydrophobicContact CD2-CB 4.22Å; Y638-L661 HydrophobicContact CE2-CB 3.96Å; V657-L661 HydrophobicContact CG1-CD1 3.55Å; V657-L661 WeakPolarHBondContact O-CD1 3.39Å; V657-L661 PolarHBondContact O-N 3.37Å; L658-L661 PolarHBondContact O-N 3.5Å; L661-F663 PolarHBondContact O-N 3.09Å; L661-Y664 PolarHBondContact O-N 3.37Å; L661-Y664 VanDerWaalsContact O-N 3.15Å; L661-A665 PolarHBondContact O-N 3.08Å
662	K	88.3	Confident	84.7	Confident	96 Å²	96	47.8 Å²	47.8	42%	0.417	27%	0.267	S	S	.	.	H	α-helix	trans	-57.5	-40	177.1	-173	-178.3	175.6	-177.8	0	111.7	Y638 L658 S659 K660 A665 Q666	Y638-K662 HydrophobicContact CE1-CB 4.31Å; Y638-K662 HydrophobicContact CE1-CG 4.24Å; Y638-K662 HydrophobicContact CE2-CB 4.09Å; L658-K662 WeakPolarHBondContact O-CB 3.3Å; L658-K662 PolarHBondContact O-N 2.96Å; S659-K662 WeakPolarHBondContact O-CB 3.25Å; K660-K662 VanDerWaalsContact C-N 3.28Å; K660-K662 PolarHBondContact O-N 3.15Å; K662-A665 PolarHBondContact O-N 3.35Å; K662-Q666 WeakPolarHBondContact O-CG 3.33Å; K662-Q666 PolarHBondContact O-N 2.82Å; K662-Q666 VanDerWaalsContact O-N 3.14Å
663	F	87.3	Confident	84.8	Confident	61 Å²	61	44.3 Å²	44.3	27%	0.268	25%	0.245	S	C	.	.	H	α-helix	trans	-57.6	-51.8	175.6	175	-98.6	0	0	0	110.5	I397 K660 L661 A665 Q666 L667	I397-F663 HydrophobicContact CG2-CE1 3.65Å; I397-F663 HydrophobicContact CG2-CE2 4.34Å; I397-F663 HydrophobicContact CG2-CZ 3.47Å; I397-F663 VanDerWaalsContact CG2-CZ 3.47Å; K660-F663 WeakPolarHBondContact O-CB 3.43Å; K660-F663 PolarHBondContact O-N 3.23Å; L661-F663 PolarHBondContact O-N 3.09Å; F663-A665 VanDerWaalsContact C-N 3.28Å; F663-A665 PolarHBondContact O-N 3.04Å; F663-Q666 WeakPolarHBondContact O-CB 3.43Å; F663-Q666 PolarHBondContact O-N 3.34Å; F663-L667 HydrophobicContact CD1-CD1 4.42Å; F663-L667 HydrophobicContact CE1-CD1 4.01Å; F663-L667 HydrophobicContact CE1-CD2 4.39Å; F663-L667 HydrophobicContact CE1-CG 4.41Å; F663-L667 HydrophobicContact CZ-CD2 4.24Å; F663-L667 PolarHBondContact O-N 3Å
664	Y	88.1	Confident	85	Confident	11 Å²	11	40.2 Å²	40.2	4%	0.043	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-30.8	178.2	-60.8	-71.1	0	0	0	113.4	L361 M364 E365 Y368 K660 L661 Q666 L667 F672	L361-Y664 HydrophobicContact CD1-CD2 3.81Å; L361-Y664 HydrophobicContact CD1-CE2 3.54Å; M364-Y664 HydrophobicContact CB-CG 4.26Å; E365-Y664 HydrophobicContact CB-CE2 4.49Å; E365-Y664 WeakPolarHBondContact CB-OH 3.43Å; E365-Y664 WeakPolarHBondContact CG-OH 2.94Å; Y368-Y664 HydrophobicContact CD1-CE1 4.31Å; Y368-Y664 HydrophobicContact CG-CE1 4.01Å; K660-Y664 WeakPolarHBondContact O-CD2 3.28Å; L661-Y664 PolarHBondContact O-N 3.37Å; L661-Y664 VanDerWaalsContact O-N 3.15Å; Y664-Q666 VanDerWaalsContact C-N 3.25Å; Y664-Q666 PolarHBondContact O-N 2.9Å; Y664-L667 HydrophobicContact CD1-CD1 3.89Å; Y664-L667 WeakPolarHBondContact O-CB 3.36Å; Y664-L667 PolarHBondContact O-N 3.13Å; Y664-F672 HydrophobicContact CD1-CZ 4.31Å
665	A	86.4	Confident	85	Confident	3 Å²	3	43 Å²	43	3%	0.025	24%	0.242	C	C	.	.	H	α-helix	trans	-72.1	-15.8	174.9	0	0	0	0	0	113.9	V634 A635 W637 Y638 L661 K662 F663	V634-A665 HydrophobicContact CG1-CB 3.79Å; A635-A665 HydrophobicContact CB-CB 4.34Å; A635-A665 WeakPolarHBondContact CB-O 3.32Å; A635-A665 PolarHBondContact N-O 3.11Å; W637-A665 HydrophobicContact CH2-CB 3.85Å; W637-A665 HydrophobicContact CZ2-CB 3.58Å; Y638-A665 HydrophobicContact CD1-CB 4.49Å; Y638-A665 HydrophobicContact CD2-CB 4.02Å; Y638-A665 HydrophobicContact CG-CB 3.78Å; L661-A665 PolarHBondContact O-N 3.08Å; K662-A665 PolarHBondContact O-N 3.35Å; F663-A665 VanDerWaalsContact C-N 3.28Å; F663-A665 PolarHBondContact O-N 3.04Å
666	Q	84.6	Confident	85.1	Confident	82 Å²	82	39.9 Å²	39.9	38%	0.383	22%	0.223	S	C	.	.	H	α-helix	trans	-91.1	-14.6	174.3	-70.6	172.5	-24.6	0	0	112.8	V634 K662 F663 Y664	V634-Q666 HydrophobicContact CG2-CG 4.27Å; K662-Q666 WeakPolarHBondContact O-CG 3.33Å; K662-Q666 PolarHBondContact O-N 2.82Å; K662-Q666 VanDerWaalsContact O-N 3.14Å; F663-Q666 WeakPolarHBondContact O-CB 3.43Å; F663-Q666 PolarHBondContact O-N 3.34Å; Y664-Q666 VanDerWaalsContact C-N 3.25Å; Y664-Q666 PolarHBondContact O-N 2.9Å
667	L	82.5	Confident	85.3	Confident	24 Å²	24	37.2 Å²	37.2	13%	0.126	21%	0.207	C	C	.	.	S	Bend	trans	-71.1	156.1	177.5	-66.2	-179.2	0	0	0	111.6	Y368 F663 Y664 L671 F672	Y368-L667 HydrophobicContact CD2-CD1 3.45Å; Y368-L667 VanDerWaalsContact CD2-CD1 3.45Å; Y368-L667 HydrophobicContact CE2-CD1 3.63Å; Y368-L667 HydrophobicContact CE2-CD2 4.44Å; Y368-L667 HydrophobicContact CG-CD1 4.38Å; F663-L667 HydrophobicContact CD1-CD1 4.42Å; F663-L667 HydrophobicContact CE1-CD1 4.01Å; F663-L667 HydrophobicContact CE1-CD2 4.39Å; F663-L667 HydrophobicContact CE1-CG 4.41Å; F663-L667 HydrophobicContact CZ-CD2 4.24Å; F663-L667 PolarHBondContact O-N 3Å; Y664-L667 HydrophobicContact CD1-CD1 3.89Å; Y664-L667 WeakPolarHBondContact O-CB 3.36Å; Y664-L667 PolarHBondContact O-N 3.13Å; L667-L671 HydrophobicContact CB-CD1 3.97Å; L667-L671 HydrophobicContact CD1-CD1 4.29Å; L667-L671 HydrophobicContact CD2-CD1 4.42Å; L667-L671 HydrophobicContact CG-CD1 4.47Å; L667-F672 HydrophobicContact CB-CE2 4.05Å; L667-F672 HydrophobicContact CB-CZ 4.35Å; L667-F672 HydrophobicContact CD1-CZ 4.09Å
668	S	76	Confident	85.5	Confident	61 Å²	61	37.6 Å²	37.6	43%	0.427	21%	0.209	S	C	.	.			trans	-61.2	132.7	177.3	-178.6	0	0	0	0	110.8	S670 L671	S668-S670 PolarHBondContact O-N 3.46Å; S668-S670 PolarHBondContact OG-N 3.38Å; S668-S670 PolarHBondContact OG-OG 2.91Å; S668-L671 WeakPolarHBondContact O-CB 3.39Å; S668-L671 PolarHBondContact O-N 3.23Å
669	P	78.2	Confident	85.4	Confident	104 Å²	104	41.6 Å²	41.6	68%	0.675	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-55.2	-24.6	174.7	-25.9	34	0	0	0	113.9	L671 F672	P669-L671 PolarHBondContact O-N 2.88Å; P669-F672 PolarHBondContact O-N 3.39Å; P669-F672 VanDerWaalsContact O-N 3.08Å
670	S	75.8	Confident	85.6	Confident	49 Å²	49	38.2 Å²	38.2	34%	0.343	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-64.7	-17.8	177.7	58.5	0	0	0	0	114.4	D578 S668 F672 T673	D578-S670 WeakPolarHBondContact OD2-CB 3.3Å; S668-S670 PolarHBondContact O-N 3.46Å; S668-S670 PolarHBondContact OG-N 3.38Å; S668-S670 PolarHBondContact OG-OG 2.91Å; S670-F672 VanDerWaalsContact C-N 3.3Å; S670-T673 WeakPolarHBondContact O-CG2 3.36Å
671	L	79.8	Confident	85.7	Confident	46 Å²	46	36.4 Å²	36.4	24%	0.241	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-73.8	-24.4	173.9	-68.4	168	0	0	0	112.2	L667 S668 P669	L667-L671 HydrophobicContact CB-CD1 3.97Å; L667-L671 HydrophobicContact CD1-CD1 4.29Å; L667-L671 HydrophobicContact CD2-CD1 4.42Å; L667-L671 HydrophobicContact CG-CD1 4.47Å; S668-L671 WeakPolarHBondContact O-CB 3.39Å; S668-L671 PolarHBondContact O-N 3.23Å; P669-L671 PolarHBondContact O-N 2.88Å
672	F	85.3	Confident	85.6	Confident	12 Å²	12	39.3 Å²	39.3	5%	0.053	21%	0.212	C	C	.	.	S	Bend	trans	-105.8	79.8	-174.9	-54.3	-70.3	0	0	0	110.6	M364 M367 Y664 L667 P669 S670 I705	M364-F672 HydrophobicContact CE-CD1 3.64Å; M364-F672 HydrophobicContact CE-CD2 3.92Å; M364-F672 HydrophobicContact CE-CE1 3.33Å; M364-F672 HydrophobicContact CE-CE2 3.62Å; M364-F672 HydrophobicContact CE-CG 3.93Å; M364-F672 HydrophobicContact CE-CZ 3.31Å; M364-F672 HydrophobicContact SD-CD1 3.79Å; M364-F672 HydrophobicContact SD-CE1 3.86Å; M364-F672 HydrophobicContact SD-CG 4.34Å; M364-F672 HydrophobicContact SD-CZ 4.43Å; M367-F672 HydrophobicContact CB-CD1 4.05Å; M367-F672 HydrophobicContact CB-CE1 4.4Å; M367-F672 HydrophobicContact CE-CB 3.74Å; M367-F672 HydrophobicContact CE-CD1 3.93Å; M367-F672 HydrophobicContact CE-CG 4.34Å; M367-F672 HydrophobicContact SD-CD1 4.4Å; Y664-F672 HydrophobicContact CD1-CZ 4.31Å; L667-F672 HydrophobicContact CB-CE2 4.05Å; L667-F672 HydrophobicContact CB-CZ 4.35Å; L667-F672 HydrophobicContact CD1-CZ 4.09Å; P669-F672 PolarHBondContact O-N 3.39Å; P669-F672 VanDerWaalsContact O-N 3.08Å; S670-F672 VanDerWaalsContact C-N 3.3Å; F672-I705 HydrophobicContact CB-CG2 3.77Å; F672-I705 HydrophobicContact CD2-CG2 4.41Å; F672-I705 HydrophobicContact CG-CG2 4.14Å
673	T	86.2	Confident	85.5	Confident	32 Å²	32	36.9 Å²	36.9	20%	0.196	21%	0.208	C	C	.	.			trans	-93.7	157.5	-179.3	66.8	0	0	0	0	112.3	S670 M675 S676 F677	S670-T673 WeakPolarHBondContact O-CG2 3.36Å; T673-M675 PolarHBondContact O-N 2.96Å; T673-M675 VanDerWaalsContact O-N 3.15Å; T673-S676 PolarHBondContact N-OG 2.88Å; T673-S676 PolarHBondContact O-N 3Å; T673-S676 VanDerWaalsContact O-N 3.14Å; T673-S676 PolarHBondContact O-OG 3.22Å; T673-S676 PolarHBondContact OG1-N 3.45Å; T673-S676 PolarHBondContact OG1-OG 3.07Å; T673-F677 WeakPolarHBondContact O-CB 3.35Å; T673-F677 PolarHBondContact O-N 3.33Å
674	V	87.7	Confident	85.5	Confident	17 Å²	17	34.3 Å²	34.3	10%	0.103	20%	0.197	C	C	.	.	H	α-helix	trans	-53.1	-34.7	170.9	-173.7	0	0	0	0	111.3	T678 V706 M708	V674-T678 HydrophobicContact CG1-CG2 4.32Å; V674-T678 WeakPolarHBondContact O-CB 3.32Å; V674-T678 WeakPolarHBondContact O-CG2 3.47Å; V674-T678 PolarHBondContact O-N 3.02Å; V674-T678 PolarHBondContact O-OG1 3.48Å; V674-V706 VanDerWaalsContact CA-CG1 3.47Å; V674-V706 HydrophobicContact CB-CG1 3.93Å; V674-V706 HydrophobicContact CG1-CG1 4.44Å; V674-V706 HydrophobicContact CG2-CG1 3.47Å; V674-V706 VanDerWaalsContact CG2-CG1 3.47Å; V674-M708 HydrophobicContact CG1-CB 4.39Å; V674-M708 HydrophobicContact CG1-CE 4.07Å; V674-M708 HydrophobicContact CG1-CG 4.2Å; V674-M708 HydrophobicContact CG1-SD 3.93Å; V674-M708 HydrophobicContact CG2-CB 4.46Å
675	M	85.3	Confident	85.4	Confident	60 Å²	60	36.1 Å²	36.1	30%	0.296	21%	0.209	S	C	.	.	H	α-helix	trans	-69.9	-48.8	177.8	-66.4	-60.4	89.5	0	0	112.2	T673 F677 T678 R679	T673-M675 PolarHBondContact O-N 2.96Å; T673-M675 VanDerWaalsContact O-N 3.15Å; M675-F677 VanDerWaalsContact C-N 3.26Å; M675-F677 PolarHBondContact O-N 3.42Å; M675-T678 PolarHBondContact O-N 3.33Å; M675-T678 PolarHBondContact O-OG1 2.9Å; M675-R679 WeakPolarHBondContact O-CB 3.25Å; M675-R679 VanDerWaalsContact O-CG 3.26Å; M675-R679 WeakPolarHBondContact O-CG 3.3Å; M675-R679 PolarHBondContact O-N 3.42Å
676	S	87.6	Confident	85.3	Confident	6 Å²	6	37.7 Å²	37.7	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-42.1	174.1	61.1	0	0	0	0	111.3	M367 T673 R679 V680	M367-S676 WeakPolarHBondContact CE-OG 3.44Å; T673-S676 PolarHBondContact N-OG 2.88Å; T673-S676 PolarHBondContact O-N 3Å; T673-S676 VanDerWaalsContact O-N 3.14Å; T673-S676 PolarHBondContact O-OG 3.22Å; T673-S676 PolarHBondContact OG1-N 3.45Å; T673-S676 PolarHBondContact OG1-OG 3.07Å; S676-R679 PolarHBondContact O-N 3.34Å; S676-V680 WeakPolarHBondContact O-CG2 3.42Å; S676-V680 PolarHBondContact O-N 3.41Å
677	F	91.7	Very high	85.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-55.1	178	179.1	-119.4	0	0	0	112.1	I363 M367 T673 M675 R679 V680 L681 I698 I701 R702 V706 M708	I363-F677 HydrophobicContact CG2-CD2 4.14Å; I363-F677 HydrophobicContact CG2-CE2 4.2Å; M367-F677 HydrophobicContact CE-CB 3.77Å; M367-F677 HydrophobicContact SD-CB 4.09Å; M367-F677 HydrophobicContact SD-CD2 3.98Å; T673-F677 WeakPolarHBondContact O-CB 3.35Å; T673-F677 PolarHBondContact O-N 3.33Å; M675-F677 VanDerWaalsContact C-N 3.26Å; M675-F677 PolarHBondContact O-N 3.42Å; F677-R679 VanDerWaalsContact C-N 3.29Å; F677-R679 PolarHBondContact O-N 3.11Å; F677-V680 PolarHBondContact O-N 2.98Å; F677-V680 VanDerWaalsContact O-N 3.14Å; F677-L681 HydrophobicContact CD1-CD1 4.14Å; F677-L681 HydrophobicContact CD2-CG 4.41Å; F677-L681 HydrophobicContact CE1-CD1 3.65Å; F677-L681 HydrophobicContact CE1-CG 4.47Å; F677-L681 HydrophobicContact CE2-CD1 4.1Å; F677-L681 HydrophobicContact CE2-CD2 4.17Å; F677-L681 HydrophobicContact CE2-CG 4.21Å; F677-L681 HydrophobicContact CZ-CD1 3.66Å; F677-L681 HydrophobicContact CZ-CD2 4.45Å; F677-L681 HydrophobicContact CZ-CG 4.28Å; F677-L681 WeakPolarHBondContact O-CG 3.46Å; F677-L681 PolarHBondContact O-N 3.14Å; F677-I698 HydrophobicContact CZ-CB 4.5Å; F677-I698 HydrophobicContact CZ-CG2 3.8Å; F677-I701 HydrophobicContact CD2-CG2 3.66Å; F677-I701 HydrophobicContact CE2-CB 3.92Å; F677-I701 HydrophobicContact CE2-CG2 3.54Å; F677-I701 HydrophobicContact CZ-CB 4.5Å; F677-I701 HydrophobicContact CZ-CG2 4.33Å; F677-R702 HydrophobicContact CE1-CB 4.17Å; F677-R702 HydrophobicContact CZ-CB 4.12Å; F677-V706 HydrophobicContact CB-CG1 4.33Å; F677-V706 HydrophobicContact CB-CG2 4.03Å; F677-V706 HydrophobicContact CD1-CG1 4.36Å; F677-V706 HydrophobicContact CG-CG2 4.2Å; F677-M708 HydrophobicContact CD1-SD 4.08Å; F677-M708 HydrophobicContact CE1-SD 4.06Å
678	T	90.4	Very high	85.7	Confident	9 Å²	9	43.9 Å²	43.9	6%	0.055	24%	0.237	C	C	.	.	H	α-helix	trans	-63.3	-32.8	179.8	50.1	0	0	0	0	112.8	V674 M675 L681 S682 M708 W716	V674-T678 HydrophobicContact CG1-CG2 4.32Å; V674-T678 WeakPolarHBondContact O-CB 3.32Å; V674-T678 WeakPolarHBondContact O-CG2 3.47Å; V674-T678 PolarHBondContact O-N 3.02Å; V674-T678 PolarHBondContact O-OG1 3.48Å; M675-T678 PolarHBondContact O-N 3.33Å; M675-T678 PolarHBondContact O-OG1 2.9Å; T678-L681 PolarHBondContact O-N 3.06Å; T678-S682 WeakPolarHBondContact O-CB 3.49Å; T678-S682 PolarHBondContact O-N 3.46Å; T678-S682 PolarHBondContact O-OG 2.95Å; T678-S682 VanDerWaalsContact O-OG 3.1Å; T678-M708 HydrophobicContact CG2-CE 3.89Å; T678-M708 HydrophobicContact CG2-SD 4.37Å; T678-W716 HydrophobicContact CG2-CD2 4.12Å; T678-W716 HydrophobicContact CG2-CG 3.99Å; T678-W716 WeakPolarHBondContact O-CZ2 3.26Å
679	R	88.3	Confident	86.2	Confident	91 Å²	91	41 Å²	41	34%	0.343	22%	0.217	S	C	.	.	H	α-helix	trans	-64.7	-43.4	172.4	-72.9	-179.2	91.4	160	8.5	112.3	L370 E571 M675 S676 F677 S682 S683	L370-R679 HydrophobicContact CD1-CB 3.85Å; E571-R679 IonicContact OE1-NH1 3.06Å; M675-R679 WeakPolarHBondContact O-CB 3.25Å; M675-R679 VanDerWaalsContact O-CG 3.26Å; M675-R679 WeakPolarHBondContact O-CG 3.3Å; M675-R679 PolarHBondContact O-N 3.42Å; S676-R679 PolarHBondContact O-N 3.34Å; F677-R679 VanDerWaalsContact C-N 3.29Å; F677-R679 PolarHBondContact O-N 3.11Å; R679-S682 PolarHBondContact O-N 3.44Å; R679-S683 PolarHBondContact O-N 2.94Å
680	V	89.5	Confident	86.6	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-45.9	172.8	172.8	0	0	0	0	110.4	W362 I363 Q366 M367 L370 W379 S676 F677 S682 S683	W362-V680 HydrophobicContact CH2-CG1 4.17Å; W362-V680 HydrophobicContact CZ3-CG1 3.79Å; I363-V680 HydrophobicContact CG2-CG1 4.19Å; Q366-V680 HydrophobicContact CB-CB 4.3Å; Q366-V680 HydrophobicContact CB-CG1 3.66Å; Q366-V680 HydrophobicContact CB-CG2 3.57Å; Q366-V680 HydrophobicContact CG-CG1 4.06Å; M367-V680 HydrophobicContact CB-CG2 4.43Å; M367-V680 HydrophobicContact CG-CB 4.42Å; M367-V680 HydrophobicContact CG-CG2 3.69Å; L370-V680 HydrophobicContact CD1-CG2 3.55Å; L370-V680 HydrophobicContact CG-CG2 4.39Å; W379-V680 HydrophobicContact CH2-CB 4.49Å; W379-V680 HydrophobicContact CH2-CG2 4.05Å; W379-V680 HydrophobicContact CZ3-CB 4.32Å; W379-V680 HydrophobicContact CZ3-CG1 4.23Å; W379-V680 HydrophobicContact CZ3-CG2 4.05Å; S676-V680 WeakPolarHBondContact O-CG2 3.42Å; S676-V680 PolarHBondContact O-N 3.41Å; F677-V680 PolarHBondContact O-N 2.98Å; F677-V680 VanDerWaalsContact O-N 3.14Å; V680-S682 VanDerWaalsContact C-N 3.33Å; V680-S682 PolarHBondContact O-N 2.9Å; V680-S683 WeakPolarHBondContact O-CB 3.43Å; V680-S683 PolarHBondContact O-N 3.11Å; V680-S683 PolarHBondContact O-OG 3.32Å
681	L	91.4	Very high	87.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.8	-36.1	179.5	-60.7	-171.9	0	0	0	112.8	F677 T678 S683 L684 I698 Y713 W716	F677-L681 HydrophobicContact CD1-CD1 4.14Å; F677-L681 HydrophobicContact CD2-CG 4.41Å; F677-L681 HydrophobicContact CE1-CD1 3.65Å; F677-L681 HydrophobicContact CE1-CG 4.47Å; F677-L681 HydrophobicContact CE2-CD1 4.1Å; F677-L681 HydrophobicContact CE2-CD2 4.17Å; F677-L681 HydrophobicContact CE2-CG 4.21Å; F677-L681 HydrophobicContact CZ-CD1 3.66Å; F677-L681 HydrophobicContact CZ-CD2 4.45Å; F677-L681 HydrophobicContact CZ-CG 4.28Å; F677-L681 WeakPolarHBondContact O-CG 3.46Å; F677-L681 PolarHBondContact O-N 3.14Å; T678-L681 PolarHBondContact O-N 3.06Å; L681-S683 PolarHBondContact O-N 3.2Å; L681-L684 HydrophobicContact CD2-CD1 4.31Å; L681-L684 WeakPolarHBondContact O-CB 3.28Å; L681-L684 PolarHBondContact O-N 3.38Å; L681-I698 HydrophobicContact CD1-CG2 4.09Å; L681-I698 HydrophobicContact CD2-CD1 3.78Å; L681-I698 HydrophobicContact CD2-CG1 3.75Å; L681-Y713 HydrophobicContact CD1-CD2 4.49Å; L681-Y713 HydrophobicContact CD1-CE2 3.9Å; L681-W716 HydrophobicContact CB-CH2 3.29Å; L681-W716 HydrophobicContact CB-CZ2 3.78Å; L681-W716 HydrophobicContact CB-CZ3 4.03Å; L681-W716 HydrophobicContact CD1-CH2 4.06Å; L681-W716 HydrophobicContact CD1-CZ3 3.94Å; L681-W716 HydrophobicContact CG-CH2 4.34Å
682	S	87.5	Confident	87.4	Confident	61 Å²	61	38 Å²	38	43%	0.427	20%	0.197	S	C	.	.	H	α-helix	trans	-63.5	-19.6	174.1	-69.6	0	0	0	0	113.6	T678 R679 V680 L684 W716	T678-S682 WeakPolarHBondContact O-CB 3.49Å; T678-S682 PolarHBondContact O-N 3.46Å; T678-S682 PolarHBondContact O-OG 2.95Å; T678-S682 VanDerWaalsContact O-OG 3.1Å; R679-S682 PolarHBondContact O-N 3.44Å; V680-S682 VanDerWaalsContact C-N 3.33Å; V680-S682 PolarHBondContact O-N 2.9Å; S682-L684 VanDerWaalsContact C-N 3.34Å; S682-W716 WeakPolarHBondContact OG-CZ2 3.25Å
683	S	86.4	Confident	87.5	Confident	46 Å²	46	38 Å²	38	32%	0.322	20%	0.199	S	C	.	.	H	α-helix	trans	-77.9	-20.3	174.3	79.3	0	0	0	0	113.2	W379 R679 V680 L681	W379-S683 VanDerWaalsContact CE3-OG 3.24Å; W379-S683 WeakPolarHBondContact CZ3-OG 3.41Å; R679-S683 PolarHBondContact O-N 2.94Å; V680-S683 WeakPolarHBondContact O-CB 3.43Å; V680-S683 PolarHBondContact O-N 3.11Å; V680-S683 PolarHBondContact O-OG 3.32Å; L681-S683 PolarHBondContact O-N 3.2Å
684	L	87.4	Confident	87.6	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.037	19%	0.191	C	C	.	.	S	Bend	trans	-83.8	149.3	180	-65.7	175.8	0	0	0	111.1	W362 I382 L681 S682 E688 I689 Y721	W362-L684 HydrophobicContact CH2-CD1 4.44Å; W362-L684 HydrophobicContact CH2-CD2 3.51Å; W362-L684 HydrophobicContact CH2-CG 4.09Å; W362-L684 HydrophobicContact CZ2-CD2 4.31Å; W362-L684 HydrophobicContact CZ3-CD1 4.02Å; W362-L684 HydrophobicContact CZ3-CD2 3.85Å; W362-L684 HydrophobicContact CZ3-CG 4.17Å; I382-L684 HydrophobicContact CB-CD2 4.07Å; I382-L684 HydrophobicContact CD1-CD1 4.26Å; I382-L684 HydrophobicContact CG2-CD2 4.42Å; L681-L684 HydrophobicContact CD2-CD1 4.31Å; L681-L684 WeakPolarHBondContact O-CB 3.28Å; L681-L684 PolarHBondContact O-N 3.38Å; S682-L684 VanDerWaalsContact C-N 3.34Å; L684-E688 HydrophobicContact CB-CB 4.24Å; L684-E688 HydrophobicContact CD2-CB 4.32Å; L684-I689 HydrophobicContact CB-CD1 4.23Å; L684-I689 HydrophobicContact CB-CG1 3.74Å; L684-I689 HydrophobicContact CD1-CG1 4.27Å; L684-Y721 PolarHBondContact O-OH 2.98Å
685	T	86.2	Confident	87.7	Confident	48 Å²	48	36 Å²	36	29%	0.294	19%	0.188	S	C	.	.			trans	-75.1	158.1	169.7	58.8	0	0	0	0	110.9	W687 E688 I689	T685-W687 VanDerWaalsContact C-N 3.32Å; T685-W687 VanDerWaalsContact CB-CE2 3.46Å; T685-W687 HydrophobicContact CG2-CZ2 3.74Å; T685-W687 PolarHBondContact O-N 3.37Å; T685-W687 PolarHBondContact OG1-NE1 3.33Å; T685-E688 WeakPolarHBondContact CB-OE2 3.19Å; T685-E688 PolarHBondContact N-OE2 2.94Å; T685-E688 WeakPolarHBondContact O-CB 3.48Å; T685-E688 PolarHBondContact O-N 2.95Å; T685-E688 WeakPolarHBondContact OG1-CG 3.35Å; T685-E688 PolarHBondContact OG1-OE2 3.42Å; T685-I689 PolarHBondContact O-N 2.95Å
686	L	84.7	Confident	87.9	Confident	36 Å²	36	33.1 Å²	33.1	19%	0.188	17%	0.174	C	C	.	.	H	α-helix	trans	-56.8	-44.8	-177	177.5	53.4	0	0	0	112.8	E688 I689 L690 Y721 I724	L686-E688 VanDerWaalsContact C-N 3.28Å; L686-E688 PolarHBondContact O-N 3.48Å; L686-I689 PolarHBondContact O-N 3.44Å; L686-L690 HydrophobicContact CD1-CD1 3.64Å; L686-L690 HydrophobicContact CD1-CD2 4.37Å; L686-L690 HydrophobicContact CD1-CG 3.75Å; L686-L690 HydrophobicContact CD2-CD1 4.5Å; L686-L690 HydrophobicContact CG-CD1 3.86Å; L686-L690 HydrophobicContact CG-CG 4.31Å; L686-L690 WeakPolarHBondContact O-CB 3.36Å; L686-L690 VanDerWaalsContact O-CG 3.27Å; L686-L690 WeakPolarHBondContact O-CG 3.49Å; L686-L690 PolarHBondContact O-N 3.45Å; L686-Y721 HydrophobicContact CB-CD1 4.12Å; L686-Y721 HydrophobicContact CB-CE1 4.19Å; L686-Y721 HydrophobicContact CD1-CD1 4.5Å; L686-Y721 HydrophobicContact CD1-CD2 4.32Å; L686-Y721 HydrophobicContact CD1-CG 4.18Å; L686-I724 HydrophobicContact CD1-CD1 3.22Å; L686-I724 HydrophobicContact CD1-CG1 3.76Å; L686-I724 HydrophobicContact CD2-CD1 4.14Å; L686-I724 HydrophobicContact CD2-CG1 3.77Å; L686-I724 HydrophobicContact CG-CD1 4.31Å; L686-I724 HydrophobicContact CG-CG1 4.41Å
687	W	85.5	Confident	88	Confident	192 Å²	192	32.9 Å²	32.9	73%	0.727	17%	0.172	S	C	*	.	H	α-helix	trans	-68.1	-26.5	178.1	45.7	80.7	0	0	0	113.1	T685 S691	T685-W687 VanDerWaalsContact C-N 3.32Å; T685-W687 VanDerWaalsContact CB-CE2 3.46Å; T685-W687 HydrophobicContact CG2-CZ2 3.74Å; T685-W687 PolarHBondContact O-N 3.37Å; T685-W687 PolarHBondContact OG1-NE1 3.33Å; W687-S691 PolarHBondContact O-N 2.99Å; W687-S691 VanDerWaalsContact O-N 3.12Å
688	E	88.2	Confident	88	Confident	45 Å²	45	32.9 Å²	32.9	21%	0.21	17%	0.172	C	C	.	.	H	α-helix	trans	-71.4	-35.7	171	-74.3	169.2	139	0	0	111.7	I382 L684 T685 L686 S694	I382-E688 HydrophobicContact CG2-CB 4.16Å; I382-E688 HydrophobicContact CG2-CG 3.88Å; L684-E688 HydrophobicContact CB-CB 4.24Å; L684-E688 HydrophobicContact CD2-CB 4.32Å; T685-E688 WeakPolarHBondContact CB-OE2 3.19Å; T685-E688 PolarHBondContact N-OE2 2.94Å; T685-E688 WeakPolarHBondContact O-CB 3.48Å; T685-E688 PolarHBondContact O-N 2.95Å; T685-E688 WeakPolarHBondContact OG1-CG 3.35Å; T685-E688 PolarHBondContact OG1-OE2 3.42Å; L686-E688 VanDerWaalsContact C-N 3.28Å; L686-E688 PolarHBondContact O-N 3.48Å; E688-S694 VanDerWaalsContact O-CB 3.23Å; E688-S694 WeakPolarHBondContact O-CB 3.43Å; E688-S694 PolarHBondContact O-OG 3.37Å
689	I	86.9	Confident	87.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70.2	-38.8	175.5	-65.5	170.7	0	0	0	111.1	L684 T685 L686 S691 I698 Y713 W716 L717 Y721	L684-I689 HydrophobicContact CB-CD1 4.23Å; L684-I689 HydrophobicContact CB-CG1 3.74Å; L684-I689 HydrophobicContact CD1-CG1 4.27Å; T685-I689 PolarHBondContact O-N 2.95Å; L686-I689 PolarHBondContact O-N 3.44Å; I689-S691 VanDerWaalsContact C-N 3.34Å; I689-I698 HydrophobicContact CB-CD1 4.38Å; I689-I698 HydrophobicContact CG2-CD1 3.86Å; I689-Y713 WeakPolarHBondContact CG2-OH 3.23Å; I689-W716 HydrophobicContact CD1-CH2 4.4Å; I689-L717 HydrophobicContact CG2-CD1 4.15Å; I689-Y721 HydrophobicContact CD1-CE2 3.62Å
690	L	86.5	Confident	88	Confident	41 Å²	41	28.8 Å²	28.8	22%	0.215	16%	0.156	C	C	.	.	S	Bend	trans	-86.5	0.2	-177.4	-60.4	-177.5	0	0	0	113.9	F297 L686	F297-L690 HydrophobicContact CB-CD2 4.04Å; F297-L690 HydrophobicContact CD1-CD2 3.86Å; F297-L690 HydrophobicContact CD2-CD2 3.5Å; F297-L690 VanDerWaalsContact CD2-CD2 3.5Å; F297-L690 HydrophobicContact CE1-CD1 4.4Å; F297-L690 HydrophobicContact CE1-CD2 4.18Å; F297-L690 HydrophobicContact CE2-CD2 3.84Å; F297-L690 HydrophobicContact CG-CD2 3.51Å; F297-L690 HydrophobicContact CZ-CD2 4.18Å; L686-L690 HydrophobicContact CD1-CD1 3.64Å; L686-L690 HydrophobicContact CD1-CD2 4.37Å; L686-L690 HydrophobicContact CD1-CG 3.75Å; L686-L690 HydrophobicContact CD2-CD1 4.5Å; L686-L690 HydrophobicContact CG-CD1 3.86Å; L686-L690 HydrophobicContact CG-CG 4.31Å; L686-L690 WeakPolarHBondContact O-CB 3.36Å; L686-L690 VanDerWaalsContact O-CG 3.27Å; L686-L690 WeakPolarHBondContact O-CG 3.49Å; L686-L690 PolarHBondContact O-N 3.45Å
691	S	86.4	Confident	88	Confident	44 Å²	44	28.8 Å²	28.8	31%	0.308	16%	0.156	S	C	.	.	S	Bend	trans	-65.3	138.9	175.2	177.8	0	0	0	0	109.9	W687 I689 A693 S694 A695	W687-S691 PolarHBondContact O-N 2.99Å; W687-S691 VanDerWaalsContact O-N 3.12Å; I689-S691 VanDerWaalsContact C-N 3.34Å; S691-A693 VanDerWaalsContact C-N 3.28Å; S691-A693 PolarHBondContact O-N 2.86Å; S691-A693 VanDerWaalsContact O-N 3.15Å; S691-S694 WeakPolarHBondContact CB-OG 3.33Å; S691-S694 PolarHBondContact O-N 3.14Å; S691-S694 PolarHBondContact O-OG 2.96Å; S691-A695 VanDerWaalsContact O-CB 3.31Å; S691-A695 WeakPolarHBondContact O-CB 3.35Å; S691-A695 PolarHBondContact O-N 3.15Å
692	P	85.9	Confident	88	Confident	50 Å²	50	29.1 Å²	29.1	33%	0.325	16%	0.158	S	C	.	.	H	α-helix	trans	-49.3	-44.3	-177	-33.2	37.7	0	0	0	114.4	P299 V696	P299-P692 HydrophobicContact CG-CB 3.65Å; P692-V696 VanDerWaalsContact O-CG2 3.29Å; P692-V696 WeakPolarHBondContact O-CG2 3.37Å; P692-V696 PolarHBondContact O-N 2.8Å
693	A	86.9	Confident	87.9	Confident	12 Å²	12	27.6 Å²	27.6	10%	0.099	15%	0.146	C	C	.	.	H	α-helix	trans	-73.6	-38.1	-176.3	0	0	0	0	0	113.1	T355 Q356 S691 A697	T355-A693 HydrophobicContact CG2-CB 3.6Å; Q356-A693 HydrophobicContact CG-CB 4.07Å; S691-A693 VanDerWaalsContact C-N 3.28Å; S691-A693 PolarHBondContact O-N 2.86Å; S691-A693 VanDerWaalsContact O-N 3.15Å; A693-A697 PolarHBondContact O-N 2.89Å
694	S	89.2	Confident	87.8	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-75.8	-38.6	177.8	54.8	0	0	0	0	111.7	E688 S691 V696 A697 I698	E688-S694 VanDerWaalsContact O-CB 3.23Å; E688-S694 WeakPolarHBondContact O-CB 3.43Å; E688-S694 PolarHBondContact O-OG 3.37Å; S691-S694 WeakPolarHBondContact CB-OG 3.33Å; S691-S694 PolarHBondContact O-N 3.14Å; S691-S694 PolarHBondContact O-OG 2.96Å; S694-V696 VanDerWaalsContact C-N 3.27Å; S694-V696 PolarHBondContact O-N 3.29Å; S694-A697 PolarHBondContact O-N 2.8Å; S694-I698 WeakPolarHBondContact O-CB 3.42Å; S694-I698 WeakPolarHBondContact O-CG1 3.45Å; S694-I698 PolarHBondContact O-N 3.01Å
695	A	89.2	Confident	87.7	Confident	6 Å²	6	27.1 Å²	27.1	5%	0.05	14%	0.138	C	C	.	.	H	α-helix	trans	-56.7	-43.5	175.1	0	0	0	0	0	111.1	S691 D699	S691-A695 VanDerWaalsContact O-CB 3.31Å; S691-A695 WeakPolarHBondContact O-CB 3.35Å; S691-A695 PolarHBondContact O-N 3.15Å; A695-D699 VanDerWaalsContact O-CB 3.27Å; A695-D699 WeakPolarHBondContact O-CB 3.47Å; A695-D699 PolarHBondContact O-N 3.18Å
696	V	89.4	Confident	87.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.2	-48.8	172.1	171	0	0	0	0	111.8	T298 P299 N303 I304 C305 Q356 P692 S694 I698 D699 F700	T298-V696 HydrophobicContact CG2-CG2 3.86Å; P299-V696 HydrophobicContact CG-CG2 4.22Å; N303-V696 HydrophobicContact CB-CG2 4.35Å; N303-V696 WeakPolarHBondContact OD1-CG1 3.48Å; I304-V696 HydrophobicContact CB-CG1 4.49Å; I304-V696 HydrophobicContact CD1-CG1 4.18Å; I304-V696 HydrophobicContact CG1-CG1 3.34Å; C305-V696 PolarHBondContact SG-O 3.26Å; Q356-V696 HydrophobicContact CB-CG1 4.41Å; Q356-V696 HydrophobicContact CG-CB 4.15Å; Q356-V696 HydrophobicContact CG-CG1 4.09Å; P692-V696 VanDerWaalsContact O-CG2 3.29Å; P692-V696 WeakPolarHBondContact O-CG2 3.37Å; P692-V696 PolarHBondContact O-N 2.8Å; S694-V696 VanDerWaalsContact C-N 3.27Å; S694-V696 PolarHBondContact O-N 3.29Å; V696-I698 VanDerWaalsContact C-N 3.34Å; V696-I698 PolarHBondContact O-N 3.25Å; V696-D699 PolarHBondContact O-N 3.31Å; V696-F700 WeakPolarHBondContact O-CB 3.21Å; V696-F700 PolarHBondContact O-N 2.91Å
697	A	91.4	Very high	87.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.3	-40.9	-179.6	0	0	0	0	0	112.8	C359 V360 I363 A693 S694 D699 F700 I701	C359-A697 HydrophobicContact CB-CB 3.46Å; C359-A697 VanDerWaalsContact CB-CB 3.46Å; V360-A697 HydrophobicContact CB-CB 4.49Å; V360-A697 HydrophobicContact CG2-CB 3.6Å; I363-A697 HydrophobicContact CD1-CB 4.19Å; A693-A697 PolarHBondContact O-N 2.89Å; S694-A697 PolarHBondContact O-N 2.8Å; A697-D699 VanDerWaalsContact C-N 3.34Å; A697-F700 WeakPolarHBondContact O-CB 3.44Å; A697-F700 PolarHBondContact O-N 2.94Å; A697-I701 VanDerWaalsContact O-CG1 3.3Å; A697-I701 WeakPolarHBondContact O-CG1 3.44Å; A697-I701 PolarHBondContact O-N 3.13Å
698	I	91	Very high	87.7	Confident	1 Å²	1	20 Å²	20	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-60	-48.4	175	-71.3	171.7	0	0	0	109.3	I363 F677 L681 I689 S694 V696 F700 I701 R702 Y713	I363-I698 HydrophobicContact CD1-CG1 3.83Å; F677-I698 HydrophobicContact CZ-CB 4.5Å; F677-I698 HydrophobicContact CZ-CG2 3.8Å; L681-I698 HydrophobicContact CD1-CG2 4.09Å; L681-I698 HydrophobicContact CD2-CD1 3.78Å; L681-I698 HydrophobicContact CD2-CG1 3.75Å; I689-I698 HydrophobicContact CB-CD1 4.38Å; I689-I698 HydrophobicContact CG2-CD1 3.86Å; S694-I698 WeakPolarHBondContact O-CB 3.42Å; S694-I698 WeakPolarHBondContact O-CG1 3.45Å; S694-I698 PolarHBondContact O-N 3.01Å; V696-I698 VanDerWaalsContact C-N 3.34Å; V696-I698 PolarHBondContact O-N 3.25Å; I698-F700 VanDerWaalsContact C-N 3.31Å; I698-F700 PolarHBondContact O-N 3.38Å; I698-I701 PolarHBondContact O-N 2.99Å; I698-R702 WeakPolarHBondContact O-CB 3.33Å; I698-R702 PolarHBondContact O-N 3.49Å; I698-Y713 HydrophobicContact CG2-CD2 4.48Å; I698-Y713 HydrophobicContact CG2-CE2 3.72Å
699	D	88.7	Confident	87.6	Confident	9 Å²	9	20 Å²	20	5%	0.048	12%	0.118	C	C	.	.	H	α-helix	trans	-65.7	-35.5	-179.8	-166.7	39	0	0	0	112.3	R295 A695 V696 A697 R702 T703	R295-D699 WeakPolarHBondContact CD-OD2 3.36Å; R295-D699 IonicContact CZ-OD1 3.61Å; R295-D699 IonicContact CZ-OD2 3.18Å; R295-D699 IonicContact NE-OD2 2.96Å; R295-D699 IonicContact NH1-OD1 3.62Å; R295-D699 PolarHBondContact NH1-OD1 3.34Å; R295-D699 IonicContact NH1-OD2 3.89Å; R295-D699 PolarHBondContact NH1-OD2 3.46Å; A695-D699 VanDerWaalsContact O-CB 3.27Å; A695-D699 WeakPolarHBondContact O-CB 3.47Å; A695-D699 PolarHBondContact O-N 3.18Å; V696-D699 PolarHBondContact O-N 3.31Å; A697-D699 VanDerWaalsContact C-N 3.34Å; D699-R702 IonicContact OD1-CZ 3.47Å; D699-R702 VanDerWaalsContact OD1-CZ 3.32Å; D699-R702 IonicContact OD1-NE 3.12Å; D699-R702 PolarHBondContact OD1-NE 3.44Å; D699-R702 IonicContact OD1-NH2 2.67Å; D699-R702 PolarHBondContact OD1-NH2 3.13Å; D699-T703 WeakPolarHBondContact O-CB 3.37Å; D699-T703 WeakPolarHBondContact O-CG2 3.28Å; D699-T703 PolarHBondContact O-N 2.82Å; D699-T703 PolarHBondContact O-OG1 3.47Å
700	F	89.8	Confident	87.5	Confident	4 Å²	4	21.1 Å²	21.1	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-62.1	-53.6	173.2	-176.2	-87.6	0	0	0	111.1	I304 C305 V360 W637 I641 V696 A697 I698 R702 T703 R704 I705	I304-F700 HydrophobicContact CD1-CB 4.05Å; I304-F700 HydrophobicContact CD1-CD2 4.06Å; I304-F700 HydrophobicContact CD1-CG 3.99Å; I304-F700 HydrophobicContact CG1-CB 4.47Å; I304-F700 HydrophobicContact CG1-CD2 4.26Å; C305-F700 WeakPolarHBondContact SG-CA 3.3Å; C305-F700 PolarHBondContact SG-N 2.93Å; V360-F700 HydrophobicContact CG1-CD1 4.24Å; V360-F700 HydrophobicContact CG2-CB 4.42Å; V360-F700 HydrophobicContact CG2-CD1 4.15Å; V360-F700 HydrophobicContact CG2-CG 4.45Å; W637-F700 HydrophobicContact CB-CZ 4.46Å; W637-F700 AromaticContact CE3-CE1 3.91Å; W637-F700 HydrophobicContact CE3-CE1 3.91Å; W637-F700 HydrophobicContact CE3-CZ 4.13Å; I641-F700 HydrophobicContact CD1-CE1 3.75Å; I641-F700 HydrophobicContact CD1-CE2 4.07Å; I641-F700 HydrophobicContact CD1-CZ 3.36Å; I641-F700 HydrophobicContact CG1-CE1 4.38Å; I641-F700 HydrophobicContact CG1-CE2 3.84Å; I641-F700 HydrophobicContact CG1-CZ 3.5Å; I641-F700 VanDerWaalsContact CG1-CZ 3.5Å; V696-F700 WeakPolarHBondContact O-CB 3.21Å; V696-F700 PolarHBondContact O-N 2.91Å; A697-F700 WeakPolarHBondContact O-CB 3.44Å; A697-F700 PolarHBondContact O-N 2.94Å; I698-F700 VanDerWaalsContact C-N 3.31Å; I698-F700 PolarHBondContact O-N 3.38Å; F700-R702 PolarHBondContact O-N 2.98Å; F700-T703 PolarHBondContact O-N 3.48Å; F700-T703 PolarHBondContact O-OG1 3.24Å; F700-R704 HydrophobicContact CD2-CG 4.1Å; F700-R704 HydrophobicContact CE1-CB 4.12Å; F700-R704 HydrophobicContact CE1-CG 4.3Å; F700-R704 HydrophobicContact CE2-CG 3.83Å; F700-R704 HydrophobicContact CG-CG 4.44Å; F700-R704 HydrophobicContact CZ-CB 4.09Å; F700-R704 HydrophobicContact CZ-CG 3.89Å; F700-R704 VanDerWaalsContact O-CB 3.24Å; F700-R704 WeakPolarHBondContact O-CB 3.41Å; F700-R704 WeakPolarHBondContact O-CG 3.4Å; F700-R704 PolarHBondContact O-N 2.89Å; F700-I705 HydrophobicContact CE1-CD1 4.42Å
701	I	90.4	Very high	87.4	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-45	-178.8	-66.8	172.8	0	0	0	110.6	V360 I363 M364 M367 F677 A697 I698 T703 I705 V706	V360-I701 HydrophobicContact CG1-CD1 4.23Å; V360-I701 HydrophobicContact CG1-CG1 4.14Å; I363-I701 HydrophobicContact CB-CD1 3.4Å; I363-I701 VanDerWaalsContact CB-CD1 3.4Å; I363-I701 HydrophobicContact CD1-CD1 3.78Å; I363-I701 HydrophobicContact CG1-CD1 4.16Å; I363-I701 HydrophobicContact CG2-CD1 3.36Å; M364-I701 HydrophobicContact CG-CD1 4.32Å; M367-I701 HydrophobicContact SD-CG2 4.33Å; F677-I701 HydrophobicContact CD2-CG2 3.66Å; F677-I701 HydrophobicContact CE2-CB 3.92Å; F677-I701 HydrophobicContact CE2-CG2 3.54Å; F677-I701 HydrophobicContact CZ-CB 4.5Å; F677-I701 HydrophobicContact CZ-CG2 4.33Å; A697-I701 VanDerWaalsContact O-CG1 3.3Å; A697-I701 WeakPolarHBondContact O-CG1 3.44Å; A697-I701 PolarHBondContact O-N 3.13Å; I698-I701 PolarHBondContact O-N 2.99Å; I701-T703 VanDerWaalsContact C-N 3.31Å; I701-T703 PolarHBondContact O-N 3.49Å; I701-I705 HydrophobicContact CB-CD1 4.49Å; I701-I705 HydrophobicContact CG1-CD1 4.07Å; I701-I705 HydrophobicContact CG2-CB 4.24Å; I701-I705 HydrophobicContact CG2-CD1 4.44Å; I701-I705 WeakPolarHBondContact O-CA 3.21Å; I701-I705 WeakPolarHBondContact O-CB 3.48Å; I701-I705 PolarHBondContact O-N 2.96Å; I701-V706 HydrophobicContact CG2-CG2 3.81Å; I701-V706 PolarHBondContact O-N 2.92Å
702	R	90.8	Very high	87.4	Confident	7 Å²	7	24.1 Å²	24.1	3%	0.026	13%	0.133	C	C	.	.	I	π-helix	trans	-54.3	-46.5	177.2	-176.4	-162.8	65.2	94.3	-18	111.7	F677 I698 D699 F700 D707 M708 T710	F677-R702 HydrophobicContact CE1-CB 4.17Å; F677-R702 HydrophobicContact CZ-CB 4.12Å; I698-R702 WeakPolarHBondContact O-CB 3.33Å; I698-R702 PolarHBondContact O-N 3.49Å; D699-R702 IonicContact OD1-CZ 3.47Å; D699-R702 VanDerWaalsContact OD1-CZ 3.32Å; D699-R702 IonicContact OD1-NE 3.12Å; D699-R702 PolarHBondContact OD1-NE 3.44Å; D699-R702 IonicContact OD1-NH2 2.67Å; D699-R702 PolarHBondContact OD1-NH2 3.13Å; F700-R702 PolarHBondContact O-N 2.98Å; R702-D707 WeakPolarHBondContact O-CA 3.45Å; R702-D707 PolarHBondContact O-N 3.04Å; R702-M708 HydrophobicContact CG-CB 3.78Å; R702-M708 HydrophobicContact CG-CG 4.24Å; R702-M708 WeakPolarHBondContact CG-O 3.35Å; R702-M708 HydrophobicContact CG-SD 4.5Å; R702-M708 PolarHBondContact NH1-O 3.19Å; R702-M708 PolarHBondContact O-N 2.88Å; R702-T710 VanDerWaalsContact CZ-OG1 3.25Å; R702-T710 PolarHBondContact NH1-OG1 3.27Å; R702-T710 PolarHBondContact NH2-OG1 3.07Å
703	T	85.5	Confident	87.5	Confident	29 Å²	29	22.9 Å²	22.9	18%	0.178	12%	0.122	C	C	.	.	I	π-helix	trans	-87.7	-29	-174.7	54.6	0	0	0	0	115.2	D699 F700 I701	D699-T703 WeakPolarHBondContact O-CB 3.37Å; D699-T703 WeakPolarHBondContact O-CG2 3.28Å; D699-T703 PolarHBondContact O-N 2.82Å; D699-T703 PolarHBondContact O-OG1 3.47Å; F700-T703 PolarHBondContact O-N 3.48Å; F700-T703 PolarHBondContact O-OG1 3.24Å; I701-T703 VanDerWaalsContact C-N 3.31Å; I701-T703 PolarHBondContact O-N 3.49Å
704	R	83.1	Confident	87.5	Confident	19 Å²	19	24 Å²	24	7%	0.072	13%	0.126	C	C	.	.	I	π-helix	trans	-106.6	-24.6	-170.9	-60.2	-66.8	-172.6	136.8	-9.1	114.3	W637 D640 F700	W637-R704 HydrophobicContact CB-CB 3.97Å; D640-R704 IonicContact OD2-NH1 3.74Å; D640-R704 PolarHBondContact OD2-NH1 3.48Å; F700-R704 HydrophobicContact CD2-CG 4.1Å; F700-R704 HydrophobicContact CE1-CB 4.12Å; F700-R704 HydrophobicContact CE1-CG 4.3Å; F700-R704 HydrophobicContact CE2-CG 3.83Å; F700-R704 HydrophobicContact CG-CG 4.44Å; F700-R704 HydrophobicContact CZ-CB 4.09Å; F700-R704 HydrophobicContact CZ-CG 3.89Å; F700-R704 VanDerWaalsContact O-CB 3.24Å; F700-R704 WeakPolarHBondContact O-CB 3.41Å; F700-R704 WeakPolarHBondContact O-CG 3.4Å; F700-R704 PolarHBondContact O-N 2.89Å
705	I	86	Confident	87.4	Confident	24 Å²	24	27.6 Å²	27.6	12%	0.123	15%	0.145	C	C	.	.	I	π-helix	trans	-116.4	-49.7	-170.7	-53.9	-174.6	0	0	0	110.8	M364 W637 F672 F700 I701	M364-I705 HydrophobicContact CE-CD1 3.83Å; M364-I705 HydrophobicContact CE-CG2 4.26Å; M364-I705 HydrophobicContact CG-CD1 4.4Å; M364-I705 HydrophobicContact SD-CD1 3.51Å; M364-I705 VanDerWaalsContact SD-CD1 3.51Å; M364-I705 HydrophobicContact SD-CG2 4.18Å; W637-I705 HydrophobicContact CD2-CD1 4.12Å; W637-I705 HydrophobicContact CD2-CG1 4.17Å; W637-I705 HydrophobicContact CE3-CD1 4.44Å; W637-I705 HydrophobicContact CG-CG1 4.13Å; W637-I705 HydrophobicContact CZ2-CD1 4.14Å; F672-I705 HydrophobicContact CB-CG2 3.77Å; F672-I705 HydrophobicContact CD2-CG2 4.41Å; F672-I705 HydrophobicContact CG-CG2 4.14Å; F700-I705 HydrophobicContact CE1-CD1 4.42Å; I701-I705 HydrophobicContact CB-CD1 4.49Å; I701-I705 HydrophobicContact CG1-CD1 4.07Å; I701-I705 HydrophobicContact CG2-CB 4.24Å; I701-I705 HydrophobicContact CG2-CD1 4.44Å; I701-I705 WeakPolarHBondContact O-CA 3.21Å; I701-I705 WeakPolarHBondContact O-CB 3.48Å; I701-I705 PolarHBondContact O-N 2.96Å
706	V	86.1	Confident	87.4	Confident	11 Å²	11	28.9 Å²	28.9	7%	0.067	15%	0.149	C	C	.	.	I	π-helix	trans	-96.8	-20.4	-170	172	0	0	0	0	113	M367 V674 F677 I701 M708	M367-V706 HydrophobicContact CE-CG2 3.94Å; V674-V706 VanDerWaalsContact CA-CG1 3.47Å; V674-V706 HydrophobicContact CB-CG1 3.93Å; V674-V706 HydrophobicContact CG1-CG1 4.44Å; V674-V706 HydrophobicContact CG2-CG1 3.47Å; V674-V706 VanDerWaalsContact CG2-CG1 3.47Å; F677-V706 HydrophobicContact CB-CG1 4.33Å; F677-V706 HydrophobicContact CB-CG2 4.03Å; F677-V706 HydrophobicContact CD1-CG1 4.36Å; F677-V706 HydrophobicContact CG-CG2 4.2Å; I701-V706 HydrophobicContact CG2-CG2 3.81Å; I701-V706 PolarHBondContact O-N 2.92Å; V706-M708 VanDerWaalsContact C-N 3.32Å; V706-M708 HydrophobicContact CG1-CB 4.07Å; V706-M708 PolarHBondContact O-N 3.31Å
707	D	85.6	Confident	87.3	Confident	111 Å²	111	28.9 Å²	28.9	59%	0.594	15%	0.149	S	C	*	.			trans	55.7	38.7	-176.6	-65	-32	0	0	0	114.3	R702	R702-D707 WeakPolarHBondContact O-CA 3.45Å; R702-D707 PolarHBondContact O-N 3.04Å
708	M	85.1	Confident	87.1	Confident	6 Å²	6	30.3 Å²	30.3	3%	0.03	16%	0.158	C	C	.	.			trans	-86.2	133.4	175.5	178.1	-174.5	-157.7	0	0	110.3	V674 F677 T678 R702 V706 E712 W716	V674-M708 HydrophobicContact CG1-CB 4.39Å; V674-M708 HydrophobicContact CG1-CE 4.07Å; V674-M708 HydrophobicContact CG1-CG 4.2Å; V674-M708 HydrophobicContact CG1-SD 3.93Å; V674-M708 HydrophobicContact CG2-CB 4.46Å; F677-M708 HydrophobicContact CD1-SD 4.08Å; F677-M708 HydrophobicContact CE1-SD 4.06Å; T678-M708 HydrophobicContact CG2-CE 3.89Å; T678-M708 HydrophobicContact CG2-SD 4.37Å; R702-M708 HydrophobicContact CG-CB 3.78Å; R702-M708 HydrophobicContact CG-CG 4.24Å; R702-M708 WeakPolarHBondContact CG-O 3.35Å; R702-M708 HydrophobicContact CG-SD 4.5Å; R702-M708 PolarHBondContact NH1-O 3.19Å; R702-M708 PolarHBondContact O-N 2.88Å; V706-M708 VanDerWaalsContact C-N 3.32Å; V706-M708 HydrophobicContact CG1-CB 4.07Å; V706-M708 PolarHBondContact O-N 3.31Å; M708-E712 HydrophobicContact CE-CB 4.27Å; M708-E712 HydrophobicContact CE-CG 3.75Å; M708-E712 HydrophobicContact CG-CB 4.04Å; M708-E712 HydrophobicContact CG-CG 4.04Å; M708-W716 HydrophobicContact CE-CB 4.07Å
709	S	85.8	Confident	86.9	Confident	43 Å²	43	34.9 Å²	34.9	30%	0.301	18%	0.18	S	C	.	.			trans	-73.2	161.2	-177.5	80.1	0	0	0	0	112.3	E711 E712 Y713	S709-E711 VanDerWaalsContact C-N 3.32Å; S709-E712 PolarHBondContact O-N 3Å; S709-E712 VanDerWaalsContact OG-CB 3.32Å; S709-E712 WeakPolarHBondContact OG-CB 3.34Å; S709-E712 PolarHBondContact OG-N 3.49Å; S709-E712 VanDerWaalsContact OG-N 3.09Å; S709-Y713 PolarHBondContact O-N 2.98Å
710	T	85	Confident	86.7	Confident	24 Å²	24	36.9 Å²	36.9	15%	0.147	19%	0.192	C	C	.	.	H	α-helix	trans	-65.2	-41.2	179.7	-53.5	0	0	0	0	110	E292 R702 Y713 L714	E292-T710 WeakPolarHBondContact OE1-CB 3.16Å; E292-T710 PolarHBondContact OE1-OG1 3.15Å; R702-T710 VanDerWaalsContact CZ-OG1 3.25Å; R702-T710 PolarHBondContact NH1-OG1 3.27Å; R702-T710 PolarHBondContact NH2-OG1 3.07Å; T710-Y713 PolarHBondContact O-N 3.38Å; T710-L714 HydrophobicContact CG2-CD1 4.3Å; T710-L714 VanDerWaalsContact O-CG 3.3Å; T710-L714 WeakPolarHBondContact O-CG 3.43Å; T710-L714 PolarHBondContact O-N 3.06Å
711	E	84.1	Confident	86.5	Confident	135 Å²	135	38.7 Å²	38.7	63%	0.631	20%	0.199	S	C	*	.	H	α-helix	trans	-59.2	-45.7	173.3	-62	170.3	178	0	0	112.1	S709 Y713 L714 D715	S709-E711 VanDerWaalsContact C-N 3.32Å; E711-Y713 VanDerWaalsContact C-N 3.32Å; E711-Y713 PolarHBondContact O-N 2.92Å; E711-L714 PolarHBondContact O-N 3.44Å; E711-D715 WeakPolarHBondContact O-CB 3.33Å; E711-D715 PolarHBondContact O-N 3.16Å
712	E	86.5	Confident	86.1	Confident	13 Å²	13	43 Å²	43	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-64.6	-39.5	-179.9	-169.2	178.2	-177.6	0	0	111.2	M708 S709 W716	M708-E712 HydrophobicContact CE-CB 4.27Å; M708-E712 HydrophobicContact CE-CG 3.75Å; M708-E712 HydrophobicContact CG-CB 4.04Å; M708-E712 HydrophobicContact CG-CG 4.04Å; S709-E712 PolarHBondContact O-N 3Å; S709-E712 VanDerWaalsContact OG-CB 3.32Å; S709-E712 WeakPolarHBondContact OG-CB 3.34Å; S709-E712 PolarHBondContact OG-N 3.49Å; S709-E712 VanDerWaalsContact OG-N 3.09Å; E712-W716 WeakPolarHBondContact O-CB 3.49Å; E712-W716 PolarHBondContact O-N 3.19Å
713	Y	88.6	Confident	85.5	Confident	25 Å²	25	50.9 Å²	50.9	10%	0.098	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-45.8	174.8	173.4	-108.5	0	0	0	111.9	L681 I689 I698 S709 T710 E711 W716 L717	L681-Y713 HydrophobicContact CD1-CD2 4.49Å; L681-Y713 HydrophobicContact CD1-CE2 3.9Å; I689-Y713 WeakPolarHBondContact CG2-OH 3.23Å; I698-Y713 HydrophobicContact CG2-CD2 4.48Å; I698-Y713 HydrophobicContact CG2-CE2 3.72Å; S709-Y713 PolarHBondContact O-N 2.98Å; T710-Y713 PolarHBondContact O-N 3.38Å; E711-Y713 VanDerWaalsContact C-N 3.32Å; E711-Y713 PolarHBondContact O-N 2.92Å; Y713-W716 HydrophobicContact CD2-CE3 4.16Å; Y713-W716 HydrophobicContact CE2-CE3 4.06Å; Y713-W716 HydrophobicContact CE2-CZ3 4.02Å; Y713-W716 PolarHBondContact O-N 3.33Å; Y713-L717 HydrophobicContact CE1-CD2 4.21Å; Y713-L717 VanDerWaalsContact O-CB 3.22Å; Y713-L717 WeakPolarHBondContact O-CB 3.41Å; Y713-L717 PolarHBondContact O-N 2.97Å
714	L	86.5	Confident	85.2	Confident	34 Å²	34	49.5 Å²	49.5	18%	0.178	25%	0.253	C	S	.	.	H	α-helix	trans	-67.1	-38.2	179.2	-67.1	176	0	0	0	112.3	P296 T710 E711 L717 C718 I728	P296-L714 HydrophobicContact CG-CD1 4.31Å; P296-L714 HydrophobicContact CG-CD2 3.64Å; T710-L714 HydrophobicContact CG2-CD1 4.3Å; T710-L714 VanDerWaalsContact O-CG 3.3Å; T710-L714 WeakPolarHBondContact O-CG 3.43Å; T710-L714 PolarHBondContact O-N 3.06Å; E711-L714 PolarHBondContact O-N 3.44Å; L714-L717 HydrophobicContact CD2-CD2 4.43Å; L714-L717 PolarHBondContact O-N 3.42Å; L714-C718 WeakPolarHBondContact O-CB 3.31Å; L714-C718 PolarHBondContact O-N 2.86Å; L714-C718 PolarHBondContact O-SG 3.25Å; L714-I728 HydrophobicContact CD2-CD1 4Å
715	D	86	Confident	85	Confident	79 Å²	79	53.7 Å²	53.7	42%	0.422	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-46.2	173.1	-85.1	-6.3	0	0	0	111.3	S138 E711 L717 Q719	S138-D715 WeakPolarHBondContact OG-CB 3.4Å; S138-D715 PolarHBondContact OG-OD2 3.05Å; E711-D715 WeakPolarHBondContact O-CB 3.33Å; E711-D715 PolarHBondContact O-N 3.16Å; D715-L717 VanDerWaalsContact C-N 3.35Å; D715-Q719 WeakPolarHBondContact O-CB 3.43Å; D715-Q719 WeakPolarHBondContact O-CG 3.46Å; D715-Q719 PolarHBondContact O-N 3.38Å; D715-Q719 PolarHBondContact O-NE2 3.23Å
716	W	90.5	Very high	84.3	Confident	32 Å²	32	59.8 Å²	59.8	12%	0.121	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-43.8	175.1	171.2	86.1	0	0	0	111.4	T678 L681 S682 I689 M708 E712 Y713 Q719 T720 Y721	T678-W716 HydrophobicContact CG2-CD2 4.12Å; T678-W716 HydrophobicContact CG2-CG 3.99Å; T678-W716 WeakPolarHBondContact O-CZ2 3.26Å; L681-W716 HydrophobicContact CB-CH2 3.29Å; L681-W716 HydrophobicContact CB-CZ2 3.78Å; L681-W716 HydrophobicContact CB-CZ3 4.03Å; L681-W716 HydrophobicContact CD1-CH2 4.06Å; L681-W716 HydrophobicContact CD1-CZ3 3.94Å; L681-W716 HydrophobicContact CG-CH2 4.34Å; S682-W716 WeakPolarHBondContact OG-CZ2 3.25Å; I689-W716 HydrophobicContact CD1-CH2 4.4Å; M708-W716 HydrophobicContact CE-CB 4.07Å; E712-W716 WeakPolarHBondContact O-CB 3.49Å; E712-W716 PolarHBondContact O-N 3.19Å; Y713-W716 HydrophobicContact CD2-CE3 4.16Å; Y713-W716 HydrophobicContact CE2-CE3 4.06Å; Y713-W716 HydrophobicContact CE2-CZ3 4.02Å; Y713-W716 PolarHBondContact O-N 3.33Å; W716-Q719 PolarHBondContact O-N 3.35Å; W716-T720 HydrophobicContact CZ2-CG2 4.34Å; W716-T720 WeakPolarHBondContact O-CB 3.04Å; W716-T720 PolarHBondContact O-N 2.71Å; W716-T720 PolarHBondContact O-OG1 3.11Å; W716-Y721 HydrophobicContact CH2-CE2 4.49Å
717	L	87.6	Confident	83.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-44.2	-179.1	-173	69.9	0	0	0	110.9	I689 Y713 L714 D715 Q719 T720 Y721 I724	I689-L717 HydrophobicContact CG2-CD1 4.15Å; Y713-L717 HydrophobicContact CE1-CD2 4.21Å; Y713-L717 VanDerWaalsContact O-CB 3.22Å; Y713-L717 WeakPolarHBondContact O-CB 3.41Å; Y713-L717 PolarHBondContact O-N 2.97Å; L714-L717 HydrophobicContact CD2-CD2 4.43Å; L714-L717 PolarHBondContact O-N 3.42Å; D715-L717 VanDerWaalsContact C-N 3.35Å; L717-Q719 VanDerWaalsContact C-N 3.35Å; L717-Q719 PolarHBondContact O-N 3.24Å; L717-T720 PolarHBondContact O-N 3.23Å; L717-Y721 HydrophobicContact CD1-CD2 3.96Å; L717-Y721 HydrophobicContact CD1-CE2 4.39Å; L717-Y721 PolarHBondContact O-N 3.22Å; L717-I724 HydrophobicContact CD1-CD1 3.71Å; L717-I724 HydrophobicContact CD2-CD1 3.93Å; L717-I724 HydrophobicContact CD2-CG2 4.26Å; L717-I724 HydrophobicContact CG-CD1 3.53Å
718	C	86.6	Confident	82.9	Confident	30 Å²	30	59.7 Å²	59.7	20%	0.203	30%	0.298	C	S	.	.	H	α-helix	trans	-67.3	-33	175.4	-69.9	0	0	0	0	112.8	L714 Y721 P722	L714-C718 WeakPolarHBondContact O-CB 3.31Å; L714-C718 PolarHBondContact O-N 2.86Å; L714-C718 PolarHBondContact O-SG 3.25Å; C718-Y721 CarbonylContact O-C 3.54Å; C718-P722 WeakPolarHBondContact O-CA 3.4Å
719	Q	86.5	Confident	81.9	Confident	98 Å²	98	63.1 Å²	63.1	46%	0.458	32%	0.32	S	S	.	.	H	α-helix	trans	-71.7	-38.7	175.6	-77.7	170.6	51.1	0	0	112.1	D715 W716 L717	D715-Q719 WeakPolarHBondContact O-CB 3.43Å; D715-Q719 WeakPolarHBondContact O-CG 3.46Å; D715-Q719 PolarHBondContact O-N 3.38Å; D715-Q719 PolarHBondContact O-NE2 3.23Å; W716-Q719 PolarHBondContact O-N 3.35Å; L717-Q719 VanDerWaalsContact C-N 3.35Å; L717-Q719 PolarHBondContact O-N 3.24Å
720	T	84.7	Confident	80.6	Confident	51 Å²	51	66.9 Å²	66.9	31%	0.313	33%	0.332	S	S	.	.	H	α-helix	trans	-78.6	-39.8	-178.1	-52.3	0	0	0	0	111.2	W716 L717	W716-T720 HydrophobicContact CZ2-CG2 4.34Å; W716-T720 WeakPolarHBondContact O-CB 3.04Å; W716-T720 PolarHBondContact O-N 2.71Å; W716-T720 PolarHBondContact O-OG1 3.11Å; L717-T720 PolarHBondContact O-N 3.23Å
721	Y	85.3	Confident	79.2	Confident	42 Å²	42	71 Å²	71	17%	0.165	35%	0.354	C	S	.	.			trans	-129	83.2	179.9	-53.3	-83.1	0	0	0	110.3	L684 L686 I689 W716 L717 C718 K723 I724	L684-Y721 PolarHBondContact O-OH 2.98Å; L686-Y721 HydrophobicContact CB-CD1 4.12Å; L686-Y721 HydrophobicContact CB-CE1 4.19Å; L686-Y721 HydrophobicContact CD1-CD1 4.5Å; L686-Y721 HydrophobicContact CD1-CD2 4.32Å; L686-Y721 HydrophobicContact CD1-CG 4.18Å; I689-Y721 HydrophobicContact CD1-CE2 3.62Å; W716-Y721 HydrophobicContact CH2-CE2 4.49Å; L717-Y721 HydrophobicContact CD1-CD2 3.96Å; L717-Y721 HydrophobicContact CD1-CE2 4.39Å; L717-Y721 PolarHBondContact O-N 3.22Å; C718-Y721 CarbonylContact O-C 3.54Å; Y721-K723 PolarHBondContact O-N 3.13Å; Y721-I724 VanDerWaalsContact CB-CD1 3.46Å; Y721-I724 HydrophobicContact CD2-CD1 4.14Å; Y721-I724 HydrophobicContact CG-CD1 4.1Å; Y721-I724 PolarHBondContact O-N 3.19Å
722	P	82.4	Confident	77.5	Confident	90 Å²	90	71.6 Å²	71.6	58%	0.584	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-28.1	-178.1	-28.8	35.6	0	0	0	114.7	C718 I724 K725	C718-P722 WeakPolarHBondContact O-CA 3.4Å; P722-I724 PolarHBondContact O-N 3.4Å; P722-K725 VanDerWaalsContact O-CB 3.25Å; P722-K725 WeakPolarHBondContact O-CB 3.46Å; P722-K725 PolarHBondContact O-N 3.05Å; P722-K725 VanDerWaalsContact O-N 3.15Å
723	K	78.8	Confident	75.3	Confident	172 Å²	172	79.3 Å²	79.3	75%	0.748	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-27.8	178.7	-64.2	-176.1	178.2	-177.6	0	113.8	Y721 K725	Y721-K723 PolarHBondContact O-N 3.13Å; K723-K725 VanDerWaalsContact C-N 3.29Å
724	I	79.2	Confident	72.7	Confident	0 Å²	0	86.6 Å²	86.6	0%	0	43%	0.434	C	S	.	.	H	α-helix	trans	-74.9	-25.6	-179	-56.3	165.5	0	0	0	111.1	F297 L686 L717 Y721 P722 E726 L727 I728	F297-I724 HydrophobicContact CE2-CG2 4.07Å; F297-I724 HydrophobicContact CZ-CG2 3.92Å; L686-I724 HydrophobicContact CD1-CD1 3.22Å; L686-I724 HydrophobicContact CD1-CG1 3.76Å; L686-I724 HydrophobicContact CD2-CD1 4.14Å; L686-I724 HydrophobicContact CD2-CG1 3.77Å; L686-I724 HydrophobicContact CG-CD1 4.31Å; L686-I724 HydrophobicContact CG-CG1 4.41Å; L717-I724 HydrophobicContact CD1-CD1 3.71Å; L717-I724 HydrophobicContact CD2-CD1 3.93Å; L717-I724 HydrophobicContact CD2-CG2 4.26Å; L717-I724 HydrophobicContact CG-CD1 3.53Å; Y721-I724 VanDerWaalsContact CB-CD1 3.46Å; Y721-I724 HydrophobicContact CD2-CD1 4.14Å; Y721-I724 HydrophobicContact CG-CD1 4.1Å; Y721-I724 PolarHBondContact O-N 3.19Å; P722-I724 PolarHBondContact O-N 3.4Å; I724-E726 PolarHBondContact O-N 2.76Å; I724-E726 VanDerWaalsContact O-N 3.15Å; I724-L727 WeakPolarHBondContact O-CA 3.47Å; I724-L727 WeakPolarHBondContact O-CB 3.49Å; I724-L727 PolarHBondContact O-N 3.43Å; I724-I728 HydrophobicContact CG2-CD1 3.54Å; I724-I728 HydrophobicContact CG2-CG1 3.8Å; I724-I728 PolarHBondContact O-N 3.44Å
725	K	77.2	Confident	72	Confident	108 Å²	108	89.2 Å²	89.2	47%	0.47	45%	0.447	S	S	.	.	H	α-helix	trans	-54.9	-38.9	-177.9	-169.9	177.5	179.8	-179.8	0	111.2	P722 K723 T729	P722-K725 VanDerWaalsContact O-CB 3.25Å; P722-K725 WeakPolarHBondContact O-CB 3.46Å; P722-K725 PolarHBondContact O-N 3.05Å; P722-K725 VanDerWaalsContact O-N 3.15Å; K723-K725 VanDerWaalsContact C-N 3.29Å; K725-T729 WeakPolarHBondContact O-CG2 3.29Å; K725-T729 PolarHBondContact O-N 3.46Å; K725-T729 VanDerWaalsContact O-N 3.15Å; K725-T729 PolarHBondContact O-OG1 3.16Å
726	E	72.8	Confident	71.2	Confident	152 Å²	152	89.7 Å²	89.7	71%	0.71	45%	0.449	S	S	*	.	H	α-helix	trans	-66.5	-39.9	176.5	-65.1	175.7	-177	0	0	112.2	I724 T729 H730	I724-E726 PolarHBondContact O-N 2.76Å; I724-E726 VanDerWaalsContact O-N 3.15Å; E726-T729 WeakPolarHBondContact CA-OG1 3.5Å; E726-T729 PolarHBondContact O-OG1 2.82Å; E726-H730 WeakPolarHBondContact O-CB 3.13Å; E726-H730 PolarHBondContact O-N 3.07Å; E726-H730 VanDerWaalsContact O-N 3.15Å
727	L	71.2	Confident	70.2	Confident	95 Å²	95	92.9 Å²	92.9	50%	0.497	47%	0.467	S	S	.	.	H	α-helix	trans	-68.5	-39.3	178.4	-67.7	169	0	0	0	112.6	I724 N731	I724-L727 WeakPolarHBondContact O-CA 3.47Å; I724-L727 WeakPolarHBondContact O-CB 3.49Å; I724-L727 PolarHBondContact O-N 3.43Å; L727-N731 PolarHBondContact O-N 3.08Å
728	I	70.1	Confident	69.2	Low	24 Å²	24	98.4 Å²	98.4	12%	0.123	49%	0.494	C	S	.	.	H	α-helix	trans	-70.8	-40	178.9	-66.1	165.4	0	0	0	110.6	F297 L714 I724 H730 M732	F297-I728 HydrophobicContact CE2-CD1 4.44Å; F297-I728 HydrophobicContact CE2-CG1 4.14Å; F297-I728 HydrophobicContact CZ-CG1 4.19Å; L714-I728 HydrophobicContact CD2-CD1 4Å; I724-I728 HydrophobicContact CG2-CD1 3.54Å; I724-I728 HydrophobicContact CG2-CG1 3.8Å; I724-I728 PolarHBondContact O-N 3.44Å; I728-H730 VanDerWaalsContact C-N 3.34Å; I728-M732 WeakPolarHBondContact O-CG 3.46Å
729	T	64.7	Low	68.1	Low	79 Å²	79	102.7 Å²	102.7	49%	0.485	51%	0.512	S	S	.	.	H	α-helix	trans	-68.1	-34.3	179.3	48	0	0	0	0	112.6	K725 E726	K725-T729 WeakPolarHBondContact O-CG2 3.29Å; K725-T729 PolarHBondContact O-N 3.46Å; K725-T729 VanDerWaalsContact O-N 3.15Å; K725-T729 PolarHBondContact O-OG1 3.16Å; E726-T729 WeakPolarHBondContact CA-OG1 3.5Å; E726-T729 PolarHBondContact O-OG1 2.82Å
730	H	58.1	Low	66.8	Low	122 Å²	122	103 Å²	103	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-72.1	-34.1	-179.8	-152.9	-61.4	0	0	0	112.5	E726 I728 M732 D734	E726-H730 WeakPolarHBondContact O-CB 3.13Å; E726-H730 PolarHBondContact O-N 3.07Å; E726-H730 VanDerWaalsContact O-N 3.15Å; I728-H730 VanDerWaalsContact C-N 3.34Å; H730-M732 VanDerWaalsContact C-N 3.27Å; H730-M732 PolarHBondContact O-N 3.39Å; H730-D734 IonicContact CE1-OD2 2.87Å; H730-D734 IonicContact ND1-OD2 3.64Å
731	N	55.4	Low	65.6	Low	111 Å²	111	106.7 Å²	106.7	59%	0.594	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-1.5	179.5	-74.5	-3.6	0	0	0	114.6	L727	L727-N731 PolarHBondContact O-N 3.08Å
732	M	48.8	Very low	64	Low	146 Å²	146	111.7 Å²	111.7	72%	0.719	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-9.8	175.7	-72.6	-93.3	-134.1	0	0	112.5	I728 H730	I728-M732 WeakPolarHBondContact O-CG 3.46Å; H730-M732 VanDerWaalsContact C-N 3.27Å; H730-M732 PolarHBondContact O-N 3.39Å
733	E	40.8	Very low	62.5	Low	176 Å²	176	113.5 Å²	113.5	82%	0.822	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-13.7	179.1	-72.4	-176.8	166.6	0	0	113.5
734	D	33	Very low	61	Low	177 Å²	177	108.2 Å²	108.2	95%	0.947	54%	0.539	S	S	*	.			trans	-102.4	0	171.1	-67.3	-38.5	0	0	0	110.9	H730	H730-D734 IonicContact CE1-OD2 2.87Å; H730-D734 IonicContact ND1-OD2 3.64Å

Retrieved 734 of 734 residues in 484.1 ms (Link to these results)

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