A0A3Q0KNL5_SCHMA Loading...

Putative bhlhzip transcription factor bigmax

AlphaFold DB , UniProt , Accession A0A3Q0KNL5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 441 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	45.1	Very low	44.1	Very low	234 Å²	234	156 Å²	156	100%	1.153	85%	0.848	S	S	*	*				0	131.8	0	-73.2	172.9	175.5	0	0	105.6
2	D	50.8	Low	43.7	Very low	155 Å²	155	155.3 Å²	155.3	83%	0.829	84%	0.843	S	S	*	*			trans	72.8	83.5	-176.3	-48.4	-26.8	0	0	0	115
3	L	44.8	Very low	43.8	Very low	150 Å²	150	150.8 Å²	150.8	79%	0.785	84%	0.839	S	S	*	*				61.4	109.9	68.2	-68.7	178.1	0	0	0	116.4
4	N	40.4	Very low	43.2	Very low	147 Å²	147	145.1 Å²	145.1	79%	0.786	83%	0.831	S	S	*	*			trans	65.2	122.4	139.2	-62.4	-11.7	0	0	0	120.4
5	A	49.8	Very low	43.5	Very low	89 Å²	89	144.6 Å²	144.6	74%	0.736	83%	0.832	S	S	*	*				173.1	120.6	107.9	0	0	0	0	0	113
6	E	47.9	Very low	43.5	Very low	177 Å²	177	148.3 Å²	148.3	83%	0.827	84%	0.835	S	S	*	*			trans	50.8	100.4	135.6	-53.8	-168	163.5	0	0	118.5
7	I	38.6	Very low	43.8	Very low	167 Å²	167	146.5 Å²	146.5	86%	0.856	83%	0.829	S	S	*	*				16.5	90.2	85	-62.5	167.3	0	0	0	112.9
8	S	39.9	Very low	43.9	Very low	105 Å²	105	147.2 Å²	147.2	73%	0.734	83%	0.829	S	S	*	*			trans	-178.3	104.7	145.6	-81.9	0	0	0	0	111.1
9	L	43.4	Very low	44.1	Very low	178 Å²	178	147.1 Å²	147.1	93%	0.932	82%	0.815	S	S	*	*			trans	-80.7	126.2	165.6	-97.4	125.1	0	0	0	109.4	H11	L9-H11 PolarHBondContact O-N 3.49Å
10	P	46.7	Very low	44.4	Very low	124 Å²	124	148.4 Å²	148.4	81%	0.805	82%	0.815	S	S	*	*			trans	-85.8	108.2	170.6	32.1	-27.8	0	0	0	109.9	N12	P10-N12 PolarHBondContact O-N 3.46Å
11	H	37.7	Very low	44.4	Very low	190 Å²	190	145.8 Å²	145.8	88%	0.88	81%	0.807	S	S	*	*			trans	-85	94.1	163.4	175.3	-75.5	0	0	0	108.9	L9	L9-H11 PolarHBondContact O-N 3.49Å
12	N	38.9	Very low	44.9	Very low	148 Å²	148	139.3 Å²	139.3	79%	0.791	78%	0.777	S	S	*	*			trans	-170.4	114.1	152.3	-163.3	1.3	0	0	0	111.3	P10	P10-N12 PolarHBondContact O-N 3.46Å
13	A	45.4	Very low	45.1	Very low	96 Å²	96	138.8 Å²	138.8	79%	0.793	77%	0.774	S	S	*	*				166.2	113.6	128.8	0	0	0	0	0	111.4
14	G	35.1	Very low	45.3	Very low	71 Å²	71	140.4 Å²	140.4	73%	0.732	78%	0.777	S	S	*	*			trans	97.4	55.3	135.7	0	0	0	0	0	119.1
15	V	48.6	Very low	45.8	Very low	138 Å²	138	141.5 Å²	141.5	84%	0.836	78%	0.783	S	S	*	*			trans	-123.9	89	148.1	-174.5	0	0	0	0	108.9	T17	V15-T17 PolarHBondContact O-N 3.26Å
16	K	42.2	Very low	45.8	Very low	204 Å²	204	145 Å²	145	89%	0.887	78%	0.784	S	S	*	*			trans	-78.1	95.2	168.3	-72.5	176.2	177.1	176.2	0	108.8
17	T	48.8	Very low	45.9	Very low	118 Å²	118	143.5 Å²	143.5	72%	0.724	78%	0.782	S	S	*	*			trans	-157.4	95.2	152.4	52.9	0	0	0	0	111.1	V15	V15-T17 PolarHBondContact O-N 3.26Å
18	L	45.8	Very low	46.4	Very low	159 Å²	159	145.2 Å²	145.2	83%	0.832	78%	0.779	S	S	*	*	S	Bend	trans	43.7	99.2	138.7	-89.7	158.5	0	0	0	119
19	Y	48.2	Very low	47.1	Very low	145 Å²	145	146.3 Å²	146.3	57%	0.569	79%	0.787	S	S	*	*			trans	150.2	74.9	132.8	-102.8	-97.9	0	0	0	110.2
20	E	49.9	Very low	47.8	Very low	173 Å²	173	140.6 Å²	140.6	81%	0.808	76%	0.762	S	S	*	*			trans	-146.1	53.5	163.8	-160.8	59.2	-144.4	0	0	109.6
21	S	44.8	Very low	48.6	Very low	93 Å²	93	141 Å²	141	65%	0.65	76%	0.762	S	S	*	*			trans	-146.7	95.1	176.4	47.2	0	0	0	0	106.4
22	D	54.8	Low	49.8	Very low	99 Å²	99	139 Å²	139	53%	0.529	75%	0.753	S	S	.	*			trans	178.1	40.2	166.6	-93.4	-7.9	0	0	0	112.1
23	L	55.9	Low	51.4	Low	144 Å²	144	134.8 Å²	134.8	75%	0.754	74%	0.735	S	S	*	*	S	Bend	trans	-110.8	-4.2	175.6	-74.1	-177.9	0	0	0	115.1
24	E	48.2	Very low	53.1	Low	183 Å²	183	137.4 Å²	137.4	86%	0.855	73%	0.725	S	S	*	*	S	Bend	trans	-146.1	94.2	174.3	-62.3	-170.4	-179.5	0	0	108.6
25	D	50.8	Low	55.5	Low	171 Å²	171	135.9 Å²	135.9	91%	0.914	71%	0.71	S	S	*	*			trans	-162.5	139.8	146.4	-116.4	-22.5	0	0	0	112.4
26	E	51.1	Low	57.3	Low	162 Å²	162	132.5 Å²	132.5	76%	0.757	69%	0.686	S	S	*	*			trans	-73.1	155.1	-168.7	-54.8	-163.1	150.5	0	0	113
27	N	50	Low	59.6	Low	145 Å²	145	130.6 Å²	130.6	78%	0.775	67%	0.674	S	S	*	*			trans	52.3	70.4	146.3	-167.2	37.9	0	0	0	118.5
28	Y	48.4	Very low	61.7	Low	203 Å²	203	127.3 Å²	127.3	80%	0.796	65%	0.65	S	S	*	*			trans	-135.8	95.7	155.6	-79.4	-83.7	0	0	0	111.7	S30	Y28-S30 PolarHBondContact O-N 2.83Å
29	S	54.2	Low	63.9	Low	129 Å²	129	127.4 Å²	127.4	90%	0.902	64%	0.639	S	S	*	*			trans	-73.9	47.7	169.7	69.6	0	0	0	0	112.4
30	S	58.8	Low	66.1	Low	58 Å²	58	126.9 Å²	126.9	41%	0.406	64%	0.636	S	S	.	*	S	Bend	trans	-110.9	142	-177.2	-177.8	0	0	0	0	110.8	Y28 E32 S33	Y28-S30 PolarHBondContact O-N 2.83Å; S30-E32 PolarHBondContact O-N 3.13Å; S30-S33 PolarHBondContact O-N 3.45Å
31	V	62.2	Low	68.2	Low	133 Å²	133	124.9 Å²	124.9	81%	0.806	62%	0.621	S	S	*	*	H	α-helix	trans	-45.4	-26.9	176.2	176.5	0	0	0	0	112.6	S33 Y34 G35	V31-S33 PolarHBondContact O-N 3.01Å; V31-Y34 PolarHBondContact O-N 3.33Å; V31-G35 PolarHBondContact O-N 3.03Å
32	E	64.6	Low	70.6	Confident	147 Å²	147	126.9 Å²	126.9	69%	0.687	62%	0.618	S	S	*	*	H	α-helix	trans	-56	-42.8	173.8	-142.3	80.4	-137.9	0	0	113.9	S30 Y34 G35 I36	S30-E32 PolarHBondContact O-N 3.13Å; E32-Y34 VanDerWaalsContact C-N 3.31Å; E32-Y34 PolarHBondContact O-N 3.07Å; E32-G35 WeakPolarHBondContact O-CA 3.15Å; E32-G35 PolarHBondContact O-N 2.78Å; E32-I36 PolarHBondContact O-N 3.47Å
33	S	72.4	Confident	72.6	Confident	59 Å²	59	126.8 Å²	126.8	41%	0.413	62%	0.617	S	S	.	*	H	α-helix	trans	-66	-34.9	-178.3	-177	0	0	0	0	112	S30 V31 G35 I36 R37	S30-S33 PolarHBondContact O-N 3.45Å; V31-S33 PolarHBondContact O-N 3.01Å; S33-G35 VanDerWaalsContact C-N 3.35Å; S33-I36 PolarHBondContact O-N 3.4Å; S33-R37 WeakPolarHBondContact O-CB 3.43Å; S33-R37 PolarHBondContact O-N 3.22Å
34	Y	79.5	Confident	74.5	Confident	151 Å²	151	126.4 Å²	126.4	59%	0.592	61%	0.611	S	S	*	*	H	α-helix	trans	-65.9	-39.8	172.4	-173.3	-96	0	0	0	111.2	V31 E32 R37 E38	V31-Y34 PolarHBondContact O-N 3.33Å; E32-Y34 VanDerWaalsContact C-N 3.31Å; E32-Y34 PolarHBondContact O-N 3.07Å; Y34-R37 PolarHBondContact O-N 3.15Å; Y34-E38 VanDerWaalsContact O-CB 3.28Å; Y34-E38 WeakPolarHBondContact O-CB 3.06Å; Y34-E38 PolarHBondContact O-N 3.26Å
35	G	86.9	Confident	76.9	Confident	40 Å²	40	121.7 Å²	121.7	41%	0.412	60%	0.595	S	S	.	*	H	α-helix	trans	-60.5	-43.5	175.4	0	0	0	0	0	113.4	V31 E32 S33 E38 R39	V31-G35 PolarHBondContact O-N 3.03Å; E32-G35 WeakPolarHBondContact O-CA 3.15Å; E32-G35 PolarHBondContact O-N 2.78Å; S33-G35 VanDerWaalsContact C-N 3.35Å; G35-E38 PolarHBondContact O-N 2.9Å; G35-R39 WeakPolarHBondContact O-CB 3.44Å; G35-R39 PolarHBondContact O-N 3Å
36	I	87	Confident	79.1	Confident	67 Å²	67	118.3 Å²	118.3	34%	0.344	57%	0.574	S	S	.	*	H	α-helix	trans	-66	-46.3	176.9	-62.6	167.8	0	0	0	110.7	E32 S33 E38 R39 R40	E32-I36 PolarHBondContact O-N 3.47Å; S33-I36 PolarHBondContact O-N 3.4Å; I36-E38 VanDerWaalsContact C-N 3.31Å; I36-E38 PolarHBondContact O-N 2.86Å; I36-R39 WeakPolarHBondContact O-CB 3.27Å; I36-R39 PolarHBondContact O-N 3.35Å; I36-R40 PolarHBondContact O-N 3.36Å
37	R	89.4	Confident	81.4	Confident	164 Å²	164	112.6 Å²	112.6	62%	0.619	55%	0.554	S	S	*	*	H	α-helix	trans	-60.5	-41.9	177.6	-171.8	-179.3	-63.4	-157.3	-0.3	111.8	S33 Y34 R40 R41	S33-R37 WeakPolarHBondContact O-CB 3.43Å; S33-R37 PolarHBondContact O-N 3.22Å; Y34-R37 PolarHBondContact O-N 3.15Å; R37-R40 PolarHBondContact O-N 3.48Å; R37-R41 PolarHBondContact O-N 3.11Å
38	E	92.2	Very high	83.7	Confident	48 Å²	48	108 Å²	108	22%	0.224	53%	0.528	C	S	.	.	H	α-helix	trans	-69	-37.9	177.5	-174.3	55.4	-150.3	0	0	111.8	Y34 G35 I36 R41 K42	Y34-E38 VanDerWaalsContact O-CB 3.28Å; Y34-E38 WeakPolarHBondContact O-CB 3.06Å; Y34-E38 PolarHBondContact O-N 3.26Å; G35-E38 PolarHBondContact O-N 2.9Å; I36-E38 VanDerWaalsContact C-N 3.31Å; I36-E38 PolarHBondContact O-N 2.86Å; E38-R41 PolarHBondContact O-N 3.24Å; E38-R41 IonicContact OE2-CZ 2.74Å; E38-R41 IonicContact OE2-NE 2.8Å; E38-R41 IonicContact OE2-NH1 3.81Å; E38-R41 PolarHBondContact OE2-NH1 3.01Å; E38-K42 HydrophobicContact CG-CD 4.5Å; E38-K42 WeakPolarHBondContact O-CG 3.46Å; E38-K42 PolarHBondContact O-N 2.81Å; E38-K42 WeakPolarHBondContact OE1-CE 3.32Å
39	R	92.6	Very high	86.1	Confident	161 Å²	161	102.9 Å²	102.9	61%	0.608	51%	0.511	S	S	*	.	H	α-helix	trans	-59.8	-46.2	171.4	-176.7	-175.1	-69.6	-118.9	3	111.3	G35 I36 R41 K42 L43	G35-R39 WeakPolarHBondContact O-CB 3.44Å; G35-R39 PolarHBondContact O-N 3Å; I36-R39 WeakPolarHBondContact O-CB 3.27Å; I36-R39 PolarHBondContact O-N 3.35Å; R39-R41 PolarHBondContact O-N 3.39Å; R39-K42 PolarHBondContact O-N 3.1Å; R39-L43 HydrophobicContact CG-CD1 4.19Å; R39-L43 WeakPolarHBondContact O-CG 3.31Å; R39-L43 PolarHBondContact O-N 2.99Å
40	R	93.6	Very high	88.2	Confident	135 Å²	135	103.4 Å²	103.4	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-60.4	-43.8	176.7	-168.9	-179.4	-66.3	178.2	1.2	111.4	I36 R37 L43 H44	I36-R40 PolarHBondContact O-N 3.36Å; R37-R40 PolarHBondContact O-N 3.48Å; R40-L43 PolarHBondContact O-N 3.4Å; R40-H44 WeakPolarHBondContact O-CB 3.38Å; R40-H44 PolarHBondContact O-N 3.26Å
41	R	94.8	Very high	90.1	Very high	131 Å²	131	107.4 Å²	107.4	49%	0.494	50%	0.5	S	S	.	.	H	α-helix	trans	-60.5	-44.5	175.7	-176.7	-173	-70.1	162.4	-10.3	112.2	R37 E38 R39 H44 T45	R37-R41 PolarHBondContact O-N 3.11Å; E38-R41 PolarHBondContact O-N 3.24Å; E38-R41 IonicContact OE2-CZ 2.74Å; E38-R41 IonicContact OE2-NE 2.8Å; E38-R41 IonicContact OE2-NH1 3.81Å; E38-R41 PolarHBondContact OE2-NH1 3.01Å; R39-R41 PolarHBondContact O-N 3.39Å; R41-H44 PolarHBondContact O-N 3.43Å; R41-T45 WeakPolarHBondContact O-CB 3.07Å; R41-T45 PolarHBondContact O-N 2.96Å; R41-T45 PolarHBondContact O-OG1 3.13Å
42	K	95.8	Very high	91.8	Very high	134 Å²	134	108 Å²	108	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-63.1	-48.9	178.1	-74.7	175.3	-179.8	177.1	0	111.7	E38 R39 H44 T45 E46	E38-K42 HydrophobicContact CG-CD 4.5Å; E38-K42 WeakPolarHBondContact O-CG 3.46Å; E38-K42 PolarHBondContact O-N 2.81Å; E38-K42 WeakPolarHBondContact OE1-CE 3.32Å; R39-K42 PolarHBondContact O-N 3.1Å; K42-H44 VanDerWaalsContact C-N 3.34Å; K42-H44 PolarHBondContact O-N 2.89Å; K42-T45 PolarHBondContact O-N 3.26Å; K42-E46 WeakPolarHBondContact O-CB 3.29Å; K42-E46 PolarHBondContact O-N 3.5Å
43	L	95.8	Very high	93.4	Very high	97 Å²	97	104.6 Å²	104.6	51%	0.508	47%	0.474	S	S	.	.	H	α-helix	trans	-60.1	-42.9	177.2	-71.1	172.1	0	0	0	112	R39 R40 E46 A47	R39-L43 HydrophobicContact CG-CD1 4.19Å; R39-L43 WeakPolarHBondContact O-CG 3.31Å; R39-L43 PolarHBondContact O-N 2.99Å; R40-L43 PolarHBondContact O-N 3.4Å; L43-E46 PolarHBondContact O-N 3.48Å; L43-A47 WeakPolarHBondContact O-CB 3.39Å; L43-A47 PolarHBondContact O-N 2.86Å
44	H	96.9	Very high	94.6	Very high	136 Å²	136	103.9 Å²	103.9	63%	0.63	47%	0.472	S	S	*	.	H	α-helix	trans	-62.2	-44.7	176	-179.9	-84.9	0	0	0	112.1	R40 R41 K42 A47 E48	R40-H44 WeakPolarHBondContact O-CB 3.38Å; R40-H44 PolarHBondContact O-N 3.26Å; R41-H44 PolarHBondContact O-N 3.43Å; K42-H44 VanDerWaalsContact C-N 3.34Å; K42-H44 PolarHBondContact O-N 2.89Å; H44-A47 PolarHBondContact O-N 2.87Å; H44-E48 WeakPolarHBondContact O-CB 3.43Å; H44-E48 PolarHBondContact O-N 2.91Å
45	T	97.6	Very high	95.5	Very high	85 Å²	85	100.1 Å²	100.1	52%	0.521	46%	0.461	S	S	.	.	H	α-helix	trans	-63.8	-42.3	177.7	-55.3	0	0	0	0	111.4	R41 K42 E48 Q49	R41-T45 WeakPolarHBondContact O-CB 3.07Å; R41-T45 PolarHBondContact O-N 2.96Å; R41-T45 PolarHBondContact O-OG1 3.13Å; K42-T45 PolarHBondContact O-N 3.26Å; T45-E48 PolarHBondContact O-N 2.88Å; T45-Q49 WeakPolarHBondContact O-CB 3.42Å; T45-Q49 PolarHBondContact O-N 2.9Å
46	E	97.9	Very high	95.9	Very high	100 Å²	100	104.4 Å²	104.4	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-64	-44.1	176.9	-166.1	-152.6	120	0	0	111.8	K42 L43 Q49 R50	K42-E46 WeakPolarHBondContact O-CB 3.29Å; K42-E46 PolarHBondContact O-N 3.5Å; L43-E46 PolarHBondContact O-N 3.48Å; E46-Q49 PolarHBondContact O-N 3.48Å; E46-R50 PolarHBondContact O-N 2.84Å; E46-R50 IonicContact OE1-CZ 3.79Å; E46-R50 IonicContact OE1-NE 3.35Å; E46-R50 PolarHBondContact OE1-NE 3.01Å; E46-R50 IonicContact OE1-NH2 3.51Å; E46-R50 PolarHBondContact OE1-NH2 3.32Å
47	A	98.4	Very high	96.3	Very high	42 Å²	42	109.1 Å²	109.1	35%	0.347	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-44.7	176.6	0	0	0	0	0	112.1	L43 H44 Q49 R50 R51	L43-A47 WeakPolarHBondContact O-CB 3.39Å; L43-A47 PolarHBondContact O-N 2.86Å; H44-A47 PolarHBondContact O-N 2.87Å; A47-Q49 VanDerWaalsContact C-N 3.34Å; A47-Q49 PolarHBondContact O-N 3Å; A47-R50 PolarHBondContact O-N 3.35Å; A47-R51 PolarHBondContact O-N 3.39Å
48	E	98.4	Very high	96.6	Very high	48 Å²	48	103.6 Å²	103.6	22%	0.224	48%	0.476	C	S	.	.	H	α-helix	trans	-66.6	-35.1	176	175.5	58.4	-169.9	0	0	111.7	H44 T45 R51 R52	H44-E48 WeakPolarHBondContact O-CB 3.43Å; H44-E48 PolarHBondContact O-N 2.91Å; T45-E48 PolarHBondContact O-N 2.88Å; E48-R51 WeakPolarHBondContact O-CB 3.44Å; E48-R51 PolarHBondContact O-N 3.4Å; E48-R51 IonicContact OE1-NH1 2.78Å; E48-R51 PolarHBondContact OE1-NH1 3.42Å; E48-R51 VanDerWaalsContact OE1-NH1 3.17Å; E48-R51 WeakPolarHBondContact OE2-CD 3.33Å; E48-R51 IonicContact OE2-CZ 2.8Å; E48-R51 IonicContact OE2-NH1 2.66Å; E48-R51 PolarHBondContact OE2-NH1 3.43Å; E48-R52 VanDerWaalsContact O-CG 3.31Å; E48-R52 WeakPolarHBondContact O-CG 3.3Å; E48-R52 PolarHBondContact O-N 3.35Å; E48-R52 IonicContact OE1-CZ 2.68Å; E48-R52 IonicContact OE1-NE 3.58Å; E48-R52 PolarHBondContact OE1-NE 3.27Å; E48-R52 IonicContact OE1-NH2 3.52Å; E48-R52 PolarHBondContact OE1-NH2 2.78Å
49	Q	98.3	Very high	96.8	Very high	95 Å²	95	103.4 Å²	103.4	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-66.1	-41.8	173.3	-172	60.4	39.4	0	0	111.7	T45 E46 A47 R51 R52 N53	T45-Q49 WeakPolarHBondContact O-CB 3.42Å; T45-Q49 PolarHBondContact O-N 2.9Å; E46-Q49 PolarHBondContact O-N 3.48Å; A47-Q49 VanDerWaalsContact C-N 3.34Å; A47-Q49 PolarHBondContact O-N 3Å; Q49-R51 VanDerWaalsContact C-N 3.33Å; Q49-R51 PolarHBondContact O-N 3.43Å; Q49-R52 PolarHBondContact O-N 2.91Å; Q49-N53 PolarHBondContact NE2-OD1 3.29Å; Q49-N53 WeakPolarHBondContact O-CB 3.04Å; Q49-N53 PolarHBondContact O-N 2.89Å; Q49-N53 PolarHBondContact O-ND2 2.89Å
50	R	98.4	Very high	96.7	Very high	141 Å²	141	100.7 Å²	100.7	53%	0.532	47%	0.469	S	S	.	.	H	α-helix	trans	-59	-44.5	172.8	-78.6	-170.9	-91.9	117.8	-7.5	111.2	E46 A47 N53 A54	E46-R50 PolarHBondContact O-N 2.84Å; E46-R50 IonicContact OE1-CZ 3.79Å; E46-R50 IonicContact OE1-NE 3.35Å; E46-R50 PolarHBondContact OE1-NE 3.01Å; E46-R50 IonicContact OE1-NH2 3.51Å; E46-R50 PolarHBondContact OE1-NH2 3.32Å; A47-R50 PolarHBondContact O-N 3.35Å; R50-N53 PolarHBondContact O-N 3.46Å; R50-A54 PolarHBondContact O-N 3.3Å
51	R	98.6	Very high	96.7	Very high	142 Å²	142	95.8 Å²	95.8	54%	0.536	46%	0.459	S	S	.	.	H	α-helix	trans	-59.1	-46.4	173.8	178.6	175.9	164.9	-89.7	-3.8	111.9	A47 E48 Q49 N53 A54 I55	A47-R51 PolarHBondContact O-N 3.39Å; E48-R51 WeakPolarHBondContact O-CB 3.44Å; E48-R51 PolarHBondContact O-N 3.4Å; E48-R51 IonicContact OE1-NH1 2.78Å; E48-R51 PolarHBondContact OE1-NH1 3.42Å; E48-R51 VanDerWaalsContact OE1-NH1 3.17Å; E48-R51 WeakPolarHBondContact OE2-CD 3.33Å; E48-R51 IonicContact OE2-CZ 2.8Å; E48-R51 IonicContact OE2-NH1 2.66Å; E48-R51 PolarHBondContact OE2-NH1 3.43Å; Q49-R51 VanDerWaalsContact C-N 3.33Å; Q49-R51 PolarHBondContact O-N 3.43Å; R51-N53 PolarHBondContact O-N 3.49Å; R51-A54 PolarHBondContact O-N 2.81Å; R51-I55 HydrophobicContact CG-CD1 4.23Å; R51-I55 WeakPolarHBondContact O-CG1 3.09Å; R51-I55 PolarHBondContact O-N 3.32Å
52	R	98.4	Very high	96.7	Very high	146 Å²	146	91.9 Å²	91.9	55%	0.551	45%	0.448	S	S	*	.	H	α-helix	trans	-62.1	-42.7	177.3	-74.2	174.9	-173.6	-101.9	-10.2	112.7	E48 Q49 A54 I55 K56	E48-R52 VanDerWaalsContact O-CG 3.31Å; E48-R52 WeakPolarHBondContact O-CG 3.3Å; E48-R52 PolarHBondContact O-N 3.35Å; E48-R52 IonicContact OE1-CZ 2.68Å; E48-R52 IonicContact OE1-NE 3.58Å; E48-R52 PolarHBondContact OE1-NE 3.27Å; E48-R52 IonicContact OE1-NH2 3.52Å; E48-R52 PolarHBondContact OE1-NH2 2.78Å; Q49-R52 PolarHBondContact O-N 2.91Å; R52-A54 VanDerWaalsContact C-N 3.33Å; R52-I55 PolarHBondContact O-N 2.95Å; R52-K56 WeakPolarHBondContact O-CB 3.37Å; R52-K56 PolarHBondContact O-N 3.44Å
53	N	98.1	Very high	96.5	Very high	74 Å²	74	87.7 Å²	87.7	40%	0.396	43%	0.432	S	S	.	.	H	α-helix	trans	-65.2	-37.5	177.4	-69.6	-14.4	0	0	0	111.6	Q49 R50 R51 K56 R57	Q49-N53 PolarHBondContact NE2-OD1 3.29Å; Q49-N53 WeakPolarHBondContact O-CB 3.04Å; Q49-N53 PolarHBondContact O-N 2.89Å; Q49-N53 PolarHBondContact O-ND2 2.89Å; R50-N53 PolarHBondContact O-N 3.46Å; R51-N53 PolarHBondContact O-N 3.49Å; N53-K56 PolarHBondContact O-N 3.19Å; N53-R57 WeakPolarHBondContact O-CG 3.46Å; N53-R57 PolarHBondContact O-N 3.43Å; N53-R57 VanDerWaalsContact O-N 3.08Å
54	A	98.3	Very high	96.2	Very high	44 Å²	44	90 Å²	90	36%	0.364	44%	0.44	S	S	.	.	H	α-helix	trans	-64.5	-45.4	174.2	0	0	0	0	0	112.1	R50 R51 R52 K56 R57 G58	R50-A54 PolarHBondContact O-N 3.3Å; R51-A54 PolarHBondContact O-N 2.81Å; R52-A54 VanDerWaalsContact C-N 3.33Å; A54-K56 VanDerWaalsContact C-N 3.33Å; A54-K56 PolarHBondContact O-N 2.9Å; A54-R57 PolarHBondContact O-N 2.9Å; A54-G58 PolarHBondContact O-N 3.23Å
55	I	97.8	Very high	96	Very high	72 Å²	72	89.5 Å²	89.5	37%	0.369	44%	0.442	S	S	.	.	H	α-helix	trans	-61	-42.9	175.3	-67.6	168.9	0	0	0	110.9	R51 R52 R57 G58 F59	R51-I55 HydrophobicContact CG-CD1 4.23Å; R51-I55 WeakPolarHBondContact O-CG1 3.09Å; R51-I55 PolarHBondContact O-N 3.32Å; R52-I55 PolarHBondContact O-N 2.95Å; I55-R57 PolarHBondContact O-N 3.36Å; I55-G58 PolarHBondContact O-N 2.92Å; I55-G58 VanDerWaalsContact O-N 3.15Å; I55-F59 HydrophobicContact CG2-CD2 3.86Å; I55-F59 HydrophobicContact CG2-CE2 3.83Å; I55-F59 WeakPolarHBondContact O-CD2 3.3Å; I55-F59 PolarHBondContact O-N 3.16Å
56	K	96.1	Very high	95.6	Very high	131 Å²	131	85.7 Å²	85.7	57%	0.57	42%	0.418	S	S	*	.	H	α-helix	trans	-58.7	-47.1	178	-170.2	-173	176.2	-162	0	111.6	R52 N53 A54 G58 F59 E60	R52-K56 WeakPolarHBondContact O-CB 3.37Å; R52-K56 PolarHBondContact O-N 3.44Å; N53-K56 PolarHBondContact O-N 3.19Å; A54-K56 VanDerWaalsContact C-N 3.33Å; A54-K56 PolarHBondContact O-N 2.9Å; K56-G58 VanDerWaalsContact C-N 3.31Å; K56-G58 PolarHBondContact O-N 3.44Å; K56-F59 PolarHBondContact O-N 2.94Å; K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 3.44Å; K56-E60 IonicContact NZ-OE1 2.76Å; K56-E60 WeakPolarHBondContact O-CG 3.49Å; K56-E60 PolarHBondContact O-N 2.59Å
57	R	95.4	Very high	94.8	Very high	166 Å²	166	84.5 Å²	84.5	63%	0.626	41%	0.413	S	S	*	.	H	α-helix	trans	-60.3	-38.9	174.3	-74.4	-175.4	-70.8	123.9	-6.1	112.4	N53 A54 I55 F59 E60 G61	N53-R57 WeakPolarHBondContact O-CG 3.46Å; N53-R57 PolarHBondContact O-N 3.43Å; N53-R57 VanDerWaalsContact O-N 3.08Å; A54-R57 PolarHBondContact O-N 2.9Å; I55-R57 PolarHBondContact O-N 3.36Å; R57-F59 PolarHBondContact O-N 3Å; R57-E60 PolarHBondContact O-N 3.39Å; R57-G61 PolarHBondContact O-N 3.08Å
58	G	95.8	Very high	93.3	Very high	47 Å²	47	86.1 Å²	86.1	49%	0.485	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-40.7	174.5	0	0	0	0	0	113.2	A54 I55 K56 L62	A54-G58 PolarHBondContact O-N 3.23Å; I55-G58 PolarHBondContact O-N 2.92Å; I55-G58 VanDerWaalsContact O-N 3.15Å; K56-G58 VanDerWaalsContact C-N 3.31Å; K56-G58 PolarHBondContact O-N 3.44Å; G58-L62 WeakPolarHBondContact O-CB 3.29Å; G58-L62 PolarHBondContact O-N 3.11Å
59	F	95.5	Very high	91.3	Very high	45 Å²	45	92.2 Å²	92.2	20%	0.197	45%	0.45	C	S	.	.	H	α-helix	trans	-67.7	-37.1	174	-88.2	-79.4	0	0	0	113	I55 K56 R57 L62 L63 K82 I85 L86	I55-F59 HydrophobicContact CG2-CD2 3.86Å; I55-F59 HydrophobicContact CG2-CE2 3.83Å; I55-F59 WeakPolarHBondContact O-CD2 3.3Å; I55-F59 PolarHBondContact O-N 3.16Å; K56-F59 PolarHBondContact O-N 2.94Å; R57-F59 PolarHBondContact O-N 3Å; F59-L62 PolarHBondContact O-N 3.24Å; F59-L63 WeakPolarHBondContact O-CB 3.44Å; F59-L63 PolarHBondContact O-N 3.46Å; F59-K82 HydrophobicContact CD1-CB 4.42Å; F59-K82 HydrophobicContact CD1-CG 4.32Å; F59-K82 HydrophobicContact CE1-CB 3.81Å; F59-K82 HydrophobicContact CE1-CG 4.09Å; F59-K82 HydrophobicContact CE2-CD 4.38Å; F59-K82 HydrophobicContact CZ-CB 4.05Å; F59-K82 HydrophobicContact CZ-CD 4.33Å; F59-K82 HydrophobicContact CZ-CG 4.21Å; F59-I85 HydrophobicContact CD1-CB 4.23Å; F59-I85 HydrophobicContact CD1-CD1 4.02Å; F59-I85 HydrophobicContact CD1-CG2 4.08Å; F59-L86 HydrophobicContact CE1-CD1 4.42Å; F59-L86 HydrophobicContact CE1-CD2 4.07Å; F59-L86 HydrophobicContact CE1-CG 3.99Å; F59-L86 HydrophobicContact CZ-CD1 4.35Å; F59-L86 HydrophobicContact CZ-CD2 4.29Å; F59-L86 HydrophobicContact CZ-CG 4.34Å
60	E	91.8	Very high	89.2	Confident	104 Å²	104	96.6 Å²	96.6	49%	0.486	47%	0.467	S	S	.	.	H	α-helix	trans	-63.8	-46.8	175.5	-71.5	166.9	-178.5	0	0	110.9	K56 R57 L63 E64	K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 3.44Å; K56-E60 IonicContact NZ-OE1 2.76Å; K56-E60 WeakPolarHBondContact O-CG 3.49Å; K56-E60 PolarHBondContact O-N 2.59Å; R57-E60 PolarHBondContact O-N 3.39Å; E60-L63 WeakPolarHBondContact O-CB 3.37Å; E60-L63 PolarHBondContact O-N 3.29Å; E60-E64 PolarHBondContact O-N 3.4Å
61	G	93	Very high	86.4	Confident	31 Å²	31	97.1 Å²	97.1	32%	0.32	48%	0.481	S	S	.	.	H	α-helix	trans	-65.4	-38	174.7	0	0	0	0	0	113.3	R57 L63 E64 L65	R57-G61 PolarHBondContact O-N 3.08Å; G61-L63 PolarHBondContact O-N 2.77Å; G61-E64 PolarHBondContact O-N 3.29Å; G61-L65 WeakPolarHBondContact O-CG 3.38Å; G61-L65 PolarHBondContact O-N 3.31Å
62	L	94.2	Very high	83.8	Confident	49 Å²	49	99.1 Å²	99.1	26%	0.257	50%	0.496	S	S	.	.	H	α-helix	trans	-65.3	-39.6	175.4	-174.6	58.4	0	0	0	111.8	G58 F59 E64 L65 V66 I85 L86 A89	G58-L62 WeakPolarHBondContact O-CB 3.29Å; G58-L62 PolarHBondContact O-N 3.11Å; F59-L62 PolarHBondContact O-N 3.24Å; L62-E64 VanDerWaalsContact C-N 3.3Å; L62-E64 PolarHBondContact O-N 3.17Å; L62-L65 PolarHBondContact O-N 3.48Å; L62-V66 HydrophobicContact CD1-CG1 3.95Å; L62-V66 HydrophobicContact CG-CG1 4.25Å; L62-V66 WeakPolarHBondContact O-CG1 3.38Å; L62-V66 WeakPolarHBondContact O-CG2 3.21Å; L62-V66 PolarHBondContact O-N 3.33Å; L62-I85 HydrophobicContact CB-CG2 4.06Å; L62-I85 HydrophobicContact CD2-CG2 3.69Å; L62-I85 HydrophobicContact CG-CG2 3.69Å; L62-L86 HydrophobicContact CD2-CD2 4.31Å; L62-A89 HydrophobicContact CD1-CB 3.81Å; L62-A89 HydrophobicContact CD2-CB 3.96Å; L62-A89 HydrophobicContact CG-CB 4.16Å
63	L	91.9	Very high	81.1	Confident	46 Å²	46	97.2 Å²	97.2	24%	0.241	51%	0.506	C	S	.	.	H	α-helix	trans	-58.5	-42.4	177.1	177.7	60.5	0	0	0	111.6	F59 E60 G61 V66 H67 M80 I85	F59-L63 WeakPolarHBondContact O-CB 3.44Å; F59-L63 PolarHBondContact O-N 3.46Å; E60-L63 WeakPolarHBondContact O-CB 3.37Å; E60-L63 PolarHBondContact O-N 3.29Å; G61-L63 PolarHBondContact O-N 2.77Å; L63-V66 PolarHBondContact O-N 3.28Å; L63-H67 HydrophobicContact CD1-CB 4.41Å; L63-H67 WeakPolarHBondContact O-CB 3.01Å; L63-H67 PolarHBondContact O-N 3.07Å; L63-M80 HydrophobicContact CD1-CB 4.03Å; L63-M80 HydrophobicContact CD1-CG 4.09Å; L63-M80 HydrophobicContact CD1-SD 3.64Å; L63-I85 HydrophobicContact CB-CD1 4.23Å; L63-I85 HydrophobicContact CD1-CD1 4.39Å; L63-I85 HydrophobicContact CD1-CG1 4.12Å
64	E	90.1	Very high	78.3	Confident	146 Å²	146	102.1 Å²	102.1	68%	0.682	53%	0.531	S	S	*	.	H	α-helix	trans	-60	-43.9	176.3	-172.3	177.6	-179.6	0	0	112	E60 G61 L62 H67	E60-E64 PolarHBondContact O-N 3.4Å; G61-E64 PolarHBondContact O-N 3.29Å; L62-E64 VanDerWaalsContact C-N 3.3Å; L62-E64 PolarHBondContact O-N 3.17Å; E64-H67 CarbonylContact O-C 3.35Å
65	L	91.3	Very high	75.7	Confident	126 Å²	126	102.8 Å²	102.8	66%	0.66	53%	0.533	S	S	*	.	H	α-helix	trans	-69.2	-41.1	179.5	-65.6	173.8	0	0	0	113.4	G61 L62 H67 P68	G61-L65 WeakPolarHBondContact O-CG 3.38Å; G61-L65 PolarHBondContact O-N 3.31Å; L62-L65 PolarHBondContact O-N 3.48Å; L65-H67 VanDerWaalsContact C-N 3.34Å; L65-P68 WeakPolarHBondContact O-CD 3.3Å; L65-P68 WeakPolarHBondContact O-CG 3.43Å
66	V	89.3	Confident	73.6	Confident	5 Å²	5	105.8 Å²	105.8	3%	0.03	56%	0.557	C	S	.	*	H	α-helix	trans	-83.1	-15.8	-177.3	-56.2	0	0	0	0	112.8	L62 L63 P68 I85 K88 A89 M92	L62-V66 HydrophobicContact CD1-CG1 3.95Å; L62-V66 HydrophobicContact CG-CG1 4.25Å; L62-V66 WeakPolarHBondContact O-CG1 3.38Å; L62-V66 WeakPolarHBondContact O-CG2 3.21Å; L62-V66 PolarHBondContact O-N 3.33Å; L63-V66 PolarHBondContact O-N 3.28Å; V66-P68 VanDerWaalsContact C-CD 3.48Å; V66-I85 HydrophobicContact CG2-CG2 4.48Å; V66-K88 HydrophobicContact CB-CB 4.11Å; V66-K88 HydrophobicContact CB-CD 4.16Å; V66-K88 HydrophobicContact CB-CG 4Å; V66-K88 HydrophobicContact CG2-CB 4.18Å; V66-K88 HydrophobicContact CG2-CD 4.14Å; V66-K88 HydrophobicContact CG2-CG 4.34Å; V66-K88 WeakPolarHBondContact O-CD 3.4Å; V66-K88 WeakPolarHBondContact O-CE 3.49Å; V66-K88 PolarHBondContact O-NZ 2.7Å; V66-A89 VanDerWaalsContact CG1-CA 3.46Å; V66-A89 HydrophobicContact CG1-CB 3.74Å; V66-M92 HydrophobicContact CB-CG 4.4Å
67	H	82.5	Confident	71.6	Confident	75 Å²	75	103.4 Å²	103.4	35%	0.347	56%	0.557	S	S	.	*	S	Bend	trans	-129.8	65.9	175.6	-148.2	157.3	0	0	0	110.4	L63 E64 L65 M69	L63-H67 HydrophobicContact CD1-CB 4.41Å; L63-H67 WeakPolarHBondContact O-CB 3.01Å; L63-H67 PolarHBondContact O-N 3.07Å; E64-H67 CarbonylContact O-C 3.35Å; L65-H67 VanDerWaalsContact C-N 3.34Å; H67-M69 PolarHBondContact O-N 3.35Å
68	P	66.6	Low	70	Confident	75 Å²	75	99.1 Å²	99.1	49%	0.487	55%	0.549	S	S	.	.			trans	-58.5	116.3	174.2	-15.7	28.7	0	0	0	107.4	L65 V66 K70	L65-P68 WeakPolarHBondContact O-CD 3.3Å; L65-P68 WeakPolarHBondContact O-CG 3.43Å; V66-P68 VanDerWaalsContact C-CD 3.48Å; P68-K70 VanDerWaalsContact C-N 3.28Å; P68-K70 PolarHBondContact O-N 2.62Å
69	M	56.6	Low	69	Low	177 Å²	177	108 Å²	108	87%	0.872	57%	0.568	S	S	*	*			trans	-62.5	89.5	-179.3	-73.3	-164	-83.5	0	0	109.1	H67 N71	H67-M69 PolarHBondContact O-N 3.35Å; M69-N71 PolarHBondContact O-N 3.33Å
70	K	53.2	Low	68.5	Low	186 Å²	186	107.9 Å²	107.9	81%	0.809	57%	0.568	S	S	*	*			trans	-82.3	97.3	167.9	-73.3	-171.2	176.8	-171.1	0	107.4	P68 E72	P68-K70 VanDerWaalsContact C-N 3.28Å; P68-K70 PolarHBondContact O-N 2.62Å; K70-E72 PolarHBondContact O-N 3.37Å
71	N	39.6	Very low	68.6	Low	152 Å²	152	105.9 Å²	105.9	81%	0.813	57%	0.566	S	S	*	*	S	Bend	trans	43.5	76.3	147.4	-52	-14.9	0	0	0	115.8	M69	M69-N71 PolarHBondContact O-N 3.33Å
72	E	44.9	Very low	68.6	Low	184 Å²	184	111.2 Å²	111.2	86%	0.86	58%	0.58	S	S	*	*	S	Bend	trans	-172.4	124.1	138.9	-106.1	175.2	-160.9	0	0	107.8	K70	K70-E72 PolarHBondContact O-N 3.37Å
73	S	42	Very low	68.7	Low	107 Å²	107	111.9 Å²	111.9	75%	0.748	59%	0.589	S	S	*	*			trans	34.3	121	163.6	58.7	0	0	0	0	119.1	S75	S73-S75 PolarHBondContact O-N 2.99Å
74	L	38.3	Very low	68.8	Low	177 Å²	177	112.1 Å²	112.1	93%	0.927	59%	0.594	S	S	*	*			trans	-36.3	98.3	169.1	-70.9	88.9	0	0	0	113.1	P76	L74-P76 WeakPolarHBondContact O-CD 3.17Å
75	S	43	Very low	69	Low	58 Å²	58	105.6 Å²	105.6	41%	0.406	56%	0.564	S	S	.	*			trans	-111.1	94.6	156	160.5	0	0	0	0	106.2	S73 S77	S73-S75 PolarHBondContact O-N 2.99Å; S75-S77 PolarHBondContact O-N 3.07Å; S75-S77 PolarHBondContact OG-OG 2.88Å
76	P	54	Low	69.3	Low	134 Å²	134	103.5 Å²	103.5	87%	0.87	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	19.5	170.1	29.1	-34	0	0	0	112.3	L74	L74-P76 WeakPolarHBondContact O-CD 3.17Å
77	S	54.5	Low	69.7	Low	82 Å²	82	109.1 Å²	109.1	57%	0.573	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	11.6	-166.5	73.9	0	0	0	0	115	S75 R79	S75-S77 PolarHBondContact O-N 3.07Å; S75-S77 PolarHBondContact OG-OG 2.88Å; S77-R79 PolarHBondContact O-N 3.09Å
78	V	60.9	Low	70.2	Confident	75 Å²	75	108.4 Å²	108.4	46%	0.455	58%	0.575	S	S	.	*			trans	-71.6	75.3	168.7	-173.3	0	0	0	0	109.5	M80	V78-M80 HydrophobicContact CG1-CG 4.12Å; V78-M80 PolarHBondContact O-N 2.86Å
79	R	76.9	Confident	71.6	Confident	234 Å²	234	105.3 Å²	105.3	88%	0.883	56%	0.555	S	S	*	*			trans	-76.2	87.1	172.6	-71.9	-179.8	60	-174.7	-3.2	108.1	S77	S77-R79 PolarHBondContact O-N 3.09Å
80	M	84.1	Confident	73.6	Confident	43 Å²	43	101.3 Å²	101.3	21%	0.212	54%	0.536	C	S	.	.			trans	-73.3	140.5	166.2	-74.3	-179.9	58.9	0	0	110	L63 V78 S84 I85 K88	L63-M80 HydrophobicContact CD1-CB 4.03Å; L63-M80 HydrophobicContact CD1-CG 4.09Å; L63-M80 HydrophobicContact CD1-SD 3.64Å; V78-M80 HydrophobicContact CG1-CG 4.12Å; V78-M80 PolarHBondContact O-N 2.86Å; M80-S84 VanDerWaalsContact CE-C 3.46Å; M80-S84 VanDerWaalsContact CE-O 3.29Å; M80-S84 WeakPolarHBondContact CE-O 3.15Å; M80-I85 HydrophobicContact CB-CD1 4.31Å; M80-I85 HydrophobicContact CB-CG1 3.68Å; M80-I85 HydrophobicContact CE-CG1 4.33Å; M80-K88 HydrophobicContact CE-CB 4.02Å; M80-K88 HydrophobicContact CE-CD 3.85Å; M80-K88 HydrophobicContact SD-CD 4.31Å
81	S	93.1	Very high	75.6	Confident	61 Å²	61	98.7 Å²	98.7	43%	0.427	52%	0.522	S	S	.	.			trans	-64.4	153.9	171.3	82.3	0	0	0	0	110.1	S83 S84 I85	S81-S83 PolarHBondContact O-N 3.25Å; S81-S84 WeakPolarHBondContact O-CB 3.14Å; S81-S84 PolarHBondContact O-N 3.26Å; S81-S84 WeakPolarHBondContact OG-CB 3.4Å; S81-S84 PolarHBondContact OG-N 2.95Å; S81-S84 PolarHBondContact OG-OG 3.37Å; S81-I85 WeakPolarHBondContact O-CG1 3.25Å; S81-I85 PolarHBondContact O-N 3.46Å
82	K	94.4	Very high	78.3	Confident	144 Å²	144	92.5 Å²	92.5	63%	0.626	49%	0.489	S	S	*	.	H	α-helix	trans	-52.4	-41.9	175	-68.5	-178.4	179.7	179.1	0	111.8	F59 I85 L86	F59-K82 HydrophobicContact CD1-CB 4.42Å; F59-K82 HydrophobicContact CD1-CG 4.32Å; F59-K82 HydrophobicContact CE1-CB 3.81Å; F59-K82 HydrophobicContact CE1-CG 4.09Å; F59-K82 HydrophobicContact CE2-CD 4.38Å; F59-K82 HydrophobicContact CZ-CB 4.05Å; F59-K82 HydrophobicContact CZ-CD 4.33Å; F59-K82 HydrophobicContact CZ-CG 4.21Å; K82-I85 PolarHBondContact O-N 2.96Å; K82-L86 WeakPolarHBondContact O-CG 3.01Å; K82-L86 PolarHBondContact O-N 3.31Å; K82-L86 VanDerWaalsContact O-N 3.15Å
83	S	96.2	Very high	80.8	Confident	62 Å²	62	89.6 Å²	89.6	43%	0.434	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-45.2	176.1	175.9	0	0	0	0	111.9	S81 I85 L86 H87	S81-S83 PolarHBondContact O-N 3.25Å; S83-I85 VanDerWaalsContact C-N 3.32Å; S83-I85 PolarHBondContact O-N 2.91Å; S83-L86 PolarHBondContact O-N 2.86Å; S83-H87 PolarHBondContact O-N 2.91Å; S83-H87 PolarHBondContact O-ND1 2.89Å; S83-H87 VanDerWaalsContact O-ND1 3.1Å; S83-H87 PolarHBondContact OG-CE1 2.96Å; S83-H87 PolarHBondContact OG-ND1 2.86Å
84	S	94.1	Very high	83.4	Confident	52 Å²	52	90 Å²	90	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-62	-38.4	177.4	-53.9	0	0	0	0	112.4	M80 S81 K88	M80-S84 VanDerWaalsContact CE-C 3.46Å; M80-S84 VanDerWaalsContact CE-O 3.29Å; M80-S84 WeakPolarHBondContact CE-O 3.15Å; S81-S84 WeakPolarHBondContact O-CB 3.14Å; S81-S84 PolarHBondContact O-N 3.26Å; S81-S84 WeakPolarHBondContact OG-CB 3.4Å; S81-S84 PolarHBondContact OG-N 2.95Å; S81-S84 PolarHBondContact OG-OG 3.37Å; S84-K88 WeakPolarHBondContact O-CB 3.4Å; S84-K88 PolarHBondContact O-N 3.22Å
85	I	94.3	Very high	86.2	Confident	9 Å²	9	86.2 Å²	86.2	5%	0.046	44%	0.441	C	S	.	.	H	α-helix	trans	-62.1	-47.3	176.2	-63.8	169.2	0	0	0	110	F59 L62 L63 V66 M80 S81 K82 S83 K88 A89	F59-I85 HydrophobicContact CD1-CB 4.23Å; F59-I85 HydrophobicContact CD1-CD1 4.02Å; F59-I85 HydrophobicContact CD1-CG2 4.08Å; L62-I85 HydrophobicContact CB-CG2 4.06Å; L62-I85 HydrophobicContact CD2-CG2 3.69Å; L62-I85 HydrophobicContact CG-CG2 3.69Å; L63-I85 HydrophobicContact CB-CD1 4.23Å; L63-I85 HydrophobicContact CD1-CD1 4.39Å; L63-I85 HydrophobicContact CD1-CG1 4.12Å; V66-I85 HydrophobicContact CG2-CG2 4.48Å; M80-I85 HydrophobicContact CB-CD1 4.31Å; M80-I85 HydrophobicContact CB-CG1 3.68Å; M80-I85 HydrophobicContact CE-CG1 4.33Å; S81-I85 WeakPolarHBondContact O-CG1 3.25Å; S81-I85 PolarHBondContact O-N 3.46Å; K82-I85 PolarHBondContact O-N 2.96Å; S83-I85 VanDerWaalsContact C-N 3.32Å; S83-I85 PolarHBondContact O-N 2.91Å; I85-K88 PolarHBondContact O-N 3.33Å; I85-A89 WeakPolarHBondContact O-CB 3.18Å; I85-A89 PolarHBondContact O-N 3.21Å
86	L	97.4	Very high	88.8	Confident	82 Å²	82	87.7 Å²	87.7	43%	0.429	45%	0.445	S	S	.	.	H	α-helix	trans	-63.2	-46.5	179	-66	173.2	0	0	0	112.2	F59 L62 K82 S83 K88 A89 I90	F59-L86 HydrophobicContact CE1-CD1 4.42Å; F59-L86 HydrophobicContact CE1-CD2 4.07Å; F59-L86 HydrophobicContact CE1-CG 3.99Å; F59-L86 HydrophobicContact CZ-CD1 4.35Å; F59-L86 HydrophobicContact CZ-CD2 4.29Å; F59-L86 HydrophobicContact CZ-CG 4.34Å; L62-L86 HydrophobicContact CD2-CD2 4.31Å; K82-L86 WeakPolarHBondContact O-CG 3.01Å; K82-L86 PolarHBondContact O-N 3.31Å; K82-L86 VanDerWaalsContact O-N 3.15Å; S83-L86 PolarHBondContact O-N 2.86Å; L86-K88 VanDerWaalsContact C-N 3.33Å; L86-K88 PolarHBondContact O-N 3.29Å; L86-A89 WeakPolarHBondContact O-CB 3.42Å; L86-A89 PolarHBondContact O-N 2.95Å; L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 3.05Å
87	H	96.3	Very high	90.9	Very high	122 Å²	122	83 Å²	83	57%	0.565	42%	0.421	S	S	*	.	H	α-helix	trans	-60.8	-43.3	177.2	-70.9	131.9	0	0	0	112	S83 A89 I90 Y91	S83-H87 PolarHBondContact O-N 2.91Å; S83-H87 PolarHBondContact O-ND1 2.89Å; S83-H87 VanDerWaalsContact O-ND1 3.1Å; S83-H87 PolarHBondContact OG-CE1 2.96Å; S83-H87 PolarHBondContact OG-ND1 2.86Å; H87-A89 VanDerWaalsContact C-N 3.3Å; H87-A89 PolarHBondContact O-N 3.24Å; H87-I90 PolarHBondContact O-N 2.92Å; H87-Y91 PolarHBondContact O-N 2.88Å
88	K	94.3	Very high	93	Very high	61 Å²	61	86.6 Å²	86.6	27%	0.265	43%	0.426	S	S	.	.	H	α-helix	trans	-66.5	-34.4	177.4	-157.4	173.5	-174.3	-160.7	0	111.5	V66 M80 S84 I85 L86 M92	V66-K88 HydrophobicContact CB-CB 4.11Å; V66-K88 HydrophobicContact CB-CD 4.16Å; V66-K88 HydrophobicContact CB-CG 4Å; V66-K88 HydrophobicContact CG2-CB 4.18Å; V66-K88 HydrophobicContact CG2-CD 4.14Å; V66-K88 HydrophobicContact CG2-CG 4.34Å; V66-K88 WeakPolarHBondContact O-CD 3.4Å; V66-K88 WeakPolarHBondContact O-CE 3.49Å; V66-K88 PolarHBondContact O-NZ 2.7Å; M80-K88 HydrophobicContact CE-CB 4.02Å; M80-K88 HydrophobicContact CE-CD 3.85Å; M80-K88 HydrophobicContact SD-CD 4.31Å; S84-K88 WeakPolarHBondContact O-CB 3.4Å; S84-K88 PolarHBondContact O-N 3.22Å; I85-K88 PolarHBondContact O-N 3.33Å; L86-K88 VanDerWaalsContact C-N 3.33Å; L86-K88 PolarHBondContact O-N 3.29Å; K88-M92 HydrophobicContact CG-CG 4.47Å; K88-M92 WeakPolarHBondContact O-CB 3.46Å; K88-M92 WeakPolarHBondContact O-CG 3.4Å; K88-M92 PolarHBondContact O-N 2.86Å
89	A	96.6	Very high	94.7	Very high	10 Å²	10	87.6 Å²	87.6	8%	0.083	43%	0.425	C	S	.	.	H	α-helix	trans	-62.4	-48.2	173.8	0	0	0	0	0	112.2	L62 V66 I85 L86 H87 Y91 M92 I93	L62-A89 HydrophobicContact CD1-CB 3.81Å; L62-A89 HydrophobicContact CD2-CB 3.96Å; L62-A89 HydrophobicContact CG-CB 4.16Å; V66-A89 VanDerWaalsContact CG1-CA 3.46Å; V66-A89 HydrophobicContact CG1-CB 3.74Å; I85-A89 WeakPolarHBondContact O-CB 3.18Å; I85-A89 PolarHBondContact O-N 3.21Å; L86-A89 WeakPolarHBondContact O-CB 3.42Å; L86-A89 PolarHBondContact O-N 2.95Å; H87-A89 VanDerWaalsContact C-N 3.3Å; H87-A89 PolarHBondContact O-N 3.24Å; A89-Y91 PolarHBondContact O-N 3.39Å; A89-M92 PolarHBondContact O-N 3.04Å; A89-I93 VanDerWaalsContact O-CG1 3.31Å; A89-I93 WeakPolarHBondContact O-CG1 3.39Å; A89-I93 PolarHBondContact O-N 3.1Å
90	I	97.5	Very high	95.7	Very high	92 Å²	92	83.2 Å²	83.2	47%	0.472	41%	0.413	S	S	.	.	H	α-helix	trans	-57.4	-52.2	176.5	-66.4	164.8	0	0	0	109.9	L86 H87 M92 I93 E94	L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 3.05Å; H87-I90 PolarHBondContact O-N 2.92Å; I90-M92 VanDerWaalsContact C-N 3.29Å; I90-M92 PolarHBondContact O-N 3.46Å; I90-I93 PolarHBondContact O-N 3.27Å; I90-E94 WeakPolarHBondContact O-CG 3.4Å; I90-E94 PolarHBondContact O-N 3.07Å
91	Y	95.7	Very high	96.4	Very high	131 Å²	131	87.7 Å²	87.7	51%	0.514	43%	0.433	S	S	.	.	H	α-helix	trans	-55.9	-43.1	177.8	171.6	-100.2	0	0	0	112.7	H87 A89 R95	H87-Y91 PolarHBondContact O-N 2.88Å; A89-Y91 PolarHBondContact O-N 3.39Å; Y91-R95 VanDerWaalsContact O-CB 3.25Å; Y91-R95 WeakPolarHBondContact O-CB 3.49Å; Y91-R95 PolarHBondContact O-N 3.23Å
92	M	95.7	Very high	96.6	Very high	22 Å²	22	90.9 Å²	90.9	11%	0.108	44%	0.441	C	S	.	.	H	α-helix	trans	-66.5	-42.3	179.3	-72.9	-72	-69	0	0	112	V66 K88 A89 I90 R95 L96	V66-M92 HydrophobicContact CB-CG 4.4Å; K88-M92 HydrophobicContact CG-CG 4.47Å; K88-M92 WeakPolarHBondContact O-CB 3.46Å; K88-M92 WeakPolarHBondContact O-CG 3.4Å; K88-M92 PolarHBondContact O-N 2.86Å; A89-M92 PolarHBondContact O-N 3.04Å; I90-M92 VanDerWaalsContact C-N 3.29Å; I90-M92 PolarHBondContact O-N 3.46Å; M92-R95 VanDerWaalsContact CE-NH2 3.31Å; M92-R95 PolarHBondContact O-N 2.83Å; M92-R95 VanDerWaalsContact SD-CZ 3.59Å; M92-R95 PolarHBondContact SD-NH2 3.16Å; M92-L96 VanDerWaalsContact O-CB 3.27Å; M92-L96 WeakPolarHBondContact O-CB 3.2Å; M92-L96 WeakPolarHBondContact O-CG 3.33Å; M92-L96 PolarHBondContact O-N 3.03Å
93	I	97.3	Very high	96.8	Very high	123 Å²	123	89.9 Å²	89.9	63%	0.631	44%	0.437	S	S	*	.	H	α-helix	trans	-61.1	-47.3	176.5	-69.9	165.6	0	0	0	110.3	A89 I90 L96 G97	A89-I93 VanDerWaalsContact O-CG1 3.31Å; A89-I93 WeakPolarHBondContact O-CG1 3.39Å; A89-I93 PolarHBondContact O-N 3.1Å; I90-I93 PolarHBondContact O-N 3.27Å; I93-L96 PolarHBondContact O-N 3.45Å; I93-G97 PolarHBondContact O-N 3.17Å
94	E	97.8	Very high	96.9	Very high	117 Å²	117	91.9 Å²	91.9	55%	0.547	44%	0.442	S	S	.	.	H	α-helix	trans	-62.3	-45.8	178	-69.3	175.7	158.8	0	0	111.7	I90 G97 K98	I90-E94 WeakPolarHBondContact O-CG 3.4Å; I90-E94 PolarHBondContact O-N 3.07Å; E94-G97 PolarHBondContact O-N 3.35Å; E94-K98 WeakPolarHBondContact O-CG 3.49Å; E94-K98 PolarHBondContact O-N 2.87Å
95	R	96.5	Very high	97	Very high	96 Å²	96	92.6 Å²	92.6	36%	0.362	45%	0.447	S	S	.	.	H	α-helix	trans	-62.4	-47.1	178.4	-172.2	-174.6	73.3	169.7	3	111.7	Y91 M92 G97 K98 Q99	Y91-R95 VanDerWaalsContact O-CB 3.25Å; Y91-R95 WeakPolarHBondContact O-CB 3.49Å; Y91-R95 PolarHBondContact O-N 3.23Å; M92-R95 VanDerWaalsContact CE-NH2 3.31Å; M92-R95 PolarHBondContact O-N 2.83Å; M92-R95 VanDerWaalsContact SD-CZ 3.59Å; M92-R95 PolarHBondContact SD-NH2 3.16Å; R95-G97 VanDerWaalsContact C-N 3.32Å; R95-K98 PolarHBondContact O-N 3.4Å; R95-Q99 WeakPolarHBondContact O-CG 3.46Å; R95-Q99 PolarHBondContact O-N 2.78Å
96	L	97.4	Very high	97.2	Very high	90 Å²	90	96.5 Å²	96.5	47%	0.471	47%	0.465	S	S	.	.	H	α-helix	trans	-65.6	-36.2	177.4	-71.5	171.4	0	0	0	111.3	M92 I93 Q99 K100	M92-L96 VanDerWaalsContact O-CB 3.27Å; M92-L96 WeakPolarHBondContact O-CB 3.2Å; M92-L96 WeakPolarHBondContact O-CG 3.33Å; M92-L96 PolarHBondContact O-N 3.03Å; I93-L96 PolarHBondContact O-N 3.45Å; L96-Q99 PolarHBondContact O-N 3.02Å; L96-K100 WeakPolarHBondContact O-CB 3.31Å; L96-K100 PolarHBondContact O-N 2.99Å
97	G	97.9	Very high	97.2	Very high	36 Å²	36	95.1 Å²	95.1	37%	0.371	47%	0.466	S	S	.	.	H	α-helix	trans	-59.9	-47	173.5	0	0	0	0	0	112.4	I93 E94 R95 K100 H101	I93-G97 PolarHBondContact O-N 3.17Å; E94-G97 PolarHBondContact O-N 3.35Å; R95-G97 VanDerWaalsContact C-N 3.32Å; G97-K100 PolarHBondContact O-N 3.49Å; G97-H101 PolarHBondContact O-N 3.05Å
98	K	97.7	Very high	97.3	Very high	157 Å²	157	94.8 Å²	94.8	68%	0.683	46%	0.464	S	S	*	.	H	α-helix	trans	-61.4	-45.7	174.3	-70.8	178.7	-178.8	-178.8	0	112.1	E94 R95 K100 H101 Q102	E94-K98 WeakPolarHBondContact O-CG 3.49Å; E94-K98 PolarHBondContact O-N 2.87Å; R95-K98 PolarHBondContact O-N 3.4Å; K98-K100 PolarHBondContact O-N 3.48Å; K98-H101 PolarHBondContact O-N 3.36Å; K98-Q102 WeakPolarHBondContact O-CB 3.47Å; K98-Q102 PolarHBondContact O-N 3.01Å
99	Q	97.9	Very high	97.4	Very high	95 Å²	95	94.5 Å²	94.5	44%	0.444	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-41.5	177.5	-74.3	-178.8	-23.5	0	0	112.4	R95 L96 Q102 K103	R95-Q99 WeakPolarHBondContact O-CG 3.46Å; R95-Q99 PolarHBondContact O-N 2.78Å; L96-Q99 PolarHBondContact O-N 3.02Å; Q99-Q102 PolarHBondContact O-N 3.17Å; Q99-K103 WeakPolarHBondContact O-CB 3.4Å; Q99-K103 WeakPolarHBondContact O-CG 3.45Å; Q99-K103 PolarHBondContact O-N 3.39Å
100	K	98.3	Very high	97.5	Very high	142 Å²	142	98.4 Å²	98.4	62%	0.617	49%	0.489	S	S	*	.	H	α-helix	trans	-60.7	-47.7	175	-171.3	-171.1	75.7	165.5	0	111	L96 G97 K98 K103 L104	L96-K100 WeakPolarHBondContact O-CB 3.31Å; L96-K100 PolarHBondContact O-N 2.99Å; G97-K100 PolarHBondContact O-N 3.49Å; K98-K100 PolarHBondContact O-N 3.48Å; K100-K103 PolarHBondContact O-N 2.76Å; K100-L104 HydrophobicContact CG-CD1 4.09Å; K100-L104 WeakPolarHBondContact O-CG 3.19Å; K100-L104 PolarHBondContact O-N 2.93Å
101	H	98	Very high	97.5	Very high	138 Å²	138	99.2 Å²	99.2	64%	0.639	49%	0.491	S	S	*	.	H	α-helix	trans	-61.4	-45.6	179.1	-179.8	64.5	0	0	0	112	G97 K98 K103 L104 S105	G97-H101 PolarHBondContact O-N 3.05Å; K98-H101 PolarHBondContact O-N 3.36Å; H101-K103 PolarHBondContact O-N 3.29Å; H101-L104 PolarHBondContact O-N 3.44Å; H101-S105 PolarHBondContact O-N 3.27Å
102	Q	98	Very high	97.5	Very high	127 Å²	127	96.3 Å²	96.3	59%	0.593	48%	0.481	S	S	*	.	H	α-helix	trans	-57.9	-46.4	175.4	-176.3	178.9	14.5	0	0	112	K98 Q99 L104 S105 E106	K98-Q102 WeakPolarHBondContact O-CB 3.47Å; K98-Q102 PolarHBondContact O-N 3.01Å; Q99-Q102 PolarHBondContact O-N 3.17Å; Q102-L104 PolarHBondContact O-N 3.02Å; Q102-S105 PolarHBondContact O-N 3.39Å; Q102-E106 PolarHBondContact O-N 3.42Å
103	K	98	Very high	97.6	Very high	123 Å²	123	98.6 Å²	98.6	54%	0.535	49%	0.492	S	S	.	.	H	α-helix	trans	-67.2	-35.1	-179.7	-74.1	-73.7	162.3	-155.8	0	113.3	Q99 K100 H101 E106 A107	Q99-K103 WeakPolarHBondContact O-CB 3.4Å; Q99-K103 WeakPolarHBondContact O-CG 3.45Å; Q99-K103 PolarHBondContact O-N 3.39Å; K100-K103 PolarHBondContact O-N 2.76Å; H101-K103 PolarHBondContact O-N 3.29Å; K103-E106 IonicContact NZ-OE1 3.57Å; K103-E106 IonicContact NZ-OE2 3.84Å; K103-E106 PolarHBondContact NZ-OE2 3.43Å; K103-A107 WeakPolarHBondContact O-CB 3.25Å; K103-A107 PolarHBondContact O-N 2.72Å
104	L	98	Very high	97.6	Very high	105 Å²	105	97.4 Å²	97.4	55%	0.55	49%	0.49	S	S	.	.	H	α-helix	trans	-67.8	-41.9	174.5	-71.8	171.7	0	0	0	111.8	K100 H101 Q102 A107 E108	K100-L104 HydrophobicContact CG-CD1 4.09Å; K100-L104 WeakPolarHBondContact O-CG 3.19Å; K100-L104 PolarHBondContact O-N 2.93Å; H101-L104 PolarHBondContact O-N 3.44Å; Q102-L104 PolarHBondContact O-N 3.02Å; L104-A107 PolarHBondContact O-N 2.65Å; L104-E108 WeakPolarHBondContact O-CB 3.23Å; L104-E108 PolarHBondContact O-N 3.48Å
105	S	97	Very high	97.5	Very high	67 Å²	67	97.3 Å²	97.3	47%	0.469	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-39.9	176	175.7	0	0	0	0	112.5	H101 Q102 E108 S109	H101-S105 PolarHBondContact O-N 3.27Å; Q102-S105 PolarHBondContact O-N 3.39Å; S105-E108 PolarHBondContact O-N 2.95Å; S105-S109 WeakPolarHBondContact O-CB 3.4Å; S105-S109 PolarHBondContact O-N 2.8Å
106	E	97.8	Very high	97.5	Very high	90 Å²	90	93.2 Å²	93.2	42%	0.421	48%	0.475	S	S	.	.	H	α-helix	trans	-62.9	-43.2	173.5	-174.2	-177.6	179.1	0	0	111.5	Q102 K103 S109 L110	Q102-E106 PolarHBondContact O-N 3.42Å; K103-E106 IonicContact NZ-OE1 3.57Å; K103-E106 IonicContact NZ-OE2 3.84Å; K103-E106 PolarHBondContact NZ-OE2 3.43Å; E106-S109 PolarHBondContact O-N 3.34Å; E106-L110 HydrophobicContact CG-CD1 4.38Å; E106-L110 WeakPolarHBondContact O-CG 3.3Å; E106-L110 PolarHBondContact O-N 3.27Å
107	A	97.8	Very high	97.4	Very high	54 Å²	54	92.2 Å²	92.2	45%	0.446	47%	0.469	S	S	.	.	H	α-helix	trans	-64.5	-41.5	177.2	0	0	0	0	0	112.5	K103 L104 L110 E111	K103-A107 WeakPolarHBondContact O-CB 3.25Å; K103-A107 PolarHBondContact O-N 2.72Å; L104-A107 PolarHBondContact O-N 2.65Å; A107-L110 PolarHBondContact O-N 3.27Å; A107-E111 WeakPolarHBondContact O-CB 3.44Å; A107-E111 PolarHBondContact O-N 2.99Å
108	E	97.9	Very high	97.3	Very high	114 Å²	114	98.4 Å²	98.4	53%	0.533	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-44.6	175.4	-176.6	179.4	-175.8	0	0	111.4	L104 S105 L110 E111 K112	L104-E108 WeakPolarHBondContact O-CB 3.23Å; L104-E108 PolarHBondContact O-N 3.48Å; S105-E108 PolarHBondContact O-N 2.95Å; E108-L110 PolarHBondContact O-N 3Å; E108-E111 PolarHBondContact O-N 3.36Å; E108-K112 HydrophobicContact CG-CD 4.3Å; E108-K112 WeakPolarHBondContact O-CD 3.29Å; E108-K112 VanDerWaalsContact O-CG 3.28Å; E108-K112 WeakPolarHBondContact O-CG 3.3Å; E108-K112 PolarHBondContact O-N 3.16Å
109	S	96.9	Very high	97.2	Very high	56 Å²	56	95.3 Å²	95.3	39%	0.392	47%	0.471	S	S	.	.	H	α-helix	trans	-58.9	-46.6	174.9	-170.3	0	0	0	0	111.9	S105 E106 E111 K112 E113 L441	S105-S109 WeakPolarHBondContact O-CB 3.4Å; S105-S109 PolarHBondContact O-N 2.8Å; E106-S109 PolarHBondContact O-N 3.34Å; S109-E111 PolarHBondContact O-N 3.01Å; S109-K112 WeakPolarHBondContact O-CB 3.47Å; S109-K112 PolarHBondContact O-N 2.92Å; S109-E113 PolarHBondContact O-N 2.72Å; S109-L441 WeakPolarHBondContact O-CD1 3.4Å
110	L	97.9	Very high	97.1	Very high	91 Å²	91	93.5 Å²	93.5	48%	0.476	46%	0.464	S	S	.	.	H	α-helix	trans	-66.3	-37.2	178.5	-72.2	170.4	0	0	0	112.4	E106 A107 E108 K112 E113 V114	E106-L110 HydrophobicContact CG-CD1 4.38Å; E106-L110 WeakPolarHBondContact O-CG 3.3Å; E106-L110 PolarHBondContact O-N 3.27Å; A107-L110 PolarHBondContact O-N 3.27Å; E108-L110 PolarHBondContact O-N 3Å; L110-K112 VanDerWaalsContact C-N 3.32Å; L110-K112 PolarHBondContact O-N 2.72Å; L110-E113 WeakPolarHBondContact O-CB 3.41Å; L110-E113 PolarHBondContact O-N 3.17Å; L110-V114 WeakPolarHBondContact O-CG2 3.32Å; L110-V114 PolarHBondContact O-N 3.32Å
111	E	97.8	Very high	96.7	Very high	109 Å²	109	90.4 Å²	90.4	51%	0.509	46%	0.46	S	S	.	.	H	α-helix	trans	-62.9	-42.5	176.3	-172.1	-172.6	156.8	0	0	111.1	A107 E108 S109 E113 K115	A107-E111 WeakPolarHBondContact O-CB 3.44Å; A107-E111 PolarHBondContact O-N 2.99Å; E108-E111 PolarHBondContact O-N 3.36Å; S109-E111 PolarHBondContact O-N 3.01Å; E111-E113 VanDerWaalsContact C-N 3.33Å; E111-K115 WeakPolarHBondContact O-CG 3.17Å; E111-K115 PolarHBondContact O-N 3.39Å; E111-K115 VanDerWaalsContact O-N 3.14Å; E111-K115 VanDerWaalsContact OE1-CE 3.25Å; E111-K115 WeakPolarHBondContact OE1-CE 3.25Å; E111-K115 IonicContact OE1-NZ 3.91Å; E111-K115 PolarHBondContact OE1-NZ 3.41Å
112	K	96.7	Very high	96.5	Very high	71 Å²	71	88 Å²	88	31%	0.309	45%	0.451	S	S	.	.	H	α-helix	trans	-59.3	-46.8	172.2	-67.7	159.2	156.5	-124.7	0	110	E108 S109 L110 V114 K115 A116 L441	E108-K112 HydrophobicContact CG-CD 4.3Å; E108-K112 WeakPolarHBondContact O-CD 3.29Å; E108-K112 VanDerWaalsContact O-CG 3.28Å; E108-K112 WeakPolarHBondContact O-CG 3.3Å; E108-K112 PolarHBondContact O-N 3.16Å; S109-K112 WeakPolarHBondContact O-CB 3.47Å; S109-K112 PolarHBondContact O-N 2.92Å; L110-K112 VanDerWaalsContact C-N 3.32Å; L110-K112 PolarHBondContact O-N 2.72Å; K112-V114 VanDerWaalsContact C-N 3.33Å; K112-V114 PolarHBondContact O-N 3.27Å; K112-K115 WeakPolarHBondContact O-CA 3.48Å; K112-K115 WeakPolarHBondContact O-CB 3.05Å; K112-K115 PolarHBondContact O-N 2.98Å; K112-A116 PolarHBondContact O-N 2.88Å; K112-L441 HydrophobicContact CB-CB 3.44Å; K112-L441 VanDerWaalsContact CB-CB 3.44Å; K112-L441 HydrophobicContact CB-CD1 4.1Å; K112-L441 HydrophobicContact CB-CD2 3.98Å; K112-L441 HydrophobicContact CB-CG 3.96Å; K112-L441 HydrophobicContact CD-CB 4.15Å; K112-L441 WeakPolarHBondContact CD-O 3.44Å; K112-L441 WeakPolarHBondContact CE-O 3.28Å; K112-L441 HydrophobicContact CG-CB 4.32Å; K112-L441 VanDerWaalsContact CG-O 3.26Å; K112-L441 WeakPolarHBondContact CG-O 3.35Å; K112-L441 PolarHBondContact NZ-O 3.41Å; K112-L441 PolarHBondContact NZ-OXT 2.94Å; K112-L441 WeakPolarHBondContact O-CD2 3.46Å
113	E	96.6	Very high	96.2	Very high	70 Å²	70	85.8 Å²	85.8	33%	0.327	44%	0.443	S	S	.	.	H	α-helix	trans	-55.9	-48	-178.2	-163.3	177.6	165.3	0	0	112.1	S109 L110 E111 K115 A116 L117 I437 L441	S109-E113 PolarHBondContact O-N 2.72Å; L110-E113 WeakPolarHBondContact O-CB 3.41Å; L110-E113 PolarHBondContact O-N 3.17Å; E111-E113 VanDerWaalsContact C-N 3.33Å; E113-K115 VanDerWaalsContact C-N 3.3Å; E113-K115 PolarHBondContact O-N 2.99Å; E113-A116 PolarHBondContact O-N 3.01Å; E113-L117 HydrophobicContact CG-CD1 4.19Å; E113-L117 WeakPolarHBondContact O-CB 3.06Å; E113-L117 WeakPolarHBondContact O-CG 3.13Å; E113-L117 PolarHBondContact O-N 3.36Å; E113-I437 HydrophobicContact CG-CG2 4.11Å; E113-L441 VanDerWaalsContact CA-CD2 3.43Å; E113-L441 HydrophobicContact CB-CD1 3.41Å; E113-L441 VanDerWaalsContact CB-CD1 3.41Å; E113-L441 HydrophobicContact CB-CD2 4.45Å; E113-L441 HydrophobicContact CG-CD1 3.95Å; E113-L441 VanDerWaalsContact N-CD1 3.25Å
114	V	97.2	Very high	95.8	Very high	98 Å²	98	85.7 Å²	85.7	59%	0.594	44%	0.441	S	S	*	.	H	α-helix	trans	-60.9	-40.3	177.2	172.2	0	0	0	0	111.3	L110 K112 R118	L110-V114 WeakPolarHBondContact O-CG2 3.32Å; L110-V114 PolarHBondContact O-N 3.32Å; K112-V114 VanDerWaalsContact C-N 3.33Å; K112-V114 PolarHBondContact O-N 3.27Å; V114-R118 VanDerWaalsContact O-CB 3.32Å; V114-R118 WeakPolarHBondContact O-CB 3.42Å; V114-R118 PolarHBondContact O-N 3.24Å
115	K	96	Very high	95.4	Very high	114 Å²	114	85.6 Å²	85.6	50%	0.496	44%	0.437	S	S	.	.	H	α-helix	trans	-65	-45.6	176.3	-71.9	171.8	-174.6	166.8	0	111.6	E111 K112 E113 R118 I119	E111-K115 WeakPolarHBondContact O-CG 3.17Å; E111-K115 PolarHBondContact O-N 3.39Å; E111-K115 VanDerWaalsContact O-N 3.14Å; E111-K115 VanDerWaalsContact OE1-CE 3.25Å; E111-K115 WeakPolarHBondContact OE1-CE 3.25Å; E111-K115 IonicContact OE1-NZ 3.91Å; E111-K115 PolarHBondContact OE1-NZ 3.41Å; K112-K115 WeakPolarHBondContact O-CA 3.48Å; K112-K115 WeakPolarHBondContact O-CB 3.05Å; K112-K115 PolarHBondContact O-N 2.98Å; E113-K115 VanDerWaalsContact C-N 3.3Å; E113-K115 PolarHBondContact O-N 2.99Å; K115-R118 PolarHBondContact O-N 3.4Å; K115-I119 VanDerWaalsContact O-CG1 3.32Å; K115-I119 WeakPolarHBondContact O-CG1 3.45Å; K115-I119 PolarHBondContact O-N 3.14Å
116	A	96.5	Very high	94.9	Very high	11 Å²	11	88.6 Å²	88.6	9%	0.091	44%	0.442	C	S	.	.	H	α-helix	trans	-63.7	-44.7	178	0	0	0	0	0	112	K112 E113 R118 I119 L120 L440 L441	K112-A116 PolarHBondContact O-N 2.88Å; E113-A116 PolarHBondContact O-N 3.01Å; A116-R118 VanDerWaalsContact C-N 3.29Å; A116-R118 PolarHBondContact O-N 3.48Å; A116-I119 PolarHBondContact O-N 2.93Å; A116-L120 WeakPolarHBondContact O-CB 3.44Å; A116-L120 PolarHBondContact O-N 3.46Å; A116-L440 HydrophobicContact CB-CB 4.23Å; A116-L441 HydrophobicContact CB-CD2 3.29Å
117	L	96.6	Very high	94.5	Very high	69 Å²	69	89.6 Å²	89.6	36%	0.361	45%	0.449	S	S	.	.	H	α-helix	trans	-60.7	-39.1	174.3	-72.7	173.4	0	0	0	111.6	E113 L120 C121 I437	E113-L117 HydrophobicContact CG-CD1 4.19Å; E113-L117 WeakPolarHBondContact O-CB 3.06Å; E113-L117 WeakPolarHBondContact O-CG 3.13Å; E113-L117 PolarHBondContact O-N 3.36Å; L117-L120 PolarHBondContact O-N 3.28Å; L117-C121 WeakPolarHBondContact O-CB 3.26Å; L117-C121 PolarHBondContact O-N 2.97Å; L117-C121 PolarHBondContact O-SG 3.45Å; L117-I437 HydrophobicContact CD2-CD1 4.29Å
118	R	95	Very high	93.7	Very high	166 Å²	166	90.9 Å²	90.9	63%	0.626	45%	0.451	S	S	*	.	H	α-helix	trans	-64.2	-43.3	176.1	-171.5	66	-177.5	-178.3	5.4	111.8	V114 K115 A116 L120 C121 L122	V114-R118 VanDerWaalsContact O-CB 3.32Å; V114-R118 WeakPolarHBondContact O-CB 3.42Å; V114-R118 PolarHBondContact O-N 3.24Å; K115-R118 PolarHBondContact O-N 3.4Å; A116-R118 VanDerWaalsContact C-N 3.29Å; A116-R118 PolarHBondContact O-N 3.48Å; R118-L120 VanDerWaalsContact C-N 3.33Å; R118-C121 PolarHBondContact O-N 2.92Å; R118-L122 HydrophobicContact CG-CD1 4.43Å; R118-L122 VanDerWaalsContact O-CG 3.3Å; R118-L122 WeakPolarHBondContact O-CG 3.41Å; R118-L122 PolarHBondContact O-N 2.99Å
119	I	95.4	Very high	92.8	Very high	91 Å²	91	90 Å²	90	47%	0.467	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-44.4	174.5	-67.9	164.2	0	0	0	110.1	K115 A116 L122 N123	K115-I119 VanDerWaalsContact O-CG1 3.32Å; K115-I119 WeakPolarHBondContact O-CG1 3.45Å; K115-I119 PolarHBondContact O-N 3.14Å; A116-I119 PolarHBondContact O-N 2.93Å; I119-L122 PolarHBondContact O-N 2.8Å; I119-N123 WeakPolarHBondContact CG2-ND2 3.18Å; I119-N123 PolarHBondContact O-N 3.31Å; I119-N123 PolarHBondContact O-ND2 3.04Å
120	L	95.2	Very high	91.7	Very high	57 Å²	57	92.9 Å²	92.9	30%	0.298	46%	0.458	S	S	.	.	H	α-helix	trans	-61.9	-46.8	178.9	-174.3	63.3	0	0	0	111.8	A116 L117 R118 L122 N123 Y124	A116-L120 WeakPolarHBondContact O-CB 3.44Å; A116-L120 PolarHBondContact O-N 3.46Å; L117-L120 PolarHBondContact O-N 3.28Å; R118-L120 VanDerWaalsContact C-N 3.33Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-L122 PolarHBondContact O-N 3.21Å; L120-N123 PolarHBondContact O-N 2.94Å; L120-Y124 HydrophobicContact CD1-CD2 3.88Å; L120-Y124 HydrophobicContact CD1-CE2 3.41Å; L120-Y124 VanDerWaalsContact CD1-CE2 3.41Å; L120-Y124 HydrophobicContact CD2-CE2 4.06Å; L120-Y124 HydrophobicContact CG-CD2 3.77Å; L120-Y124 HydrophobicContact CG-CE2 3.55Å; L120-Y124 VanDerWaalsContact O-CD2 3.3Å; L120-Y124 WeakPolarHBondContact O-CD2 3.44Å; L120-Y124 PolarHBondContact O-N 3.11Å
121	C	91.4	Very high	90.1	Very high	77 Å²	77	91 Å²	91	52%	0.52	45%	0.452	S	S	.	.	H	α-helix	trans	-57.3	-46	175.2	-72.5	0	0	0	0	111.9	L117 R118 N123 Y124 E125	L117-C121 WeakPolarHBondContact O-CB 3.26Å; L117-C121 PolarHBondContact O-N 2.97Å; L117-C121 PolarHBondContact O-SG 3.45Å; R118-C121 PolarHBondContact O-N 2.92Å; C121-N123 VanDerWaalsContact C-N 3.32Å; C121-N123 PolarHBondContact O-N 2.68Å; C121-Y124 PolarHBondContact O-N 3.31Å; C121-E125 WeakPolarHBondContact O-CB 3.47Å; C121-E125 PolarHBondContact O-N 3.22Å
122	L	93.4	Very high	88.3	Confident	87 Å²	87	91.7 Å²	91.7	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-63.8	-37	177.6	-70.7	170.8	0	0	0	112.3	R118 I119 L120 K126	R118-L122 HydrophobicContact CG-CD1 4.43Å; R118-L122 VanDerWaalsContact O-CG 3.3Å; R118-L122 WeakPolarHBondContact O-CG 3.41Å; R118-L122 PolarHBondContact O-N 2.99Å; I119-L122 PolarHBondContact O-N 2.8Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-L122 PolarHBondContact O-N 3.21Å; L122-K126 WeakPolarHBondContact O-CB 3.44Å; L122-K126 PolarHBondContact O-N 3.33Å
123	N	90.8	Very high	86.3	Confident	81 Å²	81	95.1 Å²	95.1	43%	0.433	49%	0.488	S	S	.	.	H	α-helix	trans	-67.7	-44.9	175.9	-81.9	-73.6	0	0	0	111.8	I119 L120 C121 E125 K126 I127	I119-N123 WeakPolarHBondContact CG2-ND2 3.18Å; I119-N123 PolarHBondContact O-N 3.31Å; I119-N123 PolarHBondContact O-ND2 3.04Å; L120-N123 PolarHBondContact O-N 2.94Å; C121-N123 VanDerWaalsContact C-N 3.32Å; C121-N123 PolarHBondContact O-N 2.68Å; N123-E125 VanDerWaalsContact C-N 3.33Å; N123-E125 PolarHBondContact O-N 2.66Å; N123-K126 PolarHBondContact O-N 3.35Å; N123-I127 VanDerWaalsContact O-CG1 3.31Å; N123-I127 WeakPolarHBondContact O-CG1 3.44Å; N123-I127 PolarHBondContact O-N 2.83Å
124	Y	90.4	Very high	83.9	Confident	122 Å²	122	96.8 Å²	96.8	48%	0.478	49%	0.492	S	S	.	.	H	α-helix	trans	-62.1	-41.5	174.7	-81.8	-63.9	0	0	0	111.7	L120 C121 K126 I127 V128	L120-Y124 HydrophobicContact CD1-CD2 3.88Å; L120-Y124 HydrophobicContact CD1-CE2 3.41Å; L120-Y124 VanDerWaalsContact CD1-CE2 3.41Å; L120-Y124 HydrophobicContact CD2-CE2 4.06Å; L120-Y124 HydrophobicContact CG-CD2 3.77Å; L120-Y124 HydrophobicContact CG-CE2 3.55Å; L120-Y124 VanDerWaalsContact O-CD2 3.3Å; L120-Y124 WeakPolarHBondContact O-CD2 3.44Å; L120-Y124 PolarHBondContact O-N 3.11Å; C121-Y124 PolarHBondContact O-N 3.31Å; Y124-K126 VanDerWaalsContact C-N 3.32Å; Y124-K126 PolarHBondContact O-N 2.86Å; Y124-I127 PolarHBondContact O-N 3.44Å; Y124-V128 WeakPolarHBondContact O-CB 3.24Å; Y124-V128 WeakPolarHBondContact O-CG2 3.09Å; Y124-V128 PolarHBondContact O-N 2.97Å
125	E	88.4	Confident	81.4	Confident	102 Å²	102	101 Å²	101	48%	0.477	51%	0.505	S	S	.	.	H	α-helix	trans	-58.3	-45.2	174.9	-171.4	-178.2	172.8	0	0	111.2	C121 N123 V128 Q129	C121-E125 WeakPolarHBondContact O-CB 3.47Å; C121-E125 PolarHBondContact O-N 3.22Å; N123-E125 VanDerWaalsContact C-N 3.33Å; N123-E125 PolarHBondContact O-N 2.66Å; E125-V128 PolarHBondContact O-N 3.49Å; E125-Q129 WeakPolarHBondContact O-CB 3.26Å; E125-Q129 VanDerWaalsContact O-CG 3.25Å; E125-Q129 WeakPolarHBondContact O-CG 3.43Å; E125-Q129 PolarHBondContact O-N 2.89Å; E125-Q129 PolarHBondContact OE1-NE2 3.21Å
126	K	88.2	Confident	79	Confident	130 Å²	130	99.6 Å²	99.6	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-65.2	-38.7	176.2	-174.6	177.2	180	-177	0	113.1	L122 N123 Y124 N130	L122-K126 WeakPolarHBondContact O-CB 3.44Å; L122-K126 PolarHBondContact O-N 3.33Å; N123-K126 PolarHBondContact O-N 3.35Å; Y124-K126 VanDerWaalsContact C-N 3.32Å; Y124-K126 PolarHBondContact O-N 2.86Å; K126-N130 WeakPolarHBondContact CG-ND2 3.47Å; K126-N130 WeakPolarHBondContact O-CB 3.28Å; K126-N130 PolarHBondContact O-N 3.15Å; K126-N130 VanDerWaalsContact O-N 3.1Å; K126-N130 PolarHBondContact O-ND2 2.83Å
127	I	87.8	Confident	76.3	Confident	111 Å²	111	108.9 Å²	108.9	57%	0.569	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-43.4	176	-68.9	165.1	0	0	0	110.1	N123 Y124 N130 S131	N123-I127 VanDerWaalsContact O-CG1 3.31Å; N123-I127 WeakPolarHBondContact O-CG1 3.44Å; N123-I127 PolarHBondContact O-N 2.83Å; Y124-I127 PolarHBondContact O-N 3.44Å; I127-N130 PolarHBondContact O-N 3.41Å; I127-S131 PolarHBondContact O-N 3.07Å; I127-S131 VanDerWaalsContact O-N 3.11Å
128	V	81.3	Confident	73.7	Confident	81 Å²	81	110.5 Å²	110.5	49%	0.491	56%	0.558	S	S	.	*	H	α-helix	trans	-60.9	-47.2	176.6	169.7	0	0	0	0	110.2	Y124 E125 N130 S131 Y134	Y124-V128 WeakPolarHBondContact O-CB 3.24Å; Y124-V128 WeakPolarHBondContact O-CG2 3.09Å; Y124-V128 PolarHBondContact O-N 2.97Å; E125-V128 PolarHBondContact O-N 3.49Å; V128-N130 VanDerWaalsContact C-N 3.35Å; V128-N130 PolarHBondContact O-N 2.98Å; V128-S131 PolarHBondContact O-N 3.5Å; V128-Y134 HydrophobicContact CG1-CD2 3.73Å; V128-Y134 HydrophobicContact CG1-CE2 3.64Å; V128-Y134 VanDerWaalsContact O-CB 3.29Å; V128-Y134 WeakPolarHBondContact O-CB 3.4Å; V128-Y134 WeakPolarHBondContact O-CD2 3.15Å
129	Q	78.5	Confident	71.6	Confident	97 Å²	97	106.5 Å²	106.5	45%	0.453	55%	0.553	S	S	.	*	H	α-helix	trans	-63.9	-31.5	178.6	-72.8	174	9.4	0	0	114.3	E125 Y134	E125-Q129 WeakPolarHBondContact O-CB 3.26Å; E125-Q129 VanDerWaalsContact O-CG 3.25Å; E125-Q129 WeakPolarHBondContact O-CG 3.43Å; E125-Q129 PolarHBondContact O-N 2.89Å; E125-Q129 PolarHBondContact OE1-NE2 3.21Å; Q129-Y134 HydrophobicContact CG-CE1 4.4Å
130	N	74.3	Confident	69.6	Low	115 Å²	115	110.1 Å²	110.1	62%	0.615	57%	0.567	S	S	*	*	H	α-helix	trans	-93.8	-5.5	-178	-70	-50.9	0	0	0	114.3	K126 I127 V128	K126-N130 WeakPolarHBondContact CG-ND2 3.47Å; K126-N130 WeakPolarHBondContact O-CB 3.28Å; K126-N130 PolarHBondContact O-N 3.15Å; K126-N130 VanDerWaalsContact O-N 3.1Å; K126-N130 PolarHBondContact O-ND2 2.83Å; I127-N130 PolarHBondContact O-N 3.41Å; V128-N130 VanDerWaalsContact C-N 3.35Å; V128-N130 PolarHBondContact O-N 2.98Å
131	S	64.1	Low	68.2	Low	52 Å²	52	112.5 Å²	112.5	36%	0.364	59%	0.586	S	S	.	*	S	Bend	trans	-66.9	131.4	179.1	-173.7	0	0	0	0	109.6	I127 V128 N133 Y134	I127-S131 PolarHBondContact O-N 3.07Å; I127-S131 VanDerWaalsContact O-N 3.11Å; V128-S131 PolarHBondContact O-N 3.5Å; S131-N133 PolarHBondContact O-N 2.88Å; S131-Y134 WeakPolarHBondContact O-CA 3.22Å; S131-Y134 WeakPolarHBondContact O-CB 3.44Å; S131-Y134 PolarHBondContact O-N 2.79Å
132	P	61	Low	67	Low	123 Å²	123	111.9 Å²	111.9	80%	0.799	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-9.3	179.3	24	-32.5	0	0	0	113.8
133	N	53.6	Low	66.3	Low	144 Å²	144	111.2 Å²	111.2	77%	0.77	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	7.7	169.2	-65	-36.1	0	0	0	113.2	S131 E135 C136	S131-N133 PolarHBondContact O-N 2.88Å; N133-E135 PolarHBondContact O-N 3.42Å; N133-C136 PolarHBondContact O-N 2.78Å
134	Y	47.9	Very low	65.9	Low	104 Å²	104	112.5 Å²	112.5	41%	0.408	59%	0.585	S	S	.	*			trans	-80.8	22.1	173.6	-166	-102.2	0	0	0	112.5	V128 Q129 S131 C136	V128-Y134 HydrophobicContact CG1-CD2 3.73Å; V128-Y134 HydrophobicContact CG1-CE2 3.64Å; V128-Y134 VanDerWaalsContact O-CB 3.29Å; V128-Y134 WeakPolarHBondContact O-CB 3.4Å; V128-Y134 WeakPolarHBondContact O-CD2 3.15Å; Q129-Y134 HydrophobicContact CG-CE1 4.4Å; S131-Y134 WeakPolarHBondContact O-CA 3.22Å; S131-Y134 WeakPolarHBondContact O-CB 3.44Å; S131-Y134 PolarHBondContact O-N 2.79Å; Y134-C136 PolarHBondContact O-N 3Å
135	E	44	Very low	65.6	Low	187 Å²	187	113 Å²	113	87%	0.874	60%	0.596	S	S	*	*			trans	-77.2	28.4	148.8	-71.3	-169.8	171.9	0	0	111.5	N133 R137	N133-E135 PolarHBondContact O-N 3.42Å; E135-R137 PolarHBondContact O-N 3.02Å
136	C	44.5	Very low	65.5	Low	84 Å²	84	110 Å²	110	57%	0.568	58%	0.584	S	S	*	*	S	Bend	trans	-74.4	82	144.4	-161.6	0	0	0	0	105.8	N133 Y134 S138	N133-C136 PolarHBondContact O-N 2.78Å; Y134-C136 PolarHBondContact O-N 3Å; C136-S138 PolarHBondContact O-N 3.39Å
137	R	41.1	Very low	65.4	Low	206 Å²	206	107.9 Å²	107.9	78%	0.777	58%	0.575	S	S	*	*			trans	-7.5	123.4	160	172.5	-175.6	-80.1	-142.2	-2	109.4	E135 V139	E135-R137 PolarHBondContact O-N 3.02Å; R137-V139 WeakPolarHBondContact O-CA 3.46Å; R137-V139 WeakPolarHBondContact O-CG2 3.37Å; R137-V139 PolarHBondContact O-N 3.49Å
138	S	42	Very low	65.5	Low	103 Å²	103	108 Å²	108	72%	0.72	58%	0.577	S	S	*	*			trans	-36.4	95.1	164	53.6	0	0	0	0	108.2	C136 E140	C136-S138 PolarHBondContact O-N 3.39Å; S138-E140 PolarHBondContact O-N 3.32Å
139	V	50.5	Low	65.9	Low	83 Å²	83	107.5 Å²	107.5	50%	0.503	57%	0.569	S	S	.	*			trans	-76.8	93.8	-175.4	178.4	0	0	0	0	100	R137 I142	R137-V139 WeakPolarHBondContact O-CA 3.46Å; R137-V139 WeakPolarHBondContact O-CG2 3.37Å; R137-V139 PolarHBondContact O-N 3.49Å; V139-I142 HydrophobicContact CG1-CD1 4.29Å; V139-I142 HydrophobicContact CG1-CG1 3.75Å
140	E	54.3	Low	66.5	Low	166 Å²	166	103.7 Å²	103.7	78%	0.776	55%	0.552	S	S	*	*			trans	-34.1	117.1	156.8	-179.1	178.3	-166.4	0	0	105	S138 I142	S138-E140 PolarHBondContact O-N 3.32Å; E140-I142 PolarHBondContact O-N 2.92Å
141	P	63.9	Low	67.3	Low	107 Å²	107	103.6 Å²	103.6	70%	0.695	55%	0.547	S	S	*	.			trans	-49.3	115.5	-167.1	15.7	-28.9	0	0	0	106.6	P143	P141-P143 WeakPolarHBondContact O-CD 3.45Å
142	I	66.9	Low	68.7	Low	65 Å²	65	107 Å²	107	33%	0.333	55%	0.552	S	S	.	*			trans	-49.8	117	-177.6	-65.1	173.4	0	0	0	104.5	V139 E140 D144 T146 K147	V139-I142 HydrophobicContact CG1-CD1 4.29Å; V139-I142 HydrophobicContact CG1-CG1 3.75Å; E140-I142 PolarHBondContact O-N 2.92Å; I142-D144 PolarHBondContact O-N 3.45Å; I142-T146 HydrophobicContact CG2-CG2 3.75Å; I142-K147 HydrophobicContact CB-CG 4.3Å; I142-K147 HydrophobicContact CG2-CG 3.89Å; I142-K147 WeakPolarHBondContact O-CE 3.33Å; I142-K147 PolarHBondContact O-NZ 3.44Å
143	P	79.5	Confident	70.1	Confident	73 Å²	73	102.3 Å²	102.3	47%	0.474	52%	0.52	S	S	.	.			trans	-55.6	140.9	-172.3	14.2	-24.5	0	0	0	107.7	P141 D145 T146 K147	P141-P143 WeakPolarHBondContact O-CD 3.45Å; P143-D145 PolarHBondContact O-N 3.38Å; P143-T146 WeakPolarHBondContact O-CB 3.12Å; P143-T146 PolarHBondContact O-N 3.5Å; P143-K147 PolarHBondContact O-N 2.82Å
144	D	81.1	Confident	72	Confident	108 Å²	108	96.3 Å²	96.3	58%	0.578	49%	0.487	S	S	*	.	H	α-helix	trans	-57.6	-27.9	-174.1	-70.8	-25.7	0	0	0	111.1	I142 T146 K147 L148	I142-D144 PolarHBondContact O-N 3.45Å; D144-T146 PolarHBondContact O-N 3.5Å; D144-K147 PolarHBondContact O-N 2.78Å; D144-K147 IonicContact OD1-NZ 2.72Å; D144-K147 PolarHBondContact OD1-NZ 3.35Å; D144-L148 WeakPolarHBondContact O-CB 3.36Å; D144-L148 VanDerWaalsContact O-CG 3.23Å; D144-L148 WeakPolarHBondContact O-CG 3.37Å; D144-L148 PolarHBondContact O-N 2.8Å
145	D	85	Confident	74.1	Confident	131 Å²	131	97.3 Å²	97.3	70%	0.701	49%	0.494	S	S	*	.	H	α-helix	trans	-55.9	-44.6	170	-65.2	-23.2	0	0	0	113.2	P143 L148 E149	P143-D145 PolarHBondContact O-N 3.38Å; D145-L148 PolarHBondContact O-N 2.88Å; D145-E149 WeakPolarHBondContact O-CB 3.38Å; D145-E149 PolarHBondContact O-N 2.6Å
146	T	85.6	Confident	76.4	Confident	39 Å²	39	91.2 Å²	91.2	24%	0.239	47%	0.468	C	S	.	.	H	α-helix	trans	-69.9	-38.1	176.9	-56.9	0	0	0	0	111.2	I142 P143 D144 E149 V150 I202	I142-T146 HydrophobicContact CG2-CG2 3.75Å; P143-T146 WeakPolarHBondContact O-CB 3.12Å; P143-T146 PolarHBondContact O-N 3.5Å; D144-T146 PolarHBondContact O-N 3.5Å; T146-E149 PolarHBondContact O-N 2.99Å; T146-V150 VanDerWaalsContact O-CG2 3.3Å; T146-V150 WeakPolarHBondContact O-CG2 3.32Å; T146-V150 PolarHBondContact O-N 3.34Å; T146-I202 HydrophobicContact CG2-CG2 4.41Å
147	K	86.1	Confident	78.7	Confident	87 Å²	87	89.7 Å²	89.7	38%	0.378	46%	0.456	S	S	.	.	H	α-helix	trans	-62.6	-46.6	175	-62.2	179.7	-168	142.2	0	110.7	I142 P143 D144 E149 V150 F151	I142-K147 HydrophobicContact CB-CG 4.3Å; I142-K147 HydrophobicContact CG2-CG 3.89Å; I142-K147 WeakPolarHBondContact O-CE 3.33Å; I142-K147 PolarHBondContact O-NZ 3.44Å; P143-K147 PolarHBondContact O-N 2.82Å; D144-K147 PolarHBondContact O-N 2.78Å; D144-K147 IonicContact OD1-NZ 2.72Å; D144-K147 PolarHBondContact OD1-NZ 3.35Å; K147-E149 VanDerWaalsContact C-N 3.3Å; K147-E149 PolarHBondContact O-N 2.83Å; K147-V150 PolarHBondContact O-N 3.48Å; K147-F151 WeakPolarHBondContact O-CD2 3.14Å; K147-F151 PolarHBondContact O-N 2.68Å
148	L	90.3	Very high	81.1	Confident	114 Å²	114	80.8 Å²	80.8	60%	0.597	42%	0.423	S	S	*	.	H	α-helix	trans	-62.2	-38.4	177.4	-71.6	172	0	0	0	111.4	D144 D145 F151 R152	D144-L148 WeakPolarHBondContact O-CB 3.36Å; D144-L148 VanDerWaalsContact O-CG 3.23Å; D144-L148 WeakPolarHBondContact O-CG 3.37Å; D144-L148 PolarHBondContact O-N 2.8Å; D145-L148 PolarHBondContact O-N 2.88Å; L148-F151 PolarHBondContact O-N 2.65Å; L148-R152 VanDerWaalsContact O-CB 3.31Å; L148-R152 WeakPolarHBondContact O-CB 3.34Å; L148-R152 PolarHBondContact O-N 2.91Å
149	E	90.6	Very high	83.5	Confident	69 Å²	69	82 Å²	82	32%	0.322	42%	0.415	S	S	.	.	H	α-helix	trans	-66	-42	175.3	-176.3	59.5	-166.8	0	0	112.1	D145 T146 K147 F151 R152 V153 I202	D145-E149 WeakPolarHBondContact O-CB 3.38Å; D145-E149 PolarHBondContact O-N 2.6Å; T146-E149 PolarHBondContact O-N 2.99Å; K147-E149 VanDerWaalsContact C-N 3.3Å; K147-E149 PolarHBondContact O-N 2.83Å; E149-F151 PolarHBondContact O-N 2.9Å; E149-R152 PolarHBondContact O-N 3.01Å; E149-R152 IonicContact OE1-CZ 3.22Å; E149-R152 IonicContact OE1-NE 2.82Å; E149-R152 IonicContact OE1-NH2 3.88Å; E149-R152 PolarHBondContact OE1-NH2 3Å; E149-R152 IonicContact OE2-CZ 3.37Å; E149-R152 IonicContact OE2-NE 2.97Å; E149-R152 PolarHBondContact OE2-NE 3.5Å; E149-R152 IonicContact OE2-NH2 2.86Å; E149-R152 PolarHBondContact OE2-NH2 3.34Å; E149-V153 HydrophobicContact CG-CG2 4.38Å; E149-V153 WeakPolarHBondContact O-CG2 3.46Å; E149-V153 PolarHBondContact O-N 2.92Å; E149-V153 WeakPolarHBondContact OE1-CG2 3.25Å; E149-I202 HydrophobicContact CG-CD1 4.26Å
150	V	90.6	Very high	85.5	Confident	18 Å²	18	86 Å²	86	11%	0.109	42%	0.422	C	S	.	.	H	α-helix	trans	-57.7	-49.2	172.3	171.9	0	0	0	0	110.7	T146 K147 R152 F154 M195 V198 L199 I202	T146-V150 VanDerWaalsContact O-CG2 3.3Å; T146-V150 WeakPolarHBondContact O-CG2 3.32Å; T146-V150 PolarHBondContact O-N 3.34Å; K147-V150 PolarHBondContact O-N 3.48Å; V150-R152 VanDerWaalsContact C-N 3.34Å; V150-R152 PolarHBondContact O-N 3.09Å; V150-F154 VanDerWaalsContact O-CB 3.24Å; V150-F154 WeakPolarHBondContact O-CB 3.32Å; V150-F154 PolarHBondContact O-N 2.99Å; V150-M195 HydrophobicContact CG1-SD 3.9Å; V150-V198 HydrophobicContact CG1-CG1 4.27Å; V150-L199 HydrophobicContact CG1-CD2 3.84Å; V150-L199 HydrophobicContact CG2-CD2 3.95Å; V150-I202 VanDerWaalsContact CA-CD1 3.44Å; V150-I202 HydrophobicContact CB-CD1 4.05Å; V150-I202 HydrophobicContact CG2-CD1 3.56Å; V150-I202 HydrophobicContact CG2-CG2 4.49Å
151	F	91.1	Very high	87.3	Confident	113 Å²	113	79.9 Å²	79.9	50%	0.496	40%	0.398	S	S	.	.	H	α-helix	trans	-59.4	-45.4	176.5	-80.9	-66	0	0	0	111.8	K147 L148 E149 F154 F155	K147-F151 WeakPolarHBondContact O-CD2 3.14Å; K147-F151 PolarHBondContact O-N 2.68Å; L148-F151 PolarHBondContact O-N 2.65Å; E149-F151 PolarHBondContact O-N 2.9Å; F151-F154 PolarHBondContact O-N 2.86Å; F151-F155 HydrophobicContact CD1-CE2 4.1Å; F151-F155 WeakPolarHBondContact O-CB 3.5Å; F151-F155 VanDerWaalsContact O-CD2 3.26Å; F151-F155 WeakPolarHBondContact O-CD2 3.29Å; F151-F155 PolarHBondContact O-N 2.91Å
152	R	92.5	Very high	88.7	Confident	124 Å²	124	77.5 Å²	77.5	47%	0.468	38%	0.376	S	S	.	.	H	α-helix	trans	-60.4	-52.3	-179.9	-170.2	-171.1	71.2	82.4	-6.1	111.3	L148 E149 V150 F154 F155 D156	L148-R152 VanDerWaalsContact O-CB 3.31Å; L148-R152 WeakPolarHBondContact O-CB 3.34Å; L148-R152 PolarHBondContact O-N 2.91Å; E149-R152 PolarHBondContact O-N 3.01Å; E149-R152 IonicContact OE1-CZ 3.22Å; E149-R152 IonicContact OE1-NE 2.82Å; E149-R152 IonicContact OE1-NH2 3.88Å; E149-R152 PolarHBondContact OE1-NH2 3Å; E149-R152 IonicContact OE2-CZ 3.37Å; E149-R152 IonicContact OE2-NE 2.97Å; E149-R152 PolarHBondContact OE2-NE 3.5Å; E149-R152 IonicContact OE2-NH2 2.86Å; E149-R152 PolarHBondContact OE2-NH2 3.34Å; V150-R152 VanDerWaalsContact C-N 3.34Å; V150-R152 PolarHBondContact O-N 3.09Å; R152-F154 VanDerWaalsContact C-N 3.31Å; R152-F154 PolarHBondContact O-N 2.78Å; R152-F155 PolarHBondContact O-N 3.24Å; R152-D156 IonicContact CZ-OD2 3.17Å; R152-D156 IonicContact NH1-OD2 2.98Å; R152-D156 PolarHBondContact NH1-OD2 3Å; R152-D156 VanDerWaalsContact O-CB 3.24Å; R152-D156 WeakPolarHBondContact O-CB 3.39Å; R152-D156 VanDerWaalsContact O-CG 3.22Å; R152-D156 PolarHBondContact O-N 2.74Å
153	V	91.6	Very high	89.9	Confident	23 Å²	23	78.8 Å²	78.8	14%	0.139	38%	0.384	C	S	.	.	H	α-helix	trans	-63.8	-38.7	-179	177.3	0	0	0	0	111.1	E149 T157 V198 I202	E149-V153 HydrophobicContact CG-CG2 4.38Å; E149-V153 WeakPolarHBondContact O-CG2 3.46Å; E149-V153 PolarHBondContact O-N 2.92Å; E149-V153 WeakPolarHBondContact OE1-CG2 3.25Å; V153-T157 WeakPolarHBondContact O-CB 3.49Å; V153-T157 PolarHBondContact O-N 3.5Å; V153-T157 PolarHBondContact O-OG1 2.94Å; V153-V198 HydrophobicContact CB-CG1 3.89Å; V153-V198 HydrophobicContact CG1-CB 4.48Å; V153-V198 HydrophobicContact CG1-CG1 3.8Å; V153-V198 HydrophobicContact CG1-CG2 4.06Å; V153-I202 HydrophobicContact CB-CD1 4.18Å; V153-I202 HydrophobicContact CG2-CD1 4.09Å; V153-I202 HydrophobicContact CG2-CG1 4.5Å
154	F	93.3	Very high	90.4	Very high	18 Å²	18	82 Å²	82	8%	0.079	40%	0.397	C	S	.	.	H	α-helix	trans	-61.5	-52.6	175.5	-179.1	-93.9	0	0	0	111.8	V150 F151 R152 T157 M158 M191 L194 M195 V198	V150-F154 VanDerWaalsContact O-CB 3.24Å; V150-F154 WeakPolarHBondContact O-CB 3.32Å; V150-F154 PolarHBondContact O-N 2.99Å; F151-F154 PolarHBondContact O-N 2.86Å; R152-F154 VanDerWaalsContact C-N 3.31Å; R152-F154 PolarHBondContact O-N 2.78Å; F154-T157 PolarHBondContact O-N 3.24Å; F154-M158 HydrophobicContact CD1-CG 4.46Å; F154-M158 HydrophobicContact CE1-CG 4.11Å; F154-M158 HydrophobicContact CZ-CG 4.38Å; F154-M158 PolarHBondContact O-N 3.31Å; F154-M191 HydrophobicContact CZ-CB 4.5Å; F154-M191 HydrophobicContact CZ-CG 4.42Å; F154-L194 HydrophobicContact CD2-CD2 3.88Å; F154-L194 HydrophobicContact CD2-CG 3.83Å; F154-L194 HydrophobicContact CE2-CB 4.05Å; F154-L194 HydrophobicContact CE2-CD2 3.6Å; F154-L194 HydrophobicContact CE2-CG 3.72Å; F154-L194 HydrophobicContact CZ-CD2 4.13Å; F154-M195 HydrophobicContact CD1-CE 4.5Å; F154-M195 HydrophobicContact CD2-CB 4.33Å; F154-M195 HydrophobicContact CD2-CE 3.86Å; F154-M195 HydrophobicContact CD2-SD 3.95Å; F154-M195 HydrophobicContact CE2-CB 4.15Å; F154-M195 HydrophobicContact CE2-CE 4.06Å; F154-M195 HydrophobicContact CE2-SD 4.47Å; F154-M195 HydrophobicContact CG-CE 4.09Å; F154-M195 HydrophobicContact CG-SD 4.43Å; F154-M195 HydrophobicContact CZ-CE 4.47Å; F154-V198 HydrophobicContact CB-CG1 4.46Å; F154-V198 HydrophobicContact CB-CG2 4.4Å; F154-V198 HydrophobicContact CD2-CG2 4.46Å
155	F	92	Very high	90.8	Very high	125 Å²	125	79.9 Å²	79.9	55%	0.548	38%	0.381	S	S	.	.	H	α-helix	trans	-69	-35.9	179.9	-81.8	-69.1	0	0	0	113	F151 R152 T157 M158 F159	F151-F155 HydrophobicContact CD1-CE2 4.1Å; F151-F155 WeakPolarHBondContact O-CB 3.5Å; F151-F155 VanDerWaalsContact O-CD2 3.26Å; F151-F155 WeakPolarHBondContact O-CD2 3.29Å; F151-F155 PolarHBondContact O-N 2.91Å; R152-F155 PolarHBondContact O-N 3.24Å; F155-T157 VanDerWaalsContact C-N 3.27Å; F155-T157 PolarHBondContact O-N 3.37Å; F155-M158 PolarHBondContact O-N 3.03Å; F155-F159 VanDerWaalsContact O-CB 3.32Å; F155-F159 WeakPolarHBondContact O-CB 3.35Å; F155-F159 PolarHBondContact O-N 3.44Å
156	D	92.8	Very high	91	Very high	60 Å²	60	74.2 Å²	74.2	32%	0.321	35%	0.351	S	S	.	.	H	α-helix	trans	-61	-39.6	173.2	-79.2	-15.1	0	0	0	110.8	R152 F159 R160	R152-D156 IonicContact CZ-OD2 3.17Å; R152-D156 IonicContact NH1-OD2 2.98Å; R152-D156 PolarHBondContact NH1-OD2 3Å; R152-D156 VanDerWaalsContact O-CB 3.24Å; R152-D156 WeakPolarHBondContact O-CB 3.39Å; R152-D156 VanDerWaalsContact O-CG 3.22Å; R152-D156 PolarHBondContact O-N 2.74Å; D156-F159 PolarHBondContact O-N 3.37Å; D156-R160 WeakPolarHBondContact O-CB 3.32Å; D156-R160 VanDerWaalsContact O-CG 3.27Å; D156-R160 WeakPolarHBondContact O-CG 3.34Å; D156-R160 PolarHBondContact O-N 3.13Å
157	T	91.5	Very high	91	Very high	52 Å²	52	76 Å²	76	32%	0.319	36%	0.362	S	S	.	.	H	α-helix	trans	-68.6	-42.5	177	-53.2	0	0	0	0	111.4	V153 F154 F155 R160 S161 L194	V153-T157 WeakPolarHBondContact O-CB 3.49Å; V153-T157 PolarHBondContact O-N 3.5Å; V153-T157 PolarHBondContact O-OG1 2.94Å; F154-T157 PolarHBondContact O-N 3.24Å; F155-T157 VanDerWaalsContact C-N 3.27Å; F155-T157 PolarHBondContact O-N 3.37Å; T157-R160 PolarHBondContact O-N 3.02Å; T157-S161 PolarHBondContact O-N 3.32Å; T157-L194 HydrophobicContact CG2-CD1 3.49Å; T157-L194 VanDerWaalsContact CG2-CD1 3.49Å; T157-L194 HydrophobicContact CG2-CD2 4.46Å
158	M	92.2	Very high	91	Very high	18 Å²	18	78.8 Å²	78.8	9%	0.089	37%	0.374	C	S	.	.	H	α-helix	trans	-59.8	-45.9	172.6	-74.1	-66.7	-71.6	0	0	111.3	F154 F155 S161 F162 W181 M191 L194	F154-M158 HydrophobicContact CD1-CG 4.46Å; F154-M158 HydrophobicContact CE1-CG 4.11Å; F154-M158 HydrophobicContact CZ-CG 4.38Å; F154-M158 PolarHBondContact O-N 3.31Å; F155-M158 PolarHBondContact O-N 3.03Å; M158-S161 WeakPolarHBondContact O-CB 3.26Å; M158-S161 PolarHBondContact O-N 3Å; M158-S161 VanDerWaalsContact O-N 3.16Å; M158-S161 PolarHBondContact O-OG 3.33Å; M158-F162 PolarHBondContact O-N 3.43Å; M158-W181 HydrophobicContact CE-CH2 3.82Å; M158-W181 HydrophobicContact CE-CZ2 3.84Å; M158-W181 WeakPolarHBondContact O-CZ2 3.49Å; M158-M191 HydrophobicContact CE-CE 3.79Å; M158-L194 HydrophobicContact CG-CD2 3.74Å; M158-L194 HydrophobicContact SD-CD2 3.63Å
159	F	93.2	Very high	90.7	Very high	128 Å²	128	77.4 Å²	77.4	56%	0.561	37%	0.374	S	S	*	.	H	α-helix	trans	-65.1	-43	-179.8	-174.9	-97.5	0	0	0	112.1	F155 D156 S161 F162 D163	F155-F159 VanDerWaalsContact O-CB 3.32Å; F155-F159 WeakPolarHBondContact O-CB 3.35Å; F155-F159 PolarHBondContact O-N 3.44Å; D156-F159 PolarHBondContact O-N 3.37Å; F159-S161 VanDerWaalsContact C-N 3.26Å; F159-S161 PolarHBondContact O-N 3.39Å; F159-F162 WeakPolarHBondContact O-CA 3.48Å; F159-F162 WeakPolarHBondContact O-CB 3.27Å; F159-F162 PolarHBondContact O-N 3.46Å; F159-D163 HydrophobicContact CE1-CB 4.48Å; F159-D163 WeakPolarHBondContact O-CB 3.48Å; F159-D163 PolarHBondContact O-N 3.48Å
160	R	92.5	Very high	90.5	Very high	167 Å²	167	76.3 Å²	76.3	63%	0.63	37%	0.374	S	S	*	.	H	α-helix	trans	-60	-38.2	172.4	-74	174.3	-174.7	-179.2	3.2	112	D156 T157 F162 N164	D156-R160 WeakPolarHBondContact O-CB 3.32Å; D156-R160 VanDerWaalsContact O-CG 3.27Å; D156-R160 WeakPolarHBondContact O-CG 3.34Å; D156-R160 PolarHBondContact O-N 3.13Å; T157-R160 PolarHBondContact O-N 3.02Å; R160-F162 VanDerWaalsContact C-N 3.27Å; R160-F162 PolarHBondContact O-N 2.94Å; R160-N164 WeakPolarHBondContact O-CB 3.24Å; R160-N164 PolarHBondContact O-N 2.84Å; R160-N164 VanDerWaalsContact O-N 3.15Å; R160-N164 PolarHBondContact O-ND2 2.97Å
161	S	91.8	Very high	90.5	Very high	39 Å²	39	83.5 Å²	83.5	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-65.9	-34.4	175.9	84.2	0	0	0	0	111.8	T157 M158 F159 Y165 W181	T157-S161 PolarHBondContact O-N 3.32Å; M158-S161 WeakPolarHBondContact O-CB 3.26Å; M158-S161 PolarHBondContact O-N 3Å; M158-S161 VanDerWaalsContact O-N 3.16Å; M158-S161 PolarHBondContact O-OG 3.33Å; F159-S161 VanDerWaalsContact C-N 3.26Å; F159-S161 PolarHBondContact O-N 3.39Å; S161-Y165 WeakPolarHBondContact O-CB 3.48Å; S161-Y165 PolarHBondContact O-N 2.99Å; S161-W181 PolarHBondContact O-NE1 2.95Å; S161-W181 WeakPolarHBondContact OG-CZ2 3.46Å; S161-W181 PolarHBondContact OG-NE1 2.99Å
162	F	92.7	Very high	90.4	Very high	57 Å²	57	82.9 Å²	82.9	25%	0.25	41%	0.41	C	S	.	.	H	α-helix	trans	-68.8	-54	174.9	177	-94.2	0	0	0	110.6	M158 F159 R160 N164 Y165 I166 V178 W181	M158-F162 PolarHBondContact O-N 3.43Å; F159-F162 WeakPolarHBondContact O-CA 3.48Å; F159-F162 WeakPolarHBondContact O-CB 3.27Å; F159-F162 PolarHBondContact O-N 3.46Å; R160-F162 VanDerWaalsContact C-N 3.27Å; R160-F162 PolarHBondContact O-N 2.94Å; F162-N164 VanDerWaalsContact C-N 3.26Å; F162-N164 PolarHBondContact O-N 3.3Å; F162-Y165 PolarHBondContact O-N 3.44Å; F162-I166 HydrophobicContact CD1-CG1 3.94Å; F162-I166 HydrophobicContact CD2-CD1 3.94Å; F162-I166 HydrophobicContact CD2-CG1 3.74Å; F162-I166 HydrophobicContact CE1-CG1 3.7Å; F162-I166 HydrophobicContact CE2-CD1 3.63Å; F162-I166 HydrophobicContact CE2-CG1 3.5Å; F162-I166 HydrophobicContact CG-CG1 3.97Å; F162-I166 HydrophobicContact CZ-CD1 4.06Å; F162-I166 HydrophobicContact CZ-CG1 3.49Å; F162-I166 VanDerWaalsContact CZ-CG1 3.49Å; F162-I166 WeakPolarHBondContact O-CG1 3.44Å; F162-I166 PolarHBondContact O-N 2.99Å; F162-V178 HydrophobicContact CE2-CG2 4.17Å; F162-V178 HydrophobicContact CZ-CG2 4.36Å; F162-W181 HydrophobicContact CB-CD2 4.26Å; F162-W181 HydrophobicContact CB-CH2 4.22Å; F162-W181 HydrophobicContact CB-CZ2 3.76Å; F162-W181 AromaticContact CD2-CD2 3.79Å; F162-W181 HydrophobicContact CD2-CD2 3.79Å; F162-W181 AromaticContact CD2-CE3 3.66Å; F162-W181 HydrophobicContact CD2-CE3 3.66Å; F162-W181 HydrophobicContact CD2-CG 4.34Å; F162-W181 HydrophobicContact CD2-CH2 4.29Å; F162-W181 HydrophobicContact CD2-CZ2 4.41Å; F162-W181 AromaticContact CD2-CZ3 3.92Å; F162-W181 HydrophobicContact CD2-CZ3 3.92Å; F162-W181 HydrophobicContact CE2-CE3 4.36Å
163	D	91.7	Very high	90.3	Very high	92 Å²	92	80.5 Å²	80.5	49%	0.492	41%	0.406	S	S	.	.	H	α-helix	trans	-57.7	-37.8	-175.9	-164.8	50.1	0	0	0	112.6	F159 Y165	F159-D163 HydrophobicContact CE1-CB 4.48Å; F159-D163 WeakPolarHBondContact O-CB 3.48Å; F159-D163 PolarHBondContact O-N 3.48Å; D163-Y165 VanDerWaalsContact C-N 3.34Å; D163-Y165 PolarHBondContact O-N 3.37Å
164	N	90.1	Very high	90.4	Very high	140 Å²	140	81.9 Å²	81.9	75%	0.749	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-18.3	176	-71.3	-53.1	0	0	0	114.3	R160 F162	R160-N164 WeakPolarHBondContact O-CB 3.24Å; R160-N164 PolarHBondContact O-N 2.84Å; R160-N164 VanDerWaalsContact O-N 3.15Å; R160-N164 PolarHBondContact O-ND2 2.97Å; F162-N164 VanDerWaalsContact C-N 3.26Å; F162-N164 PolarHBondContact O-N 3.3Å
165	Y	89.7	Confident	90.3	Very high	64 Å²	64	83 Å²	83	25%	0.251	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-29.7	-173.9	-163.9	-81.8	0	0	0	112.8	S161 F162 D163 S177 K180 W181 E184	S161-Y165 WeakPolarHBondContact O-CB 3.48Å; S161-Y165 PolarHBondContact O-N 2.99Å; F162-Y165 PolarHBondContact O-N 3.44Å; D163-Y165 VanDerWaalsContact C-N 3.34Å; D163-Y165 PolarHBondContact O-N 3.37Å; Y165-S177 WeakPolarHBondContact CE1-O 3.5Å; Y165-K180 HydrophobicContact CE1-CB 4.15Å; Y165-K180 HydrophobicContact CE1-CD 4.35Å; Y165-K180 HydrophobicContact CE1-CG 4.36Å; Y165-K180 WeakPolarHBondContact OH-CD 3.27Å; Y165-K180 WeakPolarHBondContact OH-CE 3.3Å; Y165-K180 WeakPolarHBondContact OH-CG 3.47Å; Y165-K180 PolarHBondContact OH-NZ 2.99Å; Y165-W181 HydrophobicContact CD1-CB 3.59Å; Y165-W181 HydrophobicContact CD1-CG 4.28Å; Y165-W181 HydrophobicContact CE1-CB 3.9Å; Y165-W181 HydrophobicContact CG-CB 4.15Å; Y165-W181 AromaticContact CG-CD1 3.82Å; Y165-W181 HydrophobicContact CG-CG 4.37Å; Y165-E184 WeakPolarHBondContact CE2-OE2 3.27Å; Y165-E184 PolarHBondContact OH-OE2 2.95Å
166	I	90	Very high	90.2	Very high	12 Å²	12	79.8 Å²	79.8	6%	0.062	42%	0.419	C	S	.	.			trans	-75.1	134.1	-175.5	-63.4	-45.8	0	0	0	111.6	F162 F168 L174 V178 W181	F162-I166 HydrophobicContact CD1-CG1 3.94Å; F162-I166 HydrophobicContact CD2-CD1 3.94Å; F162-I166 HydrophobicContact CD2-CG1 3.74Å; F162-I166 HydrophobicContact CE1-CG1 3.7Å; F162-I166 HydrophobicContact CE2-CD1 3.63Å; F162-I166 HydrophobicContact CE2-CG1 3.5Å; F162-I166 HydrophobicContact CG-CG1 3.97Å; F162-I166 HydrophobicContact CZ-CD1 4.06Å; F162-I166 HydrophobicContact CZ-CG1 3.49Å; F162-I166 VanDerWaalsContact CZ-CG1 3.49Å; F162-I166 WeakPolarHBondContact O-CG1 3.44Å; F162-I166 PolarHBondContact O-N 2.99Å; I166-F168 HydrophobicContact CB-CE2 4.21Å; I166-F168 HydrophobicContact CB-CZ 4.21Å; I166-F168 HydrophobicContact CG2-CD1 4.27Å; I166-F168 HydrophobicContact CG2-CD2 4.23Å; I166-F168 HydrophobicContact CG2-CE1 3.82Å; I166-F168 HydrophobicContact CG2-CE2 3.78Å; I166-F168 HydrophobicContact CG2-CG 4.46Å; I166-F168 HydrophobicContact CG2-CZ 3.57Å; I166-L174 HydrophobicContact CG2-CD1 3.4Å; I166-V178 HydrophobicContact CD1-CB 4.23Å; I166-V178 HydrophobicContact CD1-CG2 3.58Å; I166-V178 HydrophobicContact CG1-CG2 4.37Å; I166-W181 HydrophobicContact CD1-CB 4.47Å
167	V	85	Confident	90.3	Very high	77 Å²	77	77.5 Å²	77.5	47%	0.467	41%	0.408	S	S	.	.			trans	-109.7	126	175.7	-176.7	0	0	0	0	109.3	S169 L174 S177	V167-S169 WeakPolarHBondContact CG1-OG 3.37Å; V167-L174 WeakPolarHBondContact O-CA 3.5Å; V167-S177 PolarHBondContact N-OG 3.17Å
168	F	86.3	Confident	90.3	Very high	145 Å²	145	76.9 Å²	76.9	64%	0.636	40%	0.404	S	S	*	.			trans	-99.8	22.3	-174.2	-63.5	-83.8	0	0	0	114.4	I166 L174	I166-F168 HydrophobicContact CB-CE2 4.21Å; I166-F168 HydrophobicContact CB-CZ 4.21Å; I166-F168 HydrophobicContact CG2-CD1 4.27Å; I166-F168 HydrophobicContact CG2-CD2 4.23Å; I166-F168 HydrophobicContact CG2-CE1 3.82Å; I166-F168 HydrophobicContact CG2-CE2 3.78Å; I166-F168 HydrophobicContact CG2-CG 4.46Å; I166-F168 HydrophobicContact CG2-CZ 3.57Å; F168-L174 HydrophobicContact CD1-CD1 4.21Å; F168-L174 HydrophobicContact CE1-CD1 4.2Å
169	S	83.9	Confident	90.3	Very high	84 Å²	84	80.6 Å²	80.6	59%	0.587	42%	0.423	S	S	*	.	S	Bend	trans	-72.9	-37.1	-173.7	47.1	0	0	0	0	114.5	V167 D173	V167-S169 WeakPolarHBondContact CG1-OG 3.37Å; S169-D173 VanDerWaalsContact OG-CB 3.3Å; S169-D173 WeakPolarHBondContact OG-CB 3.31Å; S169-D173 VanDerWaalsContact OG-CG 3.31Å; S169-D173 PolarHBondContact OG-OD2 3.49Å
170	S	86.8	Confident	90.2	Very high	47 Å²	47	79.7 Å²	79.7	33%	0.329	42%	0.419	S	S	.	.			trans	-154.6	163	178	75.2	0	0	0	0	110.1	T172 D173 L174	S170-T172 PolarHBondContact O-N 3.46Å; S170-T172 PolarHBondContact OG-N 2.85Å; S170-D173 WeakPolarHBondContact CB-OD2 3.37Å; S170-D173 PolarHBondContact O-N 3.36Å; S170-D173 PolarHBondContact OG-N 3.32Å; S170-D173 VanDerWaalsContact OG-N 3.09Å; S170-D173 PolarHBondContact OG-OD2 2.83Å; S170-L174 VanDerWaalsContact O-CB 3.31Å; S170-L174 WeakPolarHBondContact O-CB 3.49Å; S170-L174 PolarHBondContact O-N 2.92Å
171	F	89.2	Confident	90.4	Very high	168 Å²	168	73 Å²	73	74%	0.737	39%	0.394	S	S	*	.	H	α-helix	trans	-61.2	-35.1	175.5	-178	-101.5	0	0	0	112.3	S175	F171-S175 WeakPolarHBondContact O-CB 3.5Å; F171-S175 PolarHBondContact O-N 3.18Å; F171-S175 PolarHBondContact O-OG 3.29Å
172	T	90.3	Very high	90.5	Very high	100 Å²	100	75.3 Å²	75.3	61%	0.613	40%	0.402	S	S	*	.	H	α-helix	trans	-64.2	-45.7	175.7	-51.9	0	0	0	0	111.1	S170 S175 A176	S170-T172 PolarHBondContact O-N 3.46Å; S170-T172 PolarHBondContact OG-N 2.85Å; T172-S175 PolarHBondContact O-OG 3Å; T172-A176 VanDerWaalsContact O-CB 3.32Å; T172-A176 WeakPolarHBondContact O-CB 3.37Å; T172-A176 PolarHBondContact O-N 3.42Å
173	D	90.4	Very high	90.4	Very high	74 Å²	74	78.7 Å²	78.7	40%	0.396	42%	0.419	S	S	.	.	H	α-helix	trans	-70.5	-36.8	179.3	-57.4	-38.1	0	0	0	111.9	S169 S170 S177	S169-D173 VanDerWaalsContact OG-CB 3.3Å; S169-D173 WeakPolarHBondContact OG-CB 3.31Å; S169-D173 VanDerWaalsContact OG-CG 3.31Å; S169-D173 PolarHBondContact OG-OD2 3.49Å; S170-D173 WeakPolarHBondContact CB-OD2 3.37Å; S170-D173 PolarHBondContact O-N 3.36Å; S170-D173 PolarHBondContact OG-N 3.32Å; S170-D173 VanDerWaalsContact OG-N 3.09Å; S170-D173 PolarHBondContact OG-OD2 2.83Å; D173-S177 VanDerWaalsContact O-CB 3.27Å; D173-S177 WeakPolarHBondContact O-CB 3.23Å; D173-S177 PolarHBondContact O-N 3.23Å; D173-S177 PolarHBondContact O-OG 3.02Å
174	L	92.1	Very high	90.4	Very high	52 Å²	52	78.2 Å²	78.2	27%	0.272	41%	0.413	S	S	.	.	H	α-helix	trans	-61.6	-52.7	174.4	176	62	0	0	0	110.7	I166 V167 F168 S170 A176 S177 V178	I166-L174 HydrophobicContact CG2-CD1 3.4Å; V167-L174 WeakPolarHBondContact O-CA 3.5Å; F168-L174 HydrophobicContact CD1-CD1 4.21Å; F168-L174 HydrophobicContact CE1-CD1 4.2Å; S170-L174 VanDerWaalsContact O-CB 3.31Å; S170-L174 WeakPolarHBondContact O-CB 3.49Å; S170-L174 PolarHBondContact O-N 2.92Å; L174-A176 VanDerWaalsContact C-N 3.35Å; L174-A176 PolarHBondContact O-N 2.93Å; L174-S177 WeakPolarHBondContact CA-OG 3.32Å; L174-S177 PolarHBondContact O-N 3.44Å; L174-S177 PolarHBondContact O-OG 3.22Å; L174-V178 HydrophobicContact CD1-CG2 4.02Å; L174-V178 WeakPolarHBondContact O-CB 3.41Å; L174-V178 VanDerWaalsContact O-CG2 3.27Å; L174-V178 WeakPolarHBondContact O-CG2 3.27Å; L174-V178 PolarHBondContact O-N 2.99Å
175	S	91.3	Very high	90.3	Very high	43 Å²	43	71.9 Å²	71.9	30%	0.301	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-41.2	179.9	56.4	0	0	0	0	112.2	F171 T172 I179	F171-S175 WeakPolarHBondContact O-CB 3.5Å; F171-S175 PolarHBondContact O-N 3.18Å; F171-S175 PolarHBondContact O-OG 3.29Å; T172-S175 PolarHBondContact O-OG 3Å; S175-I179 VanDerWaalsContact O-CG1 3.29Å; S175-I179 WeakPolarHBondContact O-CG1 3.31Å; S175-I179 PolarHBondContact O-N 3.3Å; S175-I179 VanDerWaalsContact O-N 3.11Å
176	A	91.5	Very high	90.3	Very high	56 Å²	56	71.1 Å²	71.1	46%	0.463	38%	0.383	S	S	.	.	H	α-helix	trans	-64	-44	175.2	0	0	0	0	0	112.6	T172 L174 K180	T172-A176 VanDerWaalsContact O-CB 3.32Å; T172-A176 WeakPolarHBondContact O-CB 3.37Å; T172-A176 PolarHBondContact O-N 3.42Å; L174-A176 VanDerWaalsContact C-N 3.35Å; L174-A176 PolarHBondContact O-N 2.93Å; A176-K180 VanDerWaalsContact O-CB 3.25Å; A176-K180 WeakPolarHBondContact O-CB 3.49Å; A176-K180 PolarHBondContact O-N 2.94Å
177	S	93.3	Very high	90.3	Very high	12 Å²	12	76.2 Å²	76.2	8%	0.084	41%	0.405	C	S	.	.	H	α-helix	trans	-68.3	-38.3	179.4	55.9	0	0	0	0	112.7	Y165 V167 D173 L174 W181	Y165-S177 WeakPolarHBondContact CE1-O 3.5Å; V167-S177 PolarHBondContact N-OG 3.17Å; D173-S177 VanDerWaalsContact O-CB 3.27Å; D173-S177 WeakPolarHBondContact O-CB 3.23Å; D173-S177 PolarHBondContact O-N 3.23Å; D173-S177 PolarHBondContact O-OG 3.02Å; L174-S177 WeakPolarHBondContact CA-OG 3.32Å; L174-S177 PolarHBondContact O-N 3.44Å; L174-S177 PolarHBondContact O-OG 3.22Å; S177-W181 WeakPolarHBondContact O-CB 3.44Å; S177-W181 PolarHBondContact O-N 3.39Å
178	V	93.2	Very high	90.4	Very high	40 Å²	40	77.6 Å²	77.6	24%	0.242	42%	0.416	C	S	.	.	H	α-helix	trans	-63.7	-49.4	175	172.1	0	0	0	0	111.4	F162 I166 L174 K180 W181 I182	F162-V178 HydrophobicContact CE2-CG2 4.17Å; F162-V178 HydrophobicContact CZ-CG2 4.36Å; I166-V178 HydrophobicContact CD1-CB 4.23Å; I166-V178 HydrophobicContact CD1-CG2 3.58Å; I166-V178 HydrophobicContact CG1-CG2 4.37Å; L174-V178 HydrophobicContact CD1-CG2 4.02Å; L174-V178 WeakPolarHBondContact O-CB 3.41Å; L174-V178 VanDerWaalsContact O-CG2 3.27Å; L174-V178 WeakPolarHBondContact O-CG2 3.27Å; L174-V178 PolarHBondContact O-N 2.99Å; V178-K180 VanDerWaalsContact C-N 3.33Å; V178-K180 PolarHBondContact O-N 2.92Å; V178-W181 PolarHBondContact O-N 3.43Å; V178-I182 HydrophobicContact CG1-CD1 4.06Å; V178-I182 WeakPolarHBondContact O-CG1 3.33Å; V178-I182 PolarHBondContact O-N 3.18Å
179	I	91.8	Very high	90.5	Very high	96 Å²	96	78.6 Å²	78.6	49%	0.492	42%	0.422	S	S	.	.	H	α-helix	trans	-59.6	-47.8	179.3	-69.3	167.5	0	0	0	110	S175 W181 I182 E183	S175-I179 VanDerWaalsContact O-CG1 3.29Å; S175-I179 WeakPolarHBondContact O-CG1 3.31Å; S175-I179 PolarHBondContact O-N 3.3Å; S175-I179 VanDerWaalsContact O-N 3.11Å; I179-W181 VanDerWaalsContact C-N 3.33Å; I179-W181 PolarHBondContact O-N 3.1Å; I179-I182 PolarHBondContact O-N 2.91Å; I179-E183 HydrophobicContact CG2-CG 4.46Å; I179-E183 WeakPolarHBondContact O-CG 3.41Å; I179-E183 PolarHBondContact O-N 2.77Å
180	K	91.5	Very high	90.7	Very high	108 Å²	108	79.4 Å²	79.4	47%	0.47	42%	0.415	S	S	.	.	H	α-helix	trans	-62.3	-39.3	-179.8	-164.1	-173.5	170.6	-147.9	0	112.2	Y165 A176 V178 E183 E184	Y165-K180 HydrophobicContact CE1-CB 4.15Å; Y165-K180 HydrophobicContact CE1-CD 4.35Å; Y165-K180 HydrophobicContact CE1-CG 4.36Å; Y165-K180 WeakPolarHBondContact OH-CD 3.27Å; Y165-K180 WeakPolarHBondContact OH-CE 3.3Å; Y165-K180 WeakPolarHBondContact OH-CG 3.47Å; Y165-K180 PolarHBondContact OH-NZ 2.99Å; A176-K180 VanDerWaalsContact O-CB 3.25Å; A176-K180 WeakPolarHBondContact O-CB 3.49Å; A176-K180 PolarHBondContact O-N 2.94Å; V178-K180 VanDerWaalsContact C-N 3.33Å; V178-K180 PolarHBondContact O-N 2.92Å; K180-E183 PolarHBondContact O-N 3.45Å; K180-E184 WeakPolarHBondContact CE-OE1 3.4Å; K180-E184 IonicContact NZ-OE1 3.93Å; K180-E184 WeakPolarHBondContact O-CB 3.41Å; K180-E184 WeakPolarHBondContact O-CG 3.25Å; K180-E184 PolarHBondContact O-N 3.01Å
181	W	95.4	Very high	91	Very high	28 Å²	28	80.3 Å²	80.3	11%	0.106	42%	0.415	C	S	.	.	H	α-helix	trans	-62.6	-44.7	173.9	178.7	83.3	0	0	0	112.1	M158 S161 F162 Y165 I166 S177 V178 I179 E183 E184 S185	M158-W181 HydrophobicContact CE-CH2 3.82Å; M158-W181 HydrophobicContact CE-CZ2 3.84Å; M158-W181 WeakPolarHBondContact O-CZ2 3.49Å; S161-W181 PolarHBondContact O-NE1 2.95Å; S161-W181 WeakPolarHBondContact OG-CZ2 3.46Å; S161-W181 PolarHBondContact OG-NE1 2.99Å; F162-W181 HydrophobicContact CB-CD2 4.26Å; F162-W181 HydrophobicContact CB-CH2 4.22Å; F162-W181 HydrophobicContact CB-CZ2 3.76Å; F162-W181 AromaticContact CD2-CD2 3.79Å; F162-W181 HydrophobicContact CD2-CD2 3.79Å; F162-W181 AromaticContact CD2-CE3 3.66Å; F162-W181 HydrophobicContact CD2-CE3 3.66Å; F162-W181 HydrophobicContact CD2-CG 4.34Å; F162-W181 HydrophobicContact CD2-CH2 4.29Å; F162-W181 HydrophobicContact CD2-CZ2 4.41Å; F162-W181 AromaticContact CD2-CZ3 3.92Å; F162-W181 HydrophobicContact CD2-CZ3 3.92Å; F162-W181 HydrophobicContact CE2-CE3 4.36Å; Y165-W181 HydrophobicContact CD1-CB 3.59Å; Y165-W181 HydrophobicContact CD1-CG 4.28Å; Y165-W181 HydrophobicContact CE1-CB 3.9Å; Y165-W181 HydrophobicContact CG-CB 4.15Å; Y165-W181 AromaticContact CG-CD1 3.82Å; Y165-W181 HydrophobicContact CG-CG 4.37Å; I166-W181 HydrophobicContact CD1-CB 4.47Å; S177-W181 WeakPolarHBondContact O-CB 3.44Å; S177-W181 PolarHBondContact O-N 3.39Å; V178-W181 PolarHBondContact O-N 3.43Å; I179-W181 VanDerWaalsContact C-N 3.33Å; I179-W181 PolarHBondContact O-N 3.1Å; W181-E183 PolarHBondContact O-N 2.99Å; W181-E184 PolarHBondContact O-N 3.24Å; W181-S185 PolarHBondContact NE1-OG 3.4Å; W181-S185 WeakPolarHBondContact O-CA 3.41Å; W181-S185 WeakPolarHBondContact O-CB 3.46Å; W181-S185 PolarHBondContact O-N 3.36Å; W181-S185 PolarHBondContact O-OG 3.45Å
182	I	93.5	Very high	91	Very high	86 Å²	86	75.2 Å²	75.2	44%	0.441	40%	0.404	S	S	.	.	H	α-helix	trans	-60.4	-47.2	178	-67.5	171.8	0	0	0	110.2	V178 I179 E184 C186	V178-I182 HydrophobicContact CG1-CD1 4.06Å; V178-I182 WeakPolarHBondContact O-CG1 3.33Å; V178-I182 PolarHBondContact O-N 3.18Å; I179-I182 PolarHBondContact O-N 2.91Å; I182-E184 VanDerWaalsContact C-N 3.32Å; I182-E184 PolarHBondContact O-N 3.4Å; I182-C186 HydrophobicContact CG2-CB 4.43Å; I182-C186 VanDerWaalsContact O-CB 3.26Å; I182-C186 WeakPolarHBondContact O-CB 3.37Å; I182-C186 PolarHBondContact O-N 3.44Å
183	E	91.7	Very high	91.1	Very high	129 Å²	129	77.7 Å²	77.7	60%	0.603	41%	0.406	S	S	*	.	H	α-helix	trans	-65	-33	-178.9	-71.2	-175.9	169.2	0	0	113.1	I179 K180 W181 K187	I179-E183 HydrophobicContact CG2-CG 4.46Å; I179-E183 WeakPolarHBondContact O-CG 3.41Å; I179-E183 PolarHBondContact O-N 2.77Å; K180-E183 PolarHBondContact O-N 3.45Å; W181-E183 PolarHBondContact O-N 2.99Å; E183-K187 WeakPolarHBondContact O-CE 3.09Å; E183-K187 WeakPolarHBondContact O-CG 3.19Å
184	E	90.6	Very high	91.1	Very high	82 Å²	82	75.5 Å²	75.5	38%	0.383	40%	0.395	S	S	.	.	H	α-helix	trans	-92.4	-29.4	-178.9	-70.2	-179.7	172	0	0	114	Y165 K180 W181 I182 K190	Y165-E184 WeakPolarHBondContact CE2-OE2 3.27Å; Y165-E184 PolarHBondContact OH-OE2 2.95Å; K180-E184 WeakPolarHBondContact CE-OE1 3.4Å; K180-E184 IonicContact NZ-OE1 3.93Å; K180-E184 WeakPolarHBondContact O-CB 3.41Å; K180-E184 WeakPolarHBondContact O-CG 3.25Å; K180-E184 PolarHBondContact O-N 3.01Å; W181-E184 PolarHBondContact O-N 3.24Å; I182-E184 VanDerWaalsContact C-N 3.32Å; I182-E184 PolarHBondContact O-N 3.4Å; E184-K190 WeakPolarHBondContact O-CD 3.36Å; E184-K190 PolarHBondContact O-NZ 3.21Å
185	S	88.4	Confident	91	Very high	6 Å²	6	75.9 Å²	75.9	4%	0.042	40%	0.396	C	S	.	.	H	α-helix	trans	-102.4	-25.5	-172.7	-62.8	0	0	0	0	114.3	W181 K190	W181-S185 PolarHBondContact NE1-OG 3.4Å; W181-S185 WeakPolarHBondContact O-CA 3.41Å; W181-S185 WeakPolarHBondContact O-CB 3.46Å; W181-S185 PolarHBondContact O-N 3.36Å; W181-S185 PolarHBondContact O-OG 3.45Å; S185-K190 PolarHBondContact OG-NZ 3.25Å; S185-K190 VanDerWaalsContact OG-NZ 3.09Å
186	C	89.8	Confident	90.9	Very high	48 Å²	48	78.5 Å²	78.5	32%	0.324	41%	0.406	S	S	.	.	S	Bend	trans	-99.3	23.6	-177.9	-58.4	0	0	0	0	114	I182 M191	I182-C186 HydrophobicContact CG2-CB 4.43Å; I182-C186 VanDerWaalsContact O-CB 3.26Å; I182-C186 WeakPolarHBondContact O-CB 3.37Å; I182-C186 PolarHBondContact O-N 3.44Å; C186-M191 HydrophobicContact CB-CE 3.96Å
187	K	89.5	Confident	90.9	Very high	119 Å²	119	78.7 Å²	78.7	52%	0.517	41%	0.405	S	S	.	.			trans	-73.1	141.4	171.5	-65.2	-172.4	-178.7	-177.9	0	110.6	E183 E189 K190 M191	E183-K187 WeakPolarHBondContact O-CE 3.09Å; E183-K187 WeakPolarHBondContact O-CG 3.19Å; K187-E189 VanDerWaalsContact C-N 3.3Å; K187-E189 PolarHBondContact O-N 3.15Å; K187-K190 HydrophobicContact CB-CB 4.5Å; K187-K190 PolarHBondContact O-N 3Å; K187-K190 VanDerWaalsContact O-N 3.13Å; K187-M191 PolarHBondContact O-N 2.98Å
188	P	88.1	Confident	90.8	Very high	106 Å²	106	78.4 Å²	78.4	69%	0.688	40%	0.402	S	S	*	.	H	α-helix	trans	-59.2	-39	-175.4	22.5	-33.3	0	0	0	112.8	K190 M191 A192	P188-K190 PolarHBondContact O-N 3.42Å; P188-M191 PolarHBondContact O-N 2.77Å; P188-A192 WeakPolarHBondContact O-CB 3.37Å; P188-A192 PolarHBondContact O-N 3.28Å
189	E	89.2	Confident	90.6	Very high	166 Å²	166	79.2 Å²	79.2	78%	0.776	41%	0.405	S	S	*	.	H	α-helix	trans	-62.6	-43.7	178	-63.8	173.6	-176.9	0	0	112.2	K187 A192 F193	K187-E189 VanDerWaalsContact C-N 3.3Å; K187-E189 PolarHBondContact O-N 3.15Å; E189-A192 PolarHBondContact O-N 3.49Å; E189-F193 WeakPolarHBondContact O-CB 3.02Å; E189-F193 PolarHBondContact O-N 3.32Å
190	K	88.1	Confident	90.4	Very high	102 Å²	102	77.8 Å²	77.8	44%	0.443	40%	0.401	S	S	.	.	H	α-helix	trans	-70.5	-37.8	179.4	-169.7	176.5	176.4	-172.6	0	111.5	E184 S185 K187 P188 L194	E184-K190 WeakPolarHBondContact O-CD 3.36Å; E184-K190 PolarHBondContact O-NZ 3.21Å; S185-K190 PolarHBondContact OG-NZ 3.25Å; S185-K190 VanDerWaalsContact OG-NZ 3.09Å; K187-K190 HydrophobicContact CB-CB 4.5Å; K187-K190 PolarHBondContact O-N 3Å; K187-K190 VanDerWaalsContact O-N 3.13Å; P188-K190 PolarHBondContact O-N 3.42Å; K190-L194 WeakPolarHBondContact O-CB 3.31Å; K190-L194 PolarHBondContact O-N 3.5Å
191	M	91.1	Very high	90.3	Very high	65 Å²	65	76.3 Å²	76.3	32%	0.32	40%	0.398	S	S	.	.	H	α-helix	trans	-65.5	-41.4	173.9	-76.6	-175.6	154.4	0	0	112	F154 M158 C186 K187 P188 L194 M195	F154-M191 HydrophobicContact CZ-CB 4.5Å; F154-M191 HydrophobicContact CZ-CG 4.42Å; M158-M191 HydrophobicContact CE-CE 3.79Å; C186-M191 HydrophobicContact CB-CE 3.96Å; K187-M191 PolarHBondContact O-N 2.98Å; P188-M191 PolarHBondContact O-N 2.77Å; M191-L194 PolarHBondContact O-N 2.92Å; M191-M195 WeakPolarHBondContact O-CB 3.33Å; M191-M195 PolarHBondContact O-N 3.39Å
192	A	90.5	Very high	89.8	Confident	61 Å²	61	75.6 Å²	75.6	50%	0.504	40%	0.396	S	S	.	.	H	α-helix	trans	-62.6	-45.9	175.7	0	0	0	0	0	111.4	P188 E189 L194 M195 D196	P188-A192 WeakPolarHBondContact O-CB 3.37Å; P188-A192 PolarHBondContact O-N 3.28Å; E189-A192 PolarHBondContact O-N 3.49Å; A192-L194 PolarHBondContact O-N 3.22Å; A192-M195 PolarHBondContact O-N 2.96Å; A192-D196 WeakPolarHBondContact O-CB 3.42Å; A192-D196 PolarHBondContact O-N 2.93Å
193	F	91.3	Very high	89.2	Confident	152 Å²	152	76.2 Å²	76.2	67%	0.667	40%	0.396	S	S	*	.	H	α-helix	trans	-61.6	-42.1	175	-178.2	-95.4	0	0	0	112.5	E189 D196 S197	E189-F193 WeakPolarHBondContact O-CB 3.02Å; E189-F193 PolarHBondContact O-N 3.32Å; F193-D196 PolarHBondContact O-N 3.05Å; F193-S197 WeakPolarHBondContact O-CB 3.35Å; F193-S197 PolarHBondContact O-N 3.06Å
194	L	91.5	Very high	88.5	Confident	29 Å²	29	74.9 Å²	74.9	15%	0.152	39%	0.393	C	S	.	.	H	α-helix	trans	-62.6	-45	175.5	177.6	62.2	0	0	0	111	F154 T157 M158 K190 M191 A192 S197 V198	F154-L194 HydrophobicContact CD2-CD2 3.88Å; F154-L194 HydrophobicContact CD2-CG 3.83Å; F154-L194 HydrophobicContact CE2-CB 4.05Å; F154-L194 HydrophobicContact CE2-CD2 3.6Å; F154-L194 HydrophobicContact CE2-CG 3.72Å; F154-L194 HydrophobicContact CZ-CD2 4.13Å; T157-L194 HydrophobicContact CG2-CD1 3.49Å; T157-L194 VanDerWaalsContact CG2-CD1 3.49Å; T157-L194 HydrophobicContact CG2-CD2 4.46Å; M158-L194 HydrophobicContact CG-CD2 3.74Å; M158-L194 HydrophobicContact SD-CD2 3.63Å; K190-L194 WeakPolarHBondContact O-CB 3.31Å; K190-L194 PolarHBondContact O-N 3.5Å; M191-L194 PolarHBondContact O-N 2.92Å; A192-L194 PolarHBondContact O-N 3.22Å; L194-S197 PolarHBondContact O-N 3.25Å; L194-V198 HydrophobicContact CD1-CG2 4.22Å; L194-V198 HydrophobicContact CG-CG2 4.45Å; L194-V198 VanDerWaalsContact O-CG2 3.25Å; L194-V198 WeakPolarHBondContact O-CG2 3.38Å; L194-V198 PolarHBondContact O-N 3.3Å
195	M	90.2	Very high	87.2	Confident	59 Å²	59	76.7 Å²	76.7	29%	0.291	40%	0.401	S	S	.	.	H	α-helix	trans	-62.3	-44	178.4	-171	64.2	84.7	0	0	111.1	V150 F154 M191 A192 S197 V198 L199	V150-M195 HydrophobicContact CG1-SD 3.9Å; F154-M195 HydrophobicContact CD1-CE 4.5Å; F154-M195 HydrophobicContact CD2-CB 4.33Å; F154-M195 HydrophobicContact CD2-CE 3.86Å; F154-M195 HydrophobicContact CD2-SD 3.95Å; F154-M195 HydrophobicContact CE2-CB 4.15Å; F154-M195 HydrophobicContact CE2-CE 4.06Å; F154-M195 HydrophobicContact CE2-SD 4.47Å; F154-M195 HydrophobicContact CG-CE 4.09Å; F154-M195 HydrophobicContact CG-SD 4.43Å; F154-M195 HydrophobicContact CZ-CE 4.47Å; M191-M195 WeakPolarHBondContact O-CB 3.33Å; M191-M195 PolarHBondContact O-N 3.39Å; A192-M195 PolarHBondContact O-N 2.96Å; M195-S197 VanDerWaalsContact C-N 3.33Å; M195-S197 PolarHBondContact O-N 3.03Å; M195-V198 PolarHBondContact O-N 3.19Å; M195-L199 HydrophobicContact CG-CD1 4.05Å; M195-L199 HydrophobicContact CG-CG 4.34Å; M195-L199 WeakPolarHBondContact O-CB 3.29Å; M195-L199 VanDerWaalsContact O-CG 3.23Å; M195-L199 WeakPolarHBondContact O-CG 3.46Å; M195-L199 PolarHBondContact O-N 3.47Å
196	D	89.7	Confident	85.8	Confident	98 Å²	98	81.1 Å²	81.1	52%	0.524	43%	0.428	S	S	.	.	H	α-helix	trans	-60.2	-42.1	176.6	-171.4	61.6	0	0	0	112.3	A192 F193 L199 T200	A192-D196 WeakPolarHBondContact O-CB 3.42Å; A192-D196 PolarHBondContact O-N 2.93Å; F193-D196 PolarHBondContact O-N 3.05Å; D196-L199 PolarHBondContact O-N 3.47Å; D196-T200 VanDerWaalsContact O-CB 3.29Å; D196-T200 WeakPolarHBondContact O-CB 3.41Å; D196-T200 PolarHBondContact O-N 2.95Å; D196-T200 PolarHBondContact O-OG1 3.04Å
197	S	89.9	Confident	83.8	Confident	61 Å²	61	84 Å²	84	43%	0.427	44%	0.444	S	S	.	.	H	α-helix	trans	-63.5	-43.4	174.4	-177.8	0	0	0	0	112.5	F193 L194 M195 T200 N201	F193-S197 WeakPolarHBondContact O-CB 3.35Å; F193-S197 PolarHBondContact O-N 3.06Å; L194-S197 PolarHBondContact O-N 3.25Å; M195-S197 VanDerWaalsContact C-N 3.33Å; M195-S197 PolarHBondContact O-N 3.03Å; S197-T200 PolarHBondContact O-N 3.37Å; S197-N201 VanDerWaalsContact O-CB 3.3Å; S197-N201 WeakPolarHBondContact O-CB 3.49Å; S197-N201 PolarHBondContact O-N 3Å
198	V	91	Very high	81.5	Confident	5 Å²	5	86.9 Å²	86.9	3%	0.03	46%	0.46	C	S	.	.	H	α-helix	trans	-64.5	-46.3	177.6	170.4	0	0	0	0	111.2	V150 V153 F154 L194 M195 N201 I202	V150-V198 HydrophobicContact CG1-CG1 4.27Å; V153-V198 HydrophobicContact CB-CG1 3.89Å; V153-V198 HydrophobicContact CG1-CB 4.48Å; V153-V198 HydrophobicContact CG1-CG1 3.8Å; V153-V198 HydrophobicContact CG1-CG2 4.06Å; F154-V198 HydrophobicContact CB-CG1 4.46Å; F154-V198 HydrophobicContact CB-CG2 4.4Å; F154-V198 HydrophobicContact CD2-CG2 4.46Å; L194-V198 HydrophobicContact CD1-CG2 4.22Å; L194-V198 HydrophobicContact CG-CG2 4.45Å; L194-V198 VanDerWaalsContact O-CG2 3.25Å; L194-V198 WeakPolarHBondContact O-CG2 3.38Å; L194-V198 PolarHBondContact O-N 3.3Å; M195-V198 PolarHBondContact O-N 3.19Å; V198-N201 PolarHBondContact O-N 2.71Å; V198-I202 HydrophobicContact CG1-CD1 3.73Å; V198-I202 WeakPolarHBondContact O-CG1 3.45Å; V198-I202 PolarHBondContact O-N 3.47Å
199	L	89.8	Confident	79.1	Confident	58 Å²	58	89.9 Å²	89.9	30%	0.304	47%	0.466	S	S	.	.	H	α-helix	trans	-59.8	-50.5	176.3	-68.8	172	0	0	0	110.1	V150 M195 D196 N201 I202 F203	V150-L199 HydrophobicContact CG1-CD2 3.84Å; V150-L199 HydrophobicContact CG2-CD2 3.95Å; M195-L199 HydrophobicContact CG-CD1 4.05Å; M195-L199 HydrophobicContact CG-CG 4.34Å; M195-L199 WeakPolarHBondContact O-CB 3.29Å; M195-L199 VanDerWaalsContact O-CG 3.23Å; M195-L199 WeakPolarHBondContact O-CG 3.46Å; M195-L199 PolarHBondContact O-N 3.47Å; D196-L199 PolarHBondContact O-N 3.47Å; L199-N201 VanDerWaalsContact C-N 3.28Å; L199-N201 PolarHBondContact O-N 2.93Å; L199-I202 PolarHBondContact O-N 3.15Å; L199-F203 HydrophobicContact CB-CD2 4.13Å; L199-F203 HydrophobicContact CB-CE2 4.07Å; L199-F203 HydrophobicContact CD2-CE2 3.89Å; L199-F203 WeakPolarHBondContact O-CB 3.35Å; L199-F203 WeakPolarHBondContact O-CD2 3.35Å; L199-F203 PolarHBondContact O-N 2.83Å
200	T	88.7	Confident	76.6	Confident	65 Å²	65	87.3 Å²	87.3	40%	0.399	47%	0.467	S	S	.	.	H	α-helix	trans	-56.6	-42.4	177.3	-59.3	0	0	0	0	111.5	D196 S197 N204	D196-T200 VanDerWaalsContact O-CB 3.29Å; D196-T200 WeakPolarHBondContact O-CB 3.41Å; D196-T200 PolarHBondContact O-N 2.95Å; D196-T200 PolarHBondContact O-OG1 3.04Å; S197-T200 PolarHBondContact O-N 3.37Å; T200-N204 WeakPolarHBondContact CG2-ND2 3.43Å; T200-N204 WeakPolarHBondContact O-CB 3.33Å; T200-N204 PolarHBondContact O-N 3.44Å; T200-N204 PolarHBondContact O-ND2 3.32Å; T200-N204 VanDerWaalsContact O-ND2 3.16Å
201	N	88.5	Confident	73.9	Confident	78 Å²	78	87.2 Å²	87.2	42%	0.417	48%	0.479	S	S	.	.	H	α-helix	trans	-66.6	-42.8	179	-172.3	30.5	0	0	0	113	S197 V198 L199 Q205	S197-N201 VanDerWaalsContact O-CB 3.3Å; S197-N201 WeakPolarHBondContact O-CB 3.49Å; S197-N201 PolarHBondContact O-N 3Å; V198-N201 PolarHBondContact O-N 2.71Å; L199-N201 VanDerWaalsContact C-N 3.28Å; L199-N201 PolarHBondContact O-N 2.93Å; N201-Q205 VanDerWaalsContact CG-NE2 3.3Å; N201-Q205 PolarHBondContact ND2-NE2 2.85Å; N201-Q205 WeakPolarHBondContact O-CB 3.37Å; N201-Q205 VanDerWaalsContact O-CG 3.29Å; N201-Q205 WeakPolarHBondContact O-CG 3.49Å; N201-Q205 PolarHBondContact O-N 2.83Å; N201-Q205 VanDerWaalsContact O-N 3.07Å; N201-Q205 PolarHBondContact O-NE2 2.82Å; N201-Q205 VanDerWaalsContact O-NE2 3.1Å; N201-Q205 PolarHBondContact OD1-NE2 2.98Å
202	I	85.3	Confident	71.5	Confident	12 Å²	12	90.5 Å²	90.5	6%	0.062	50%	0.503	C	S	.	.	H	α-helix	trans	-70.7	-42.4	-179.7	-69.7	169	0	0	0	110.7	T146 E149 V150 V153 V198 L199 Q205 T206	T146-I202 HydrophobicContact CG2-CG2 4.41Å; E149-I202 HydrophobicContact CG-CD1 4.26Å; V150-I202 VanDerWaalsContact CA-CD1 3.44Å; V150-I202 HydrophobicContact CB-CD1 4.05Å; V150-I202 HydrophobicContact CG2-CD1 3.56Å; V150-I202 HydrophobicContact CG2-CG2 4.49Å; V153-I202 HydrophobicContact CB-CD1 4.18Å; V153-I202 HydrophobicContact CG2-CD1 4.09Å; V153-I202 HydrophobicContact CG2-CG1 4.5Å; V198-I202 HydrophobicContact CG1-CD1 3.73Å; V198-I202 WeakPolarHBondContact O-CG1 3.45Å; V198-I202 PolarHBondContact O-N 3.47Å; L199-I202 PolarHBondContact O-N 3.15Å; I202-Q205 PolarHBondContact O-N 3.43Å; I202-T206 PolarHBondContact O-N 3.17Å; I202-T206 VanDerWaalsContact O-N 3.16Å; I202-T206 PolarHBondContact O-OG1 3.35Å
203	F	79.7	Confident	69	Low	99 Å²	99	92.9 Å²	92.9	43%	0.434	52%	0.516	S	S	.	.	H	α-helix	trans	-70.2	-34.7	178.7	-70.3	-59.6	0	0	0	112.7	L199 T206 T207	L199-F203 HydrophobicContact CB-CD2 4.13Å; L199-F203 HydrophobicContact CB-CE2 4.07Å; L199-F203 HydrophobicContact CD2-CE2 3.89Å; L199-F203 WeakPolarHBondContact O-CB 3.35Å; L199-F203 WeakPolarHBondContact O-CD2 3.35Å; L199-F203 PolarHBondContact O-N 2.83Å; F203-T206 PolarHBondContact O-N 2.93Å; F203-T207 PolarHBondContact O-OG1 3.45Å; F203-T207 VanDerWaalsContact O-OG1 3.08Å
204	N	77.4	Confident	66.2	Low	102 Å²	102	91 Å²	91	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-40.4	174.2	-71.3	-16.7	0	0	0	112.1	T200 T206 T207	T200-N204 WeakPolarHBondContact CG2-ND2 3.43Å; T200-N204 WeakPolarHBondContact O-CB 3.33Å; T200-N204 PolarHBondContact O-N 3.44Å; T200-N204 PolarHBondContact O-ND2 3.32Å; T200-N204 VanDerWaalsContact O-ND2 3.16Å; N204-T206 PolarHBondContact O-N 3.08Å; N204-T207 PolarHBondContact O-N 2.88Å; N204-T207 VanDerWaalsContact O-N 3.11Å
205	Q	64.8	Low	63.7	Low	120 Å²	120	101.4 Å²	101.4	56%	0.561	56%	0.558	S	S	*	*	H	α-helix	trans	-64.1	-26.9	175.3	-77.7	176.5	85.9	0	0	113.1	N201 I202 T207	N201-Q205 VanDerWaalsContact CG-NE2 3.3Å; N201-Q205 PolarHBondContact ND2-NE2 2.85Å; N201-Q205 WeakPolarHBondContact O-CB 3.37Å; N201-Q205 VanDerWaalsContact O-CG 3.29Å; N201-Q205 WeakPolarHBondContact O-CG 3.49Å; N201-Q205 PolarHBondContact O-N 2.83Å; N201-Q205 VanDerWaalsContact O-N 3.07Å; N201-Q205 PolarHBondContact O-NE2 2.82Å; N201-Q205 VanDerWaalsContact O-NE2 3.1Å; N201-Q205 PolarHBondContact OD1-NE2 2.98Å; I202-Q205 PolarHBondContact O-N 3.43Å; Q205-T207 VanDerWaalsContact C-N 3.28Å; Q205-T207 PolarHBondContact O-N 3.29Å
206	T	57.1	Low	61	Low	99 Å²	99	108 Å²	108	61%	0.607	59%	0.586	S	S	*	*	H	α-helix	trans	-76	-17.1	177.5	-50.7	0	0	0	0	112.4	I202 F203 N204	I202-T206 PolarHBondContact O-N 3.17Å; I202-T206 VanDerWaalsContact O-N 3.16Å; I202-T206 PolarHBondContact O-OG1 3.35Å; F203-T206 PolarHBondContact O-N 2.93Å; N204-T206 PolarHBondContact O-N 3.08Å
207	T	48.5	Very low	58.4	Low	107 Å²	107	111.2 Å²	111.2	66%	0.656	60%	0.602	S	S	*	*	H	α-helix	trans	-89.7	-16.6	-174	-57.1	0	0	0	0	114.1	F203 N204 Q205	F203-T207 PolarHBondContact O-OG1 3.45Å; F203-T207 VanDerWaalsContact O-OG1 3.08Å; N204-T207 PolarHBondContact O-N 2.88Å; N204-T207 VanDerWaalsContact O-N 3.11Å; Q205-T207 VanDerWaalsContact C-N 3.28Å; Q205-T207 PolarHBondContact O-N 3.29Å
208	E	41.3	Very low	55.6	Low	181 Å²	181	116.1 Å²	116.1	85%	0.846	62%	0.618	S	S	*	*	S	Bend	trans	-103.9	8.7	-176.8	-70.7	-155.9	155.2	0	0	116.4
209	M	37.8	Very low	52.6	Low	168 Å²	168	121.9 Å²	121.9	83%	0.828	66%	0.657	S	S	*	*			trans	-120.4	10.5	-179.2	-69.6	-134.2	-62	0	0	116.7	S211	M209-S211 VanDerWaalsContact C-N 3.28Å; M209-S211 PolarHBondContact O-N 2.97Å; M209-S211 VanDerWaalsContact O-N 3.07Å
210	S	35.7	Very low	50.1	Low	113 Å²	113	126.1 Å²	126.1	79%	0.79	68%	0.68	S	S	*	*			trans	-86.2	60.2	174	74.2	0	0	0	0	112.6
211	S	33.2	Very low	47.4	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	70%	0.697	S	S	*	*			trans	-149	131.9	157.4	70.5	0	0	0	0	110.7	M209	M209-S211 VanDerWaalsContact C-N 3.28Å; M209-S211 PolarHBondContact O-N 2.97Å; M209-S211 VanDerWaalsContact O-N 3.07Å
212	V	40.2	Very low	44.9	Very low	134 Å²	134	130.8 Å²	130.8	81%	0.812	72%	0.716	S	S	*	*	S	Bend	trans	96	114.8	166.7	-167.4	0	0	0	0	117.5
213	S	37.2	Very low	42.6	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	75%	0.749	S	S	*	*			trans	96.2	84.8	153.2	-78.4	0	0	0	0	120.6
214	S	32.6	Very low	40.5	Very low	113 Å²	113	139.3 Å²	139.3	79%	0.79	77%	0.771	S	S	*	*			trans	-23.4	132	135.5	-49.8	0	0	0	0	115.7
215	R	39	Very low	38.5	Very low	246 Å²	246	143 Å²	143	93%	0.928	78%	0.779	S	S	*	*			trans	-165.6	88.3	134	-105.3	-174.3	-68.6	-174	3	111.8
216	K	32.7	Very low	37	Very low	199 Å²	199	143.7 Å²	143.7	87%	0.865	79%	0.791	S	S	*	*			trans	6.6	119.8	137.3	-163.4	178.7	-172.4	-172.9	0	116.6
217	L	36.2	Very low	36.1	Very low	165 Å²	165	144.9 Å²	144.9	86%	0.864	79%	0.794	S	S	*	*			trans	-156.4	89.6	147.4	-101	159.8	0	0	0	110.1
218	Q	30.2	Very low	35.3	Very low	164 Å²	164	145 Å²	145	77%	0.766	80%	0.797	S	S	*	*			trans	33.7	111.6	133.1	-138.2	152.7	7.7	0	0	119
219	C	29.1	Very low	35.2	Very low	126 Å²	126	141.6 Å²	141.6	85%	0.851	79%	0.794	S	S	*	*			trans	-134.2	128.2	154.8	-168.6	0	0	0	0	108.3
220	D	36.3	Very low	35.3	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	79%	0.792	S	S	*	*			trans	-71.2	137.8	-171	-73.4	-47.1	0	0	0	113.2
221	T	32.4	Very low	35.3	Very low	124 Å²	124	141.1 Å²	141.1	76%	0.761	79%	0.791	S	S	*	*			trans	-74.6	139.5	175	-54.1	0	0	0	0	111.5
222	S	35.5	Very low	35.5	Very low	117 Å²	117	143.6 Å²	143.6	82%	0.818	80%	0.796	S	S	*	*			trans	-141.4	118.4	152.1	-61.1	0	0	0	0	108.8
223	P	37.1	Very low	35.2	Very low	115 Å²	115	141.4 Å²	141.4	75%	0.747	79%	0.787	S	S	*	*			trans	-97.3	141.7	-175.5	35.4	-28.3	0	0	0	111.8
224	I	36.8	Very low	35.4	Very low	175 Å²	175	145 Å²	145	90%	0.897	79%	0.791	S	S	*	*			trans	-98.4	100.2	168.3	-61.9	178	0	0	0	109.1
225	Y	35.5	Very low	35.6	Very low	180 Å²	180	145.4 Å²	145.4	71%	0.706	79%	0.785	S	S	*	*			trans	28.9	101	139.2	-144.4	-98.6	0	0	0	119.3	D227	Y225-D227 HydrophobicContact CD1-CB 4.33Å; Y225-D227 HydrophobicContact CE1-CB 3.63Å; Y225-D227 WeakPolarHBondContact CE1-OD2 3.41Å; Y225-D227 VanDerWaalsContact CZ-OD2 3.31Å; Y225-D227 PolarHBondContact OH-OD2 3.49Å
226	T	33.3	Very low	35.6	Very low	134 Å²	134	144.3 Å²	144.3	82%	0.822	78%	0.781	S	S	*	*			trans	-97.2	134.7	145	24.8	0	0	0	0	108.5
227	D	37	Very low	35.6	Very low	125 Å²	125	139.4 Å²	139.4	67%	0.668	77%	0.771	S	S	*	*			trans	-121.6	130.1	160.4	-130.2	-17.5	0	0	0	109.7	Y225	Y225-D227 HydrophobicContact CD1-CB 4.33Å; Y225-D227 HydrophobicContact CE1-CB 3.63Å; Y225-D227 WeakPolarHBondContact CE1-OD2 3.41Å; Y225-D227 VanDerWaalsContact CZ-OD2 3.31Å; Y225-D227 PolarHBondContact OH-OD2 3.49Å
228	C	32.7	Very low	35.8	Very low	108 Å²	108	140.9 Å²	140.9	73%	0.73	77%	0.774	S	S	*	*			trans	-95.1	158	-179.3	-67.7	0	0	0	0	110.4
229	S	37.9	Very low	36.2	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	77%	0.768	S	S	*	*			trans	161.9	140.4	142.6	-78.9	0	0	0	0	109
230	T	40.2	Very low	36.5	Very low	127 Å²	127	139.5 Å²	139.5	78%	0.779	77%	0.768	S	S	*	*			cis	-169.7	156	-1	18.3	0	0	0	0	106.9
231	N	35.6	Very low	36.4	Very low	143 Å²	143	136 Å²	136	77%	0.765	77%	0.767	S	S	*	*			trans	-55.3	153.5	179.6	-52.4	-58.1	0	0	0	115.7
232	D	39	Very low	36.3	Very low	153 Å²	153	135.3 Å²	135.3	82%	0.818	77%	0.767	S	S	*	*				-167.2	108.2	119.8	-100.9	-34.3	0	0	0	114.3
233	S	34	Very low	36.4	Very low	88 Å²	88	137.8 Å²	137.8	62%	0.615	77%	0.77	S	S	*	*				45.4	136.7	114.8	-40.2	0	0	0	0	122.5
234	Q	41.1	Very low	36.3	Very low	186 Å²	186	140.6 Å²	140.6	87%	0.869	77%	0.773	S	S	*	*			trans	89.8	140.4	157.3	-68.4	174.9	-53.4	0	0	117.8
235	N	36.1	Very low	36.5	Very low	122 Å²	122	137.5 Å²	137.5	65%	0.652	76%	0.763	S	S	*	*			cis	176.2	138.2	-22.8	-134.6	-31.9	0	0	0	104.2
236	R	38.3	Very low	36.5	Very low	223 Å²	223	133.3 Å²	133.3	84%	0.842	76%	0.761	S	S	*	*			trans	60.6	145.9	147.1	-78.1	177.5	174.9	-156.9	-2.9	118.4
237	S	33.7	Very low	36.9	Very low	95 Å²	95	130.7 Å²	130.7	66%	0.664	75%	0.753	S	S	*	*			cis	171.8	137.4	0.9	41.6	0	0	0	0	105.4
238	E	39.6	Very low	37	Very low	197 Å²	197	133.3 Å²	133.3	92%	0.921	76%	0.761	S	S	*	*			trans	-175.7	95.8	153.3	-104.9	164.7	-150.7	0	0	106.3
239	S	38.4	Very low	37.3	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	77%	0.768	S	S	*	*				76.3	97.2	61	-171.1	0	0	0	0	114.5
240	I	35.6	Very low	37.1	Very low	167 Å²	167	136.9 Å²	136.9	86%	0.856	77%	0.773	S	S	*	*			trans	75.4	124.9	132.6	-57.9	171	0	0	0	117.9
241	G	34	Very low	36.9	Very low	72 Å²	72	138.7 Å²	138.7	74%	0.742	78%	0.777	S	S	*	*			trans	171	52.1	160.4	0	0	0	0	0	115.9
242	S	31.3	Very low	36.7	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	78%	0.78	S	S	*	*			trans	-54.3	151	167.6	-45.8	0	0	0	0	112.3
243	I	37.8	Very low	36.5	Very low	169 Å²	169	139.3 Å²	139.3	87%	0.867	77%	0.773	S	S	*	*			trans	-170.2	117	132.4	-85.6	141.2	0	0	0	108.8
244	H	34.5	Very low	36.4	Very low	174 Å²	174	141.2 Å²	141.2	81%	0.806	78%	0.776	S	S	*	*			trans	-95.2	147.7	158.1	-163.8	-103.8	0	0	0	106.3
245	P	41.2	Very low	36.3	Very low	109 Å²	109	138 Å²	138	71%	0.708	77%	0.772	S	S	*	*				-150.1	167.7	96.3	36.7	-16	0	0	0	111.9
246	S	35.7	Very low	36.3	Very low	93 Å²	93	139.5 Å²	139.5	65%	0.65	78%	0.779	S	S	*	*				175.3	148.3	50.1	-168.3	0	0	0	0	108.6
247	A	40.5	Very low	36.2	Very low	79 Å²	79	135.9 Å²	135.9	65%	0.653	78%	0.775	S	S	*	*			trans	47.4	140.3	143.4	0	0	0	0	0	120.1
248	E	39.4	Very low	36.3	Very low	179 Å²	179	134.8 Å²	134.8	84%	0.836	78%	0.779	S	S	*	*			cis	-179.5	132.9	18.6	-115.1	171.2	-168.7	0	0	105.7
249	S	38.8	Very low	36.1	Very low	126 Å²	126	133.6 Å²	133.6	88%	0.881	77%	0.773	S	S	*	*			trans	158.8	117.9	137.5	-82	0	0	0	0	112
250	L	33.5	Very low	35.7	Very low	168 Å²	168	134.4 Å²	134.4	88%	0.88	78%	0.778	S	S	*	*			trans	-74.1	174.1	171.4	-69.4	166.5	0	0	0	111.5
251	L	36.4	Very low	35.5	Very low	165 Å²	165	130.7 Å²	130.7	86%	0.864	77%	0.768	S	S	*	*			trans	106.1	90.1	175.7	-56.7	178	0	0	0	111.6
252	Q	32.6	Very low	35.4	Very low	177 Å²	177	132.9 Å²	132.9	83%	0.827	77%	0.766	S	S	*	*				69	133	72.7	-165.1	131.3	4.5	0	0	113.5
253	I	34.4	Very low	35.4	Very low	132 Å²	132	136.5 Å²	136.5	68%	0.677	76%	0.764	S	S	*	*			trans	90.6	106.8	159.5	-31.2	178.2	0	0	0	117.9
254	N	32.7	Very low	35	Very low	128 Å²	128	134.1 Å²	134.1	68%	0.684	76%	0.758	S	S	*	*				170	116.6	110.7	-86.3	-42.5	0	0	0	112.8	L256	N254-L256 HydrophobicContact CB-CD1 4.32Å
255	P	37.8	Very low	34.8	Very low	118 Å²	118	136.6 Å²	136.6	77%	0.766	76%	0.761	S	S	*	*			trans	-90	119.4	146.2	31.8	-20.9	0	0	0	108.4	I257	P255-I257 PolarHBondContact O-N 2.87Å
256	L	35.9	Very low	34.2	Very low	155 Å²	155	136.4 Å²	136.4	81%	0.812	76%	0.763	S	S	*	*			trans	-86.2	115	-179.9	-127.2	82.8	0	0	0	111.1	N254	N254-L256 HydrophobicContact CB-CD1 4.32Å
257	I	36.3	Very low	34	Very low	147 Å²	147	136.2 Å²	136.2	75%	0.754	76%	0.761	S	S	*	*			trans	-72.4	130.1	160.3	-76.4	158.3	0	0	0	109.1	P255	P255-I257 PolarHBondContact O-N 2.87Å
258	G	36	Very low	33.7	Very low	72 Å²	72	138.8 Å²	138.8	74%	0.742	76%	0.764	S	S	*	*			trans	-116.5	99.9	154.8	0	0	0	0	0	108
259	Q	36	Very low	33.5	Very low	172 Å²	172	138.3 Å²	138.3	80%	0.804	77%	0.767	S	S	*	*				49.9	92.6	96.1	-60.4	-162.5	44.7	0	0	112.4
260	S	28.8	Very low	33	Very low	109 Å²	109	139.7 Å²	139.7	76%	0.762	76%	0.764	S	S	*	*				65.1	107.1	92.4	-168	0	0	0	0	114
261	S	32.3	Very low	33.2	Very low	90 Å²	90	141.2 Å²	141.2	63%	0.629	77%	0.767	S	S	*	*			trans	-144.1	92.6	151	-178.6	0	0	0	0	108.4	Y263	S261-Y263 WeakPolarHBondContact OG-CE2 3.35Å
262	V	32.6	Very low	32.8	Very low	117 Å²	117	138.9 Å²	138.9	71%	0.709	76%	0.76	S	S	*	*			trans	-86.3	118.4	167.1	-174.9	0	0	0	0	106.9	T264	V262-T264 HydrophobicContact CG1-CG2 4.3Å
263	Y	31.5	Very low	32.8	Very low	188 Å²	188	138.2 Å²	138.2	74%	0.737	76%	0.761	S	S	*	*			trans	-101.5	108.5	164.8	-76.7	-76.7	0	0	0	108.9	S261 Y265	S261-Y263 WeakPolarHBondContact OG-CE2 3.35Å; Y263-Y265 HydrophobicContact CD1-CE2 4.41Å
264	T	28.7	Very low	32.6	Very low	119 Å²	119	137.2 Å²	137.2	73%	0.73	76%	0.761	S	S	*	*			trans	-95.1	129.6	161	43.8	0	0	0	0	108.4	V262	V262-T264 HydrophobicContact CG1-CG2 4.3Å
265	Y	30.7	Very low	32.5	Very low	225 Å²	225	138.5 Å²	138.5	88%	0.882	77%	0.767	S	S	*	*			trans	-122.1	121.9	159.1	-86.6	-80.5	0	0	0	108.6	Y263	Y263-Y265 HydrophobicContact CD1-CE2 4.41Å
266	S	28.3	Very low	32.4	Very low	106 Å²	106	137.7 Å²	137.7	74%	0.741	77%	0.77	S	S	*	*			trans	-111.7	138.5	-178	-175.8	0	0	0	0	109.6
267	S	30.2	Very low	32.5	Very low	88 Å²	88	135.6 Å²	135.6	62%	0.615	77%	0.766	S	S	*	*			trans	71	117.2	147.5	-75.5	0	0	0	0	122.3
268	N	34.1	Very low	32.7	Very low	134 Å²	134	134.7 Å²	134.7	72%	0.717	77%	0.767	S	S	*	*				70	111.9	125	-52.8	-12.2	0	0	0	119.3
269	N	36.1	Very low	32.7	Very low	168 Å²	168	137.2 Å²	137.2	90%	0.898	77%	0.769	S	S	*	*				-175.2	127	111.9	-94.5	-42.4	0	0	0	112.2
270	L	29	Very low	32.7	Very low	156 Å²	156	135.3 Å²	135.3	82%	0.817	76%	0.764	S	S	*	*			trans	-64.3	142	161.1	-105.6	69	0	0	0	109.8
271	Q	37.1	Very low	33.3	Very low	200 Å²	200	135.8 Å²	135.8	94%	0.935	76%	0.757	S	S	*	*				-164.1	128	129.2	-106.8	170.2	46.3	0	0	112.5
272	T	28.1	Very low	33.6	Very low	116 Å²	116	137.2 Å²	137.2	71%	0.712	76%	0.757	S	S	*	*			trans	-66.4	158.3	177.3	-43	0	0	0	0	113.4
273	L	32.1	Very low	33.8	Very low	162 Å²	162	138.9 Å²	138.9	85%	0.848	76%	0.762	S	S	*	*			trans	149.2	145.9	140.8	-80	158.1	0	0	0	109
274	T	30.4	Very low	33.9	Very low	111 Å²	111	134.2 Å²	134.2	68%	0.681	76%	0.757	S	S	*	*			cis	-172.2	151.9	-26.2	-88.1	0	0	0	0	105.4
275	L	31.7	Very low	34.3	Very low	155 Å²	155	134.1 Å²	134.1	81%	0.812	76%	0.757	S	S	*	*			trans	-55.3	155.5	-174.8	-69.4	81.1	0	0	0	117.5
276	A	33.9	Very low	34.4	Very low	102 Å²	102	129.4 Å²	129.4	84%	0.843	75%	0.751	S	S	*	*			trans	-159.5	130	132.4	0	0	0	0	0	112.2
277	P	38.6	Very low	34.5	Very low	110 Å²	110	128.9 Å²	128.9	71%	0.714	75%	0.747	S	S	*	*			trans	-133.6	147	159.6	37	-22.9	0	0	0	113.5
278	T	40.1	Very low	34.8	Very low	128 Å²	128	130.6 Å²	130.6	79%	0.785	75%	0.754	S	S	*	*			trans	-158.8	118.9	157.7	48.4	0	0	0	0	111.6
279	T	36.6	Very low	34.7	Very low	126 Å²	126	131.3 Å²	131.3	77%	0.773	75%	0.753	S	S	*	*				47	146.6	127.4	71.8	0	0	0	0	119.5
280	N	36.2	Very low	34.6	Very low	131 Å²	131	131.1 Å²	131.1	70%	0.701	74%	0.744	S	S	*	*			cis	174.5	161.9	42.9	-155.1	-9.2	0	0	0	111.9
281	I	40.3	Very low	34.5	Very low	119 Å²	119	134.5 Å²	134.5	61%	0.61	75%	0.746	S	S	*	*			trans	84.8	98.3	146.5	-52.2	-164.3	0	0	0	122.7
282	N	38.6	Very low	34.4	Very low	121 Å²	121	130.5 Å²	130.5	65%	0.647	74%	0.735	S	S	*	*				71.7	139.4	110.4	-51.1	-13.2	0	0	0	125.2
283	N	38.1	Very low	34.6	Very low	152 Å²	152	133.6 Å²	133.6	81%	0.813	74%	0.742	S	S	*	*			trans	83.6	142.4	142.3	-66	-11.5	0	0	0	118.6
284	S	34.2	Very low	34.7	Very low	90 Å²	90	133.3 Å²	133.3	63%	0.629	74%	0.74	S	S	*	*			cis	-179.9	150.9	-10.8	-166.9	0	0	0	0	107.4
285	T	35.4	Very low	34.9	Very low	117 Å²	117	134.8 Å²	134.8	72%	0.718	74%	0.744	S	S	*	*			trans	57.9	115	143.9	34.5	0	0	0	0	121.1
286	V	34.1	Very low	35.1	Very low	126 Å²	126	132.1 Å²	132.1	76%	0.764	74%	0.736	S	S	*	*				98.1	110.9	79.1	159.3	0	0	0	0	113.6
287	S	30.6	Very low	35.8	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	74%	0.74	S	S	*	*			trans	69	138.1	130.7	-55	0	0	0	0	124.7
288	T	35.1	Very low	35.5	Very low	124 Å²	124	140.5 Å²	140.5	76%	0.761	74%	0.743	S	S	*	*			trans	88.8	109	133	34.8	0	0	0	0	121.3
289	E	31.6	Very low	35.4	Very low	150 Å²	150	139.4 Å²	139.4	70%	0.701	74%	0.738	S	S	*	*				70.7	137.3	121.4	-85.5	-162.2	165.1	0	0	122.6
290	K	34.3	Very low	35.2	Very low	163 Å²	163	139.9 Å²	139.9	71%	0.709	73%	0.734	S	S	*	*			trans	90.6	104.4	143.9	-82	168	-178	139	0	120
291	R	28.4	Very low	35.2	Very low	228 Å²	228	141.8 Å²	141.8	86%	0.86	74%	0.743	S	S	*	*				68.9	144.1	107.3	-160.3	178.1	-176.1	157.3	1.6	118.3
292	T	33.9	Very low	34.9	Very low	115 Å²	115	140.5 Å²	140.5	71%	0.706	74%	0.742	S	S	*	*			trans	103.3	98.2	156.1	-31.4	0	0	0	0	112.4
293	Q	32	Very low	34.6	Very low	182 Å²	182	143.8 Å²	143.8	85%	0.85	75%	0.753	S	S	*	*				49.9	127.9	88.7	-82.7	-140	61.8	0	0	114.6
294	L	34.6	Very low	34.6	Very low	155 Å²	155	140.3 Å²	140.3	81%	0.812	75%	0.753	S	S	*	*			trans	156.6	138.4	159.3	-87.7	160.7	0	0	0	105.7
295	N	34.4	Very low	34.5	Very low	142 Å²	142	143.2 Å²	143.2	76%	0.759	76%	0.762	S	S	*	*			cis	-169.1	162.9	0.6	-142	2.6	0	0	0	106.2
296	P	37.2	Very low	34.8	Very low	99 Å²	99	142.4 Å²	142.4	64%	0.643	76%	0.761	S	S	*	*			trans	-99.6	179.8	-170.4	39.7	-32.8	0	0	0	113.5
297	K	47.6	Very low	35.1	Very low	212 Å²	212	144.4 Å²	144.4	92%	0.922	76%	0.762	S	S	*	*			trans	-143.9	106.6	166.4	-129.6	168.5	-176.5	176.5	0	112.1
298	F	31.8	Very low	35.4	Very low	177 Å²	177	144 Å²	144	78%	0.776	76%	0.759	S	S	*	*			trans	-68.3	178.9	157	-89.1	-81.5	0	0	0	110.3
299	P	38.1	Very low	35.6	Very low	105 Å²	105	144.8 Å²	144.8	68%	0.682	76%	0.758	S	S	*	*			cis	-149.5	154.8	33.2	31.8	-4.3	0	0	0	118.9
300	I	33	Very low	36.1	Very low	135 Å²	135	146.8 Å²	146.8	69%	0.692	77%	0.765	S	S	*	*				70.3	118.7	106.7	-53.5	166	0	0	0	117.4	P302	I300-P302 HydrophobicContact CG2-CG 4.29Å
301	I	35.1	Very low	36	Very low	172 Å²	172	146.1 Å²	146.1	88%	0.882	77%	0.768	S	S	*	*			trans	-142.1	129	135.5	-58.8	-176.8	0	0	0	108.6
302	P	35.2	Very low	36.4	Very low	92 Å²	92	141 Å²	141	60%	0.597	76%	0.758	S	S	*	*			trans	-116.9	167.4	-179.9	40.8	-28.3	0	0	0	114.9	I300	I300-P302 HydrophobicContact CG2-CG 4.29Å
303	Q	32.6	Very low	36.4	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	76%	0.76	S	S	*	*			trans	73	134.3	146.8	-78.3	-176.8	8.2	0	0	122.5
304	G	36.9	Very low	36.4	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	75%	0.753	S	S	*	*			trans	-175.8	87.8	163.9	0	0	0	0	0	112.1
305	N	32.5	Very low	36.4	Very low	152 Å²	152	143 Å²	143	81%	0.813	76%	0.756	S	S	*	*			trans	-64.3	159.3	177.1	-88.4	-10.1	0	0	0	115
306	S	40.9	Very low	36.2	Very low	100 Å²	100	141.6 Å²	141.6	70%	0.699	76%	0.756	S	S	*	*			trans	148.6	142.5	138.3	-78.6	0	0	0	0	110.3
307	H	41.1	Very low	36.7	Very low	167 Å²	167	142.3 Å²	142.3	77%	0.773	76%	0.76	S	S	*	*			cis	-162.6	129.3	-5.2	-103.1	-67.9	0	0	0	104.5
308	S	37.8	Very low	36.7	Very low	85 Å²	85	136.9 Å²	136.9	59%	0.594	75%	0.747	S	S	*	*				66.1	110	102.8	-124.9	0	0	0	0	116.1
309	N	39.2	Very low	37.1	Very low	142 Å²	142	136.2 Å²	136.2	76%	0.759	75%	0.75	S	S	*	*				147.4	142.9	103	-78.2	-31.6	0	0	0	117
310	K	40.9	Very low	37.2	Very low	191 Å²	191	138.7 Å²	138.7	83%	0.83	76%	0.757	S	S	*	*			trans	93.6	96.7	161.9	-67.5	178.4	175.5	-179	0	116.5
311	L	33.2	Very low	37.7	Very low	150 Å²	150	137.3 Å²	137.3	79%	0.785	76%	0.757	S	S	*	*				57.6	122.4	72.1	-66	167.5	0	0	0	110.8
312	N	37	Very low	38.1	Very low	120 Å²	120	134.6 Å²	134.6	64%	0.642	75%	0.753	S	S	*	*				-172.2	138.1	51.8	-109.1	-16.3	0	0	0	109.1
313	I	33.2	Very low	38.2	Very low	145 Å²	145	134.6 Å²	134.6	74%	0.744	76%	0.761	S	S	*	*				66.5	131.9	99.2	-72.2	-178.4	0	0	0	112.5
314	V	32.9	Very low	38.8	Very low	116 Å²	116	130.5 Å²	130.5	70%	0.703	75%	0.751	S	S	*	*			cis	-175	161.7	8.2	133	0	0	0	0	106.9
315	R	34.5	Very low	38.9	Very low	234 Å²	234	133.7 Å²	133.7	88%	0.883	75%	0.749	S	S	*	*			trans	116.1	94.4	144.5	-125.2	164.9	-172.1	152.5	1.7	119.1
316	C	30.4	Very low	39.2	Very low	112 Å²	112	131.3 Å²	131.3	76%	0.757	75%	0.745	S	S	*	*			trans	-85.6	-170.1	140.8	-75.3	0	0	0	0	109.4
317	P	46.4	Very low	38.8	Very low	113 Å²	113	132.7 Å²	132.7	73%	0.734	75%	0.748	S	S	*	*				-128.1	-133.9	-57.3	36.5	-16.1	0	0	0	107.3
318	P	48.1	Very low	38.4	Very low	98 Å²	98	130.9 Å²	130.9	64%	0.636	75%	0.749	S	S	*	*			cis	-137.9	180	-22.7	31.6	-9.2	0	0	0	115
319	L	39.1	Very low	38.3	Very low	163 Å²	163	132.4 Å²	132.4	85%	0.853	76%	0.755	S	S	*	*				157.3	122.7	120.9	-94.1	127.1	0	0	0	114.4
320	L	41.2	Very low	37.9	Very low	157 Å²	157	134.8 Å²	134.8	82%	0.822	76%	0.762	S	S	*	*			trans	-74.6	-167.5	156.3	-113.9	87	0	0	0	109.9
321	P	43.1	Very low	37.6	Very low	106 Å²	106	131.5 Å²	131.5	69%	0.688	76%	0.76	S	S	*	*			cis	-134.5	-179.6	2.4	22.1	6.3	0	0	0	112.6
322	S	44	Very low	37.3	Very low	115 Å²	115	133.5 Å²	133.5	80%	0.804	77%	0.765	S	S	*	*				178.4	140.4	79.8	52.3	0	0	0	0	113.1
323	A	36.8	Very low	36.9	Very low	92 Å²	92	134.3 Å²	134.3	76%	0.76	77%	0.774	S	S	*	*			trans	-88.4	-158.1	169.1	0	0	0	0	0	110.7
324	P	46	Very low	36.9	Very low	104 Å²	104	132.7 Å²	132.7	68%	0.675	78%	0.776	S	S	*	*			cis	-141.9	-160.1	-5.9	33.6	-7.5	0	0	0	115.3
325	D	38.3	Very low	36.6	Very low	146 Å²	146	135.4 Å²	135.4	78%	0.781	78%	0.781	S	S	*	*			trans	97.5	132.3	162.3	-58.2	-13.9	0	0	0	116.7
326	S	38.8	Very low	36.4	Very low	102 Å²	102	131.1 Å²	131.1	71%	0.713	77%	0.774	S	S	*	*			cis	-164.1	138.3	4.5	-81.6	0	0	0	0	112
327	V	32.7	Very low	36.4	Very low	128 Å²	128	133.4 Å²	133.4	78%	0.776	78%	0.778	S	S	*	*			trans	35.4	122.5	136.2	-169.2	0	0	0	0	121.7
328	T	34	Very low	35.6	Very low	129 Å²	129	133.3 Å²	133.3	79%	0.791	78%	0.775	S	S	*	*				-174.6	104.1	117.9	-67.5	0	0	0	0	112.7
329	T	33.6	Very low	34.7	Very low	118 Å²	118	135.8 Å²	135.8	72%	0.724	78%	0.783	S	S	*	*			trans	26.4	115.5	134.3	-17.4	0	0	0	0	122.6
330	Q	31.4	Very low	34.2	Very low	192 Å²	192	136.9 Å²	136.9	90%	0.897	78%	0.782	S	S	*	*			trans	-159.3	135.4	135.2	-115.4	-164.7	1.1	0	0	111.5
331	P	34.4	Very low	33.8	Very low	122 Å²	122	136.1 Å²	136.1	79%	0.792	77%	0.774	S	S	*	*			trans	-96.8	131.6	179.4	35	-27.5	0	0	0	112.4
332	Q	27.3	Very low	33.2	Very low	191 Å²	191	140.1 Å²	140.1	89%	0.893	78%	0.783	S	S	*	*			trans	-98	118.1	160.4	-88.2	-165.4	-35.4	0	0	108.8
333	V	29.3	Very low	32.4	Very low	137 Å²	137	140.8 Å²	140.8	83%	0.83	79%	0.787	S	S	*	*			trans	-167.6	116.3	143.6	-178.7	0	0	0	0	109.8
334	S	32	Very low	32.1	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	78%	0.781	S	S	*	*			trans	175	87.4	144.8	56.2	0	0	0	0	107.2
335	H	28.1	Very low	31.7	Very low	173 Å²	173	142.8 Å²	142.8	80%	0.801	79%	0.788	S	S	*	*				43	119.4	94.8	-106.7	-80.2	0	0	0	116.3
336	I	28.5	Very low	31.3	Very low	144 Å²	144	141.5 Å²	141.5	74%	0.738	79%	0.788	S	S	*	*			trans	84.5	101.3	164.8	-46.7	158.4	0	0	0	114.1	V338	I336-V338 HydrophobicContact CG2-CG2 4.31Å
337	D	30.6	Very low	31.1	Very low	159 Å²	159	142.5 Å²	142.5	85%	0.85	80%	0.795	S	S	*	*				-148.6	143.7	127.6	-131.4	-22.2	0	0	0	113.3
338	V	30	Very low	31.4	Very low	111 Å²	111	145.6 Å²	145.6	67%	0.673	80%	0.798	S	S	*	*			trans	-97.9	119.4	-165	-164.5	0	0	0	0	106.8	I336	I336-V338 HydrophobicContact CG2-CG2 4.31Å
339	N	28.9	Very low	31.6	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	80%	0.803	S	S	*	*			trans	-170.1	123.9	160.1	-98.7	-46.9	0	0	0	108.6
340	F	29.6	Very low	31.7	Very low	187 Å²	187	148.8 Å²	148.8	82%	0.82	80%	0.804	S	S	*	*			trans	-172.4	130	130.5	-118.4	-110	0	0	0	110.2
341	Q	33.1	Very low	31.8	Very low	140 Å²	140	151.4 Å²	151.4	65%	0.654	81%	0.806	S	S	*	*			trans	85.2	69.1	153.1	-112.6	63.7	-1	0	0	120.7	C343	Q341-C343 PolarHBondContact O-N 3.36Å
342	Q	29.3	Very low	31.7	Very low	191 Å²	191	154.3 Å²	154.3	89%	0.893	81%	0.809	S	S	*	*				-6.4	110.5	118	-156	164.1	31.4	0	0	115.4
343	C	28.4	Very low	31.9	Very low	129 Å²	129	148.1 Å²	148.1	87%	0.872	80%	0.796	S	S	*	*			trans	-134.9	82.8	156.6	-158.5	0	0	0	0	108	Q341	Q341-C343 PolarHBondContact O-N 3.36Å
344	G	30.4	Very low	32.2	Very low	63 Å²	63	149.4 Å²	149.4	65%	0.649	80%	0.798	S	S	*	*			trans	-111.2	111.3	165.9	0	0	0	0	0	107.8
345	Q	36	Very low	32.2	Very low	174 Å²	174	151.8 Å²	151.8	81%	0.813	80%	0.802	S	S	*	*			trans	-122.8	124.5	165.2	-76.7	-72.9	-64.7	0	0	106.9
346	P	30.9	Very low	32.7	Very low	119 Å²	119	146.2 Å²	146.2	77%	0.773	79%	0.786	S	S	*	*			trans	-86	123.5	169.4	32.8	-25.5	0	0	0	108
347	S	35.2	Very low	33	Very low	124 Å²	124	148.9 Å²	148.9	87%	0.867	79%	0.793	S	S	*	*			trans	-118.7	112.4	162.6	-106.9	0	0	0	0	109.6
348	K	38.6	Very low	33.5	Very low	192 Å²	192	150.4 Å²	150.4	84%	0.835	79%	0.788	S	S	*	*			trans	-59.5	128.1	159	-63.4	169.7	177	179	0	107.3
349	D	37	Very low	33.7	Very low	169 Å²	169	150.5 Å²	150.5	90%	0.904	79%	0.785	S	S	*	*			trans	-155.2	126.8	131.6	-98.1	-28.8	0	0	0	110.2
350	I	35.9	Very low	34	Very low	146 Å²	146	152.3 Å²	152.3	75%	0.749	79%	0.786	S	S	*	*			trans	-80.5	126.7	-179.7	-68.5	160.7	0	0	0	107.3
351	R	33.2	Very low	34.3	Very low	246 Å²	246	149.6 Å²	149.6	93%	0.928	78%	0.78	S	S	*	*			trans	-138.7	105.5	136	-83.5	-170.5	79.7	-172.3	2.5	109.7
352	E	32.4	Very low	34.5	Very low	184 Å²	184	148.4 Å²	148.4	86%	0.86	79%	0.787	S	S	*	*			trans	-51.6	136.7	160.1	-170	169.2	-159.5	0	0	111.3
353	G	31.9	Very low	34.7	Very low	61 Å²	61	148 Å²	148	63%	0.629	79%	0.787	S	S	*	*			trans	123.3	88.1	170.1	0	0	0	0	0	113.3
354	D	36.1	Very low	35.1	Very low	163 Å²	163	148.1 Å²	148.1	87%	0.872	78%	0.778	S	S	*	*			trans	-160.6	92.4	136.3	-91.8	-24.7	0	0	0	109.1	A356	D354-A356 VanDerWaalsContact C-N 3.26Å; D354-A356 PolarHBondContact O-N 3.24Å
355	N	32.2	Very low	35.4	Very low	162 Å²	162	151 Å²	151	87%	0.866	79%	0.785	S	S	*	*			trans	-69.3	83.6	163.1	-70.2	-40.1	0	0	0	108.4	F357	N355-F357 PolarHBondContact O-N 3.29Å; N355-F357 VanDerWaalsContact O-N 3.15Å
356	A	38.9	Very low	35.7	Very low	56 Å²	56	152.1 Å²	152.1	46%	0.463	79%	0.787	S	S	.	*			trans	-84.1	85.4	168.4	0	0	0	0	0	109.4	D354 Y358	D354-A356 VanDerWaalsContact C-N 3.26Å; D354-A356 PolarHBondContact O-N 3.24Å; A356-Y358 HydrophobicContact CB-CD2 4.28Å; A356-Y358 HydrophobicContact CB-CE1 4.48Å; A356-Y358 HydrophobicContact CB-CE2 3.66Å; A356-Y358 WeakPolarHBondContact O-CD2 3.42Å; A356-Y358 PolarHBondContact O-N 2.94Å
357	F	35.1	Very low	36.1	Very low	201 Å²	201	153.6 Å²	153.6	88%	0.882	79%	0.789	S	S	*	*			trans	-59.3	98.6	159.5	-111.4	-95.9	0	0	0	108.1	N355 N359	N355-F357 PolarHBondContact O-N 3.29Å; N355-F357 VanDerWaalsContact O-N 3.15Å; F357-N359 PolarHBondContact O-N 3.33Å; F357-N359 VanDerWaalsContact O-N 3.07Å
358	Y	39.8	Very low	36.2	Very low	190 Å²	190	150.6 Å²	150.6	75%	0.745	78%	0.778	S	S	*	*			trans	-77.9	95.6	170.2	-67.8	-75	0	0	0	108.9	A356 F360	A356-Y358 HydrophobicContact CB-CD2 4.28Å; A356-Y358 HydrophobicContact CB-CE1 4.48Å; A356-Y358 HydrophobicContact CB-CE2 3.66Å; A356-Y358 WeakPolarHBondContact O-CD2 3.42Å; A356-Y358 PolarHBondContact O-N 2.94Å; Y358-F360 VanDerWaalsContact O-CD2 3.27Å; Y358-F360 WeakPolarHBondContact O-CD2 3.47Å; Y358-F360 PolarHBondContact O-N 3.28Å
359	N	35.6	Very low	36.1	Very low	114 Å²	114	148.9 Å²	148.9	61%	0.61	78%	0.778	S	S	*	*			trans	-74.9	105.1	166.5	-176.1	-6.9	0	0	0	108.4	F357 N361	F357-N359 PolarHBondContact O-N 3.33Å; F357-N359 VanDerWaalsContact O-N 3.07Å; N359-N361 PolarHBondContact O-N 2.91Å; N359-N361 WeakPolarHBondContact OD1-CB 3.44Å; N359-N361 PolarHBondContact OD1-N 3.49Å; N359-N361 PolarHBondContact OD1-ND2 2.91Å
360	F	35.2	Very low	35.9	Very low	188 Å²	188	147 Å²	147	83%	0.825	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-67.3	6.8	-176.3	-78.4	-85.9	0	0	0	115.5	Y358 S362	Y358-F360 VanDerWaalsContact O-CD2 3.27Å; Y358-F360 WeakPolarHBondContact O-CD2 3.47Å; Y358-F360 PolarHBondContact O-N 3.28Å; F360-S362 PolarHBondContact O-N 3.45Å
361	N	35.2	Very low	35.6	Very low	130 Å²	130	145.9 Å²	145.9	70%	0.695	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-84.9	-0.8	-174.8	-71.2	-48.9	0	0	0	115.3	N359	N359-N361 PolarHBondContact O-N 2.91Å; N359-N361 WeakPolarHBondContact OD1-CB 3.44Å; N359-N361 PolarHBondContact OD1-N 3.49Å; N359-N361 PolarHBondContact OD1-ND2 2.91Å
362	S	36.9	Very low	35.4	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-102.3	5.3	-172.8	-158.6	0	0	0	0	115.9	F360	F360-S362 PolarHBondContact O-N 3.45Å
363	M	32.9	Very low	35.3	Very low	183 Å²	183	138.3 Å²	138.3	90%	0.901	77%	0.765	S	S	*	*			trans	-113.9	58.6	175.2	-75.3	-170.9	155.9	0	0	111.7
364	I	37.8	Very low	35.4	Very low	131 Å²	131	141.2 Å²	141.2	67%	0.672	77%	0.77	S	S	*	*			trans	-104.7	105.2	160.6	-59.1	173.9	0	0	0	106.6	K366	I364-K366 PolarHBondContact O-N 3.48Å; I364-K366 VanDerWaalsContact O-N 3.13Å
365	P	36.7	Very low	35.2	Very low	124 Å²	124	139.6 Å²	139.6	81%	0.805	76%	0.76	S	S	*	*			trans	-65.1	113.8	163.2	-12.8	28	0	0	0	107.6	N367	P365-N367 PolarHBondContact O-N 2.96Å
366	K	43	Very low	35.3	Very low	197 Å²	197	137.3 Å²	137.3	86%	0.857	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-55.5	121.5	179.9	-65.2	176.8	178.9	177.9	0	109.8	I364 G368	I364-K366 PolarHBondContact O-N 3.48Å; I364-K366 VanDerWaalsContact O-N 3.13Å; K366-G368 PolarHBondContact O-N 3.24Å
367	N	39	Very low	35.1	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-61.7	128.7	167.2	50.5	-4	0	0	0	109.5	P365	P365-N367 PolarHBondContact O-N 2.96Å
368	G	37.1	Very low	35.3	Very low	61 Å²	61	136.8 Å²	136.8	63%	0.629	75%	0.749	S	S	*	*	S	Bend	trans	-60.2	139.5	170.3	0	0	0	0	0	110.3	K366	K366-G368 PolarHBondContact O-N 3.24Å
369	N	35.2	Very low	35.2	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	75%	0.748	S	S	*	*			trans	107.8	70.6	160.4	-45.1	-13.2	0	0	0	116
370	S	33.5	Very low	35.2	Very low	128 Å²	128	133.7 Å²	133.7	90%	0.895	75%	0.753	S	S	*	*				-177	120.4	125.6	-88.2	0	0	0	0	113.2
371	T	30	Very low	35.4	Very low	123 Å²	123	131.2 Å²	131.2	76%	0.755	75%	0.747	S	S	*	*			trans	-55.7	141.4	168.8	-51.5	0	0	0	0	113
372	V	29.5	Very low	35.7	Very low	141 Å²	141	129.8 Å²	129.8	86%	0.855	74%	0.744	S	S	*	*				-171.1	138.6	127.2	166.6	0	0	0	0	109.7
373	I	29.6	Very low	35.8	Very low	130 Å²	130	130.4 Å²	130.4	67%	0.667	74%	0.738	S	S	*	*			trans	-86.2	159.9	-167.3	-64.5	174.7	0	0	0	111.9	I375	I373-I375 HydrophobicContact CG2-CD1 4.17Å; I373-I375 HydrophobicContact CG2-CG1 4.37Å
374	V	33.8	Very low	36.2	Very low	123 Å²	123	128 Å²	128	75%	0.745	73%	0.729	S	S	*	*			trans	153.2	98.9	138.7	166.3	0	0	0	0	108
375	I	32.2	Very low	36.3	Very low	128 Å²	128	129.1 Å²	129.1	66%	0.656	73%	0.731	S	S	*	*				61.1	120	91	-52.9	158.2	0	0	0	109.6	I373	I373-I375 HydrophobicContact CG2-CD1 4.17Å; I373-I375 HydrophobicContact CG2-CG1 4.37Å
376	D	34	Very low	36.4	Very low	114 Å²	114	127.1 Å²	127.1	61%	0.61	73%	0.725	S	S	*	*				-175.8	159.6	53.4	-145.1	-12.4	0	0	0	113.4
377	Q	35.7	Very low	36.4	Very low	152 Å²	152	126 Å²	126	71%	0.71	72%	0.72	S	S	*	*			trans	46.5	125.6	142.3	-83.9	161.4	59.4	0	0	119.4
378	S	37.6	Very low	36.7	Very low	95 Å²	95	125.7 Å²	125.7	66%	0.664	71%	0.714	S	S	*	*				179	128.1	53.9	21.2	0	0	0	0	108.6
379	S	38.5	Very low	36.8	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	72%	0.715	S	S	*	*				87.7	138.3	111.3	-62.3	0	0	0	0	113.4
380	L	36.3	Very low	37.3	Very low	135 Å²	135	127.4 Å²	127.4	71%	0.707	71%	0.707	S	S	*	*			cis	176.5	123.5	19.6	-114	163.2	0	0	0	101.9
381	L	38.7	Very low	37.5	Very low	135 Å²	135	126.4 Å²	126.4	71%	0.707	70%	0.696	S	S	*	*				159	116	91.1	-90.2	148.5	0	0	0	105.3
382	T	40.9	Very low	37.9	Very low	100 Å²	100	125.3 Å²	125.3	61%	0.613	69%	0.693	S	S	*	*				59.1	139.5	95.8	61.1	0	0	0	0	113.6
383	D	40.1	Very low	38.2	Very low	127 Å²	127	124.2 Å²	124.2	68%	0.679	69%	0.687	S	S	*	*			cis	-170.7	145.2	7.7	-97.8	-22.1	0	0	0	104.3
384	D	41.5	Very low	38.5	Very low	133 Å²	133	122.8 Å²	122.8	71%	0.711	69%	0.688	S	S	*	*				112	146.8	112.2	-95.6	-13.9	0	0	0	108.1
385	Q	40.3	Very low	38.8	Very low	155 Å²	155	122.3 Å²	122.3	72%	0.724	69%	0.69	S	S	*	*			cis	-161.2	130.2	-0.1	-120.1	-175.8	27.8	0	0	103.9
386	A	38.8	Very low	39.1	Very low	81 Å²	81	121 Å²	121	67%	0.669	69%	0.693	S	S	*	*				81	137.7	96.1	0	0	0	0	0	116.8
387	K	42	Very low	39.2	Very low	174 Å²	174	120.9 Å²	120.9	76%	0.757	70%	0.7	S	S	*	*			trans	113.3	100.4	148.1	-59.7	-140.2	164.7	174.9	0	115.1
388	H	45.9	Very low	39.4	Very low	145 Å²	145	118.8 Å²	118.8	67%	0.671	70%	0.703	S	S	*	*				87.8	130.9	90.4	-86.3	-80.1	0	0	0	109.4
389	D	39.3	Very low	39.4	Very low	121 Å²	121	119.2 Å²	119.2	65%	0.647	71%	0.706	S	S	*	*			cis	-151.1	140.3	22.5	-81	-51.8	0	0	0	109.2
390	I	44.3	Very low	39.3	Very low	132 Å²	132	119.8 Å²	119.8	68%	0.677	71%	0.71	S	S	*	*				48.6	119.2	84.2	-38	171.7	0	0	0	110.4
391	T	38	Very low	39.3	Very low	107 Å²	107	118.4 Å²	118.4	66%	0.656	71%	0.709	S	S	*	*				167.4	126.2	82.4	-52.5	0	0	0	0	109.3
392	S	38.5	Very low	39	Very low	99 Å²	99	119.9 Å²	119.9	69%	0.692	71%	0.712	S	S	*	*			trans	69.2	147.7	138.8	-61.9	0	0	0	0	119.5
393	T	36.5	Very low	38.8	Very low	119 Å²	119	121.6 Å²	121.6	73%	0.73	72%	0.716	S	S	*	*			cis	-178	121.4	12	13.3	0	0	0	0	104.5
394	S	36	Very low	38.5	Very low	99 Å²	99	122.9 Å²	122.9	69%	0.692	72%	0.721	S	S	*	*				71.3	137.2	100.4	74.3	0	0	0	0	117.9
395	S	39	Very low	38	Very low	114 Å²	114	123.9 Å²	123.9	80%	0.797	73%	0.726	S	S	*	*			trans	81.6	136.4	159.6	78.7	0	0	0	0	115.7
396	S	40.3	Very low	37.8	Very low	101 Å²	101	121.8 Å²	121.8	71%	0.706	73%	0.729	S	S	*	*			cis	-168.5	134.1	19.5	43.2	0	0	0	0	111.1
397	S	36.1	Very low	37.6	Very low	110 Å²	110	122.7 Å²	122.7	77%	0.769	73%	0.73	S	S	*	*			trans	25.2	127.4	137.4	61.4	0	0	0	0	122
398	S	38.7	Very low	37.2	Very low	108 Å²	108	120.3 Å²	120.3	76%	0.755	73%	0.734	S	S	*	*				164.6	101.4	120.5	63.3	0	0	0	0	109
399	S	37.7	Very low	36.5	Very low	105 Å²	105	120.7 Å²	120.7	73%	0.734	74%	0.741	S	S	*	*				87.7	117.6	95.7	69.6	0	0	0	0	115.5
400	S	35.8	Very low	36.1	Very low	116 Å²	116	123 Å²	123	81%	0.811	75%	0.752	S	S	*	*			trans	88.9	146.4	147.7	-78.9	0	0	0	0	121.2
401	P	36.5	Very low	35.5	Very low	105 Å²	105	123.7 Å²	123.7	68%	0.682	76%	0.756	S	S	*	*			trans	-110.8	133.8	-143.1	35.8	-22.9	0	0	0	112
402	H	33.9	Very low	35.3	Very low	167 Å²	167	126.4 Å²	126.4	77%	0.773	76%	0.763	S	S	*	*			trans	-142.2	113.2	171.4	-81.2	-64.3	0	0	0	113.8
403	I	36.8	Very low	35	Very low	136 Å²	136	129.4 Å²	129.4	70%	0.697	77%	0.772	S	S	*	*				65.8	102.2	125.7	-55.8	172.3	0	0	0	116.8	N405	I403-N405 PolarHBondContact O-N 2.98Å
404	I	32.2	Very low	35	Very low	153 Å²	153	131.5 Å²	131.5	79%	0.785	77%	0.773	S	S	*	*			trans	-21.7	119.2	147	-55.3	158.6	0	0	0	112.4
405	N	30.7	Very low	35.1	Very low	154 Å²	154	137.2 Å²	137.2	82%	0.824	78%	0.78	S	S	*	*			trans	-134.1	81.5	157	-103.1	-20.5	0	0	0	107.5	I403	I403-N405 PolarHBondContact O-N 2.98Å
406	S	36.7	Very low	35.1	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	78%	0.783	S	S	*	*			trans	-104.8	103.4	158.6	-164.1	0	0	0	0	107.4
407	S	35.3	Very low	35.2	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	78%	0.775	S	S	*	*			trans	-85.9	106.5	178.4	-67.3	0	0	0	0	109.4
408	C	32.5	Very low	35.7	Very low	124 Å²	124	138.2 Å²	138.2	84%	0.838	76%	0.763	S	S	*	*			trans	-172.3	82	143.3	-98.2	0	0	0	0	108.4	L410	C408-L410 PolarHBondContact O-N 3.4Å
409	N	31.9	Very low	36.2	Very low	153 Å²	153	144.1 Å²	144.1	82%	0.818	77%	0.769	S	S	*	*			trans	-75.7	108.2	173.8	-79.2	-49.9	0	0	0	110.3	I411	N409-I411 HydrophobicContact CB-CG1 4.45Å
410	L	30.1	Very low	36.7	Very low	168 Å²	168	146.2 Å²	146.2	88%	0.88	77%	0.767	S	S	*	*			trans	-91.3	100.8	152.3	-106.7	144.4	0	0	0	106.8	C408 M412	C408-L410 PolarHBondContact O-N 3.4Å; L410-M412 PolarHBondContact O-N 3.47Å; L410-M412 VanDerWaalsContact O-N 3.13Å
411	I	32.1	Very low	37.1	Very low	147 Å²	147	144.9 Å²	144.9	75%	0.754	75%	0.751	S	S	*	*			trans	-72.5	99.8	173.5	-62.1	168.7	0	0	0	106.9	N409	N409-I411 HydrophobicContact CB-CG1 4.45Å
412	M	33.7	Very low	37.6	Very low	165 Å²	165	143 Å²	143	81%	0.813	74%	0.739	S	S	*	*			trans	-103	127.6	154.5	-71.8	-146.1	-70.4	0	0	108.1	L410 E414	L410-M412 PolarHBondContact O-N 3.47Å; L410-M412 VanDerWaalsContact O-N 3.13Å; M412-E414 PolarHBondContact O-N 2.89Å
413	N	32.4	Very low	38.3	Very low	161 Å²	161	138.3 Å²	138.3	86%	0.861	73%	0.726	S	S	*	*			trans	-58.2	96.1	-178.7	-96.4	-24.2	0	0	0	111.3	R415	N413-R415 PolarHBondContact O-N 2.91Å
414	E	36.1	Very low	38.7	Very low	163 Å²	163	136.8 Å²	136.8	76%	0.762	72%	0.718	S	S	*	*			trans	-79.7	91.5	161.4	-77.1	-153.3	144.7	0	0	109.9	M412	M412-E414 PolarHBondContact O-N 2.89Å
415	R	39.3	Very low	39.7	Very low	220 Å²	220	135.9 Å²	135.9	83%	0.83	71%	0.711	S	S	*	*			trans	-136	118.4	150.7	-72	-170.9	-169.5	152.3	4.1	107.4	N413	N413-R415 PolarHBondContact O-N 2.91Å
416	N	39.3	Very low	40.7	Very low	162 Å²	162	134.5 Å²	134.5	87%	0.866	70%	0.704	S	S	*	*			trans	95.1	41.1	178.2	-50.4	-52.4	0	0	0	117.5
417	L	42.3	Very low	41.5	Very low	103 Å²	103	131.4 Å²	131.4	54%	0.539	68%	0.682	S	S	.	*			trans	-92.1	127.5	155.7	-149.5	72.8	0	0	0	109.5	L421	L417-L421 HydrophobicContact CD1-CD1 4.07Å; L417-L421 HydrophobicContact CD2-CB 4.02Å; L417-L421 HydrophobicContact CD2-CD1 4.11Å; L417-L421 HydrophobicContact CG-CB 4.4Å; L417-L421 HydrophobicContact CG-CD1 3.97Å
418	P	45.8	Very low	42.4	Very low	81 Å²	81	130.5 Å²	130.5	53%	0.526	68%	0.676	S	S	.	*			trans	-59.8	139.6	-179.9	-18.6	29.4	0	0	0	111	E420 L421	P418-E420 PolarHBondContact O-N 2.96Å; P418-L421 PolarHBondContact O-N 2.86Å
419	R	49.7	Very low	43.3	Very low	231 Å²	231	129.9 Å²	129.9	87%	0.872	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	-17.1	-179.7	-155.5	179.8	-113.4	177.7	-4.1	114.3
420	E	48.5	Very low	44.4	Very low	149 Å²	149	126 Å²	126	70%	0.696	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-33.7	177.6	-66.6	-73.2	124.1	0	0	113.5	P418 S423	P418-E420 PolarHBondContact O-N 2.96Å; E420-S423 PolarHBondContact O-N 2.8Å; E420-S423 PolarHBondContact O-OG 3.28Å
421	L	42.7	Very low	45.9	Very low	89 Å²	89	123 Å²	123	47%	0.466	62%	0.623	S	S	.	*	H	α-helix	trans	-79.4	-26.6	-178.5	-76.4	167.8	0	0	0	113.2	L417 P418 S423 L424 H425	L417-L421 HydrophobicContact CD1-CD1 4.07Å; L417-L421 HydrophobicContact CD2-CB 4.02Å; L417-L421 HydrophobicContact CD2-CD1 4.11Å; L417-L421 HydrophobicContact CG-CB 4.4Å; L417-L421 HydrophobicContact CG-CD1 3.97Å; P418-L421 PolarHBondContact O-N 2.86Å; L421-S423 PolarHBondContact O-N 2.93Å; L421-L424 HydrophobicContact CD2-CD1 4Å; L421-L424 PolarHBondContact O-N 3.47Å; L421-H425 PolarHBondContact O-N 2.97Å
422	S	47.4	Very low	46.9	Very low	64 Å²	64	121 Å²	121	45%	0.448	61%	0.611	S	S	.	*	H	α-helix	trans	-67.3	-21	171.4	-44.7	0	0	0	0	112.5	N426	S422-N426 PolarHBondContact O-ND2 2.97Å
423	S	50	Low	48	Very low	70 Å²	70	118.7 Å²	118.7	49%	0.49	59%	0.594	S	S	.	*	H	α-helix	trans	-76.8	-29.4	175.7	81.9	0	0	0	0	112.7	E420 L421 N426 S427	E420-S423 PolarHBondContact O-N 2.8Å; E420-S423 PolarHBondContact O-OG 3.28Å; L421-S423 PolarHBondContact O-N 2.93Å; S423-N426 PolarHBondContact O-N 2.88Å; S423-S427 PolarHBondContact O-N 3.33Å
424	L	45	Very low	49.5	Very low	103 Å²	103	116.7 Å²	116.7	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-72.5	-34.1	175.8	-82.6	154.4	0	0	0	112.2	L421 N426 S427 V430	L421-L424 HydrophobicContact CD2-CD1 4Å; L421-L424 PolarHBondContact O-N 3.47Å; L424-N426 PolarHBondContact O-N 3.39Å; L424-S427 VanDerWaalsContact O-CB 3.3Å; L424-S427 WeakPolarHBondContact O-CB 3.49Å; L424-S427 PolarHBondContact O-N 3.47Å; L424-S427 VanDerWaalsContact O-N 3.17Å; L424-V430 WeakPolarHBondContact O-CG2 3.47Å
425	H	52	Low	50.9	Low	134 Å²	134	115.1 Å²	115.1	62%	0.62	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-18.1	173.5	-170.1	-83.6	0	0	0	113.1	L421	L421-H425 PolarHBondContact O-N 2.97Å
426	N	51.1	Low	51.6	Low	126 Å²	126	110.1 Å²	110.1	67%	0.674	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	8.6	174.4	-67.4	-32.4	0	0	0	112.8	S422 S423 L424 S428	S422-N426 PolarHBondContact O-ND2 2.97Å; S423-N426 PolarHBondContact O-N 2.88Å; L424-N426 PolarHBondContact O-N 3.39Å; N426-S428 PolarHBondContact O-N 3.43Å
427	S	53.5	Low	52.5	Low	46 Å²	46	103.9 Å²	103.9	32%	0.322	52%	0.521	S	S	.	.			trans	-69.6	125.3	174.6	-178.4	0	0	0	0	109.5	S423 L424 H429 V430 Q431	S423-S427 PolarHBondContact O-N 3.33Å; L424-S427 VanDerWaalsContact O-CB 3.3Å; L424-S427 WeakPolarHBondContact O-CB 3.49Å; L424-S427 PolarHBondContact O-N 3.47Å; L424-S427 VanDerWaalsContact O-N 3.17Å; S427-H429 PolarHBondContact O-N 3.46Å; S427-V430 PolarHBondContact O-N 2.98Å; S427-Q431 PolarHBondContact O-N 2.92Å
428	S	55	Low	53.6	Low	82 Å²	82	102.3 Å²	102.3	57%	0.573	51%	0.513	S	S	*	.	H	α-helix	trans	-44.7	-31.1	174.9	178	0	0	0	0	113	N426 Q432	N426-S428 PolarHBondContact O-N 3.43Å; S428-Q432 WeakPolarHBondContact O-CB 3.29Å; S428-Q432 WeakPolarHBondContact O-CG 3.5Å; S428-Q432 PolarHBondContact O-N 3.39Å
429	H	51	Low	54.5	Low	111 Å²	111	105.1 Å²	105.1	51%	0.514	52%	0.524	S	S	.	.	H	α-helix	trans	-68.3	-40.8	178.9	-113.7	-75.7	0	0	0	113	S427 Q432 Y433	S427-H429 PolarHBondContact O-N 3.46Å; H429-Q432 PolarHBondContact O-N 3.35Å; H429-Y433 AromaticContact ND1-CE2 3.56Å; H429-Y433 WeakPolarHBondContact O-CD2 3.49Å; H429-Y433 PolarHBondContact O-N 2.89Å
430	V	56.4	Low	54.5	Low	72 Å²	72	98.4 Å²	98.4	44%	0.436	50%	0.504	S	S	.	.	H	α-helix	trans	-71.7	-37.9	-179.8	179.1	0	0	0	0	110.3	L424 S427 Y433 K434	L424-V430 WeakPolarHBondContact O-CG2 3.47Å; S427-V430 PolarHBondContact O-N 2.98Å; V430-Y433 PolarHBondContact O-N 3.4Å; V430-K434 WeakPolarHBondContact O-CB 3.5Å; V430-K434 PolarHBondContact O-N 3.4Å
431	Q	60.5	Low	54.7	Low	103 Å²	103	93.7 Å²	93.7	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-43.4	172.2	-130.4	76.9	8.7	0	0	111.6	S427 K434 E435	S427-Q431 PolarHBondContact O-N 2.92Å; Q431-K434 PolarHBondContact O-N 2.76Å; Q431-E435 WeakPolarHBondContact O-CB 3.41Å; Q431-E435 PolarHBondContact O-N 3.06Å
432	Q	54	Low	55.4	Low	106 Å²	106	93.9 Å²	93.9	50%	0.495	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-40.8	174	-88.6	177.1	-24.4	0	0	112.5	S428 H429 K434 E435 F436	S428-Q432 WeakPolarHBondContact O-CB 3.29Å; S428-Q432 WeakPolarHBondContact O-CG 3.5Å; S428-Q432 PolarHBondContact O-N 3.39Å; H429-Q432 PolarHBondContact O-N 3.35Å; Q432-K434 VanDerWaalsContact C-N 3.32Å; Q432-E435 PolarHBondContact O-N 3.39Å; Q432-F436 WeakPolarHBondContact O-CB 3.31Å; Q432-F436 PolarHBondContact O-N 3.49Å
433	Y	55.5	Low	55.8	Low	116 Å²	116	95.5 Å²	95.5	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-66.1	-36.3	175.2	-87.5	-68.2	0	0	0	111.9	H429 V430 I437	H429-Y433 AromaticContact ND1-CE2 3.56Å; H429-Y433 WeakPolarHBondContact O-CD2 3.49Å; H429-Y433 PolarHBondContact O-N 2.89Å; V430-Y433 PolarHBondContact O-N 3.4Å; Y433-I437 WeakPolarHBondContact O-CB 3.35Å; Y433-I437 WeakPolarHBondContact O-CG1 3.48Å; Y433-I437 PolarHBondContact O-N 3.22Å
434	K	64	Low	56.1	Low	119 Å²	119	96.9 Å²	96.9	52%	0.517	49%	0.486	S	S	.	.	H	α-helix	trans	-68	-45.4	175.7	-169.4	-174	176.9	-61.6	0	111.6	V430 Q431 Q432 I437 D438	V430-K434 WeakPolarHBondContact O-CB 3.5Å; V430-K434 PolarHBondContact O-N 3.4Å; Q431-K434 PolarHBondContact O-N 2.76Å; Q432-K434 VanDerWaalsContact C-N 3.32Å; K434-I437 PolarHBondContact O-N 3.05Å; K434-D438 IonicContact NZ-OD1 3.89Å; K434-D438 IonicContact NZ-OD2 2.83Å; K434-D438 PolarHBondContact NZ-OD2 2.93Å; K434-D438 WeakPolarHBondContact O-CB 3.49Å; K434-D438 VanDerWaalsContact O-CG 3.25Å; K434-D438 PolarHBondContact O-N 2.91Å
435	E	66.2	Low	56.7	Low	131 Å²	131	96.5 Å²	96.5	61%	0.612	48%	0.483	S	S	*	.	H	α-helix	trans	-67.1	-37.9	178.1	-153.6	170.2	-150	0	0	111.2	Q431 Q432 D438 D439	Q431-E435 WeakPolarHBondContact O-CB 3.41Å; Q431-E435 PolarHBondContact O-N 3.06Å; Q432-E435 PolarHBondContact O-N 3.39Å; E435-D438 PolarHBondContact O-N 3.46Å; E435-D439 WeakPolarHBondContact O-CB 3.32Å; E435-D439 PolarHBondContact O-N 3.04Å
436	F	53.8	Low	57	Low	114 Å²	114	94.2 Å²	94.2	50%	0.5	48%	0.475	S	S	.	.	H	α-helix	trans	-63.4	-41	171.8	174.4	-102.8	0	0	0	113.1	Q432 L440	Q432-F436 WeakPolarHBondContact O-CB 3.31Å; Q432-F436 PolarHBondContact O-N 3.49Å; F436-L440 HydrophobicContact CD1-CD1 3.82Å; F436-L440 HydrophobicContact CD2-CD1 4.29Å; F436-L440 HydrophobicContact CE1-CD1 3.34Å; F436-L440 HydrophobicContact CE2-CD1 3.87Å; F436-L440 HydrophobicContact CG-CD1 4.28Å; F436-L440 HydrophobicContact CZ-CD1 3.37Å; F436-L440 WeakPolarHBondContact O-CB 3.48Å; F436-L440 WeakPolarHBondContact O-CD1 3.42Å; F436-L440 PolarHBondContact O-N 3.27Å
437	I	58.7	Low	57.4	Low	32 Å²	32	92.1 Å²	92.1	16%	0.164	46%	0.461	C	S	.	.	H	α-helix	trans	-67.2	-48.3	174.1	-71.8	169.1	0	0	0	109.1	E113 L117 Y433 K434 D439 L440 L441	E113-I437 HydrophobicContact CG-CG2 4.11Å; L117-I437 HydrophobicContact CD2-CD1 4.29Å; Y433-I437 WeakPolarHBondContact O-CB 3.35Å; Y433-I437 WeakPolarHBondContact O-CG1 3.48Å; Y433-I437 PolarHBondContact O-N 3.22Å; K434-I437 PolarHBondContact O-N 3.05Å; I437-D439 VanDerWaalsContact C-N 3.26Å; I437-D439 PolarHBondContact O-N 2.9Å; I437-L440 WeakPolarHBondContact O-CA 3.35Å; I437-L440 VanDerWaalsContact O-CB 3.31Å; I437-L440 WeakPolarHBondContact O-CB 3.44Å; I437-L440 PolarHBondContact O-N 2.92Å; I437-L441 HydrophobicContact CG2-CD2 4.43Å; I437-L441 WeakPolarHBondContact O-CD2 3.41Å; I437-L441 WeakPolarHBondContact O-CG 3.42Å; I437-L441 PolarHBondContact O-N 3.48Å
438	D	65.5	Low	57.7	Low	69 Å²	69	95.4 Å²	95.4	37%	0.369	47%	0.471	S	S	.	.	H	α-helix	trans	-58.2	-33.7	-179.9	-73.1	-26	0	0	0	112.5	K434 E435	K434-D438 IonicContact NZ-OD1 3.89Å; K434-D438 IonicContact NZ-OD2 2.83Å; K434-D438 PolarHBondContact NZ-OD2 2.93Å; K434-D438 WeakPolarHBondContact O-CB 3.49Å; K434-D438 VanDerWaalsContact O-CG 3.25Å; K434-D438 PolarHBondContact O-N 2.91Å; E435-D438 PolarHBondContact O-N 3.46Å
439	D	64.9	Low	57.9	Low	141 Å²	141	96.4 Å²	96.4	75%	0.754	46%	0.464	S	S	*	.	H	α-helix	trans	-79.6	-19.6	174.7	-84.5	-9.8	0	0	0	114.2	E435 I437 L441	E435-D439 WeakPolarHBondContact O-CB 3.32Å; E435-D439 PolarHBondContact O-N 3.04Å; I437-D439 VanDerWaalsContact C-N 3.26Å; I437-D439 PolarHBondContact O-N 2.9Å; D439-L441 VanDerWaalsContact C-N 3.26Å
440	L	49.5	Very low	58.5	Low	89 Å²	89	95.2 Å²	95.2	47%	0.466	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.4	175.9	-110.3	144.7	0	0	0	112.7	A116 F436 I437	A116-L440 HydrophobicContact CB-CB 4.23Å; F436-L440 HydrophobicContact CD1-CD1 3.82Å; F436-L440 HydrophobicContact CD2-CD1 4.29Å; F436-L440 HydrophobicContact CE1-CD1 3.34Å; F436-L440 HydrophobicContact CE2-CD1 3.87Å; F436-L440 HydrophobicContact CG-CD1 4.28Å; F436-L440 HydrophobicContact CZ-CD1 3.37Å; F436-L440 WeakPolarHBondContact O-CB 3.48Å; F436-L440 WeakPolarHBondContact O-CD1 3.42Å; F436-L440 PolarHBondContact O-N 3.27Å; I437-L440 WeakPolarHBondContact O-CA 3.35Å; I437-L440 VanDerWaalsContact O-CB 3.31Å; I437-L440 WeakPolarHBondContact O-CB 3.44Å; I437-L440 PolarHBondContact O-N 2.92Å
441	L	53.2	Low	58.7	Low	50 Å²	50	97.3 Å²	97.3	26%	0.262	46%	0.461	S	S	.	.			trans	-96.2	0	-172.8	-60.4	-159.3	0	0	0	112.7	S109 K112 E113 A116 I437 D439	S109-L441 WeakPolarHBondContact O-CD1 3.4Å; K112-L441 HydrophobicContact CB-CB 3.44Å; K112-L441 VanDerWaalsContact CB-CB 3.44Å; K112-L441 HydrophobicContact CB-CD1 4.1Å; K112-L441 HydrophobicContact CB-CD2 3.98Å; K112-L441 HydrophobicContact CB-CG 3.96Å; K112-L441 HydrophobicContact CD-CB 4.15Å; K112-L441 WeakPolarHBondContact CD-O 3.44Å; K112-L441 WeakPolarHBondContact CE-O 3.28Å; K112-L441 HydrophobicContact CG-CB 4.32Å; K112-L441 VanDerWaalsContact CG-O 3.26Å; K112-L441 WeakPolarHBondContact CG-O 3.35Å; K112-L441 PolarHBondContact NZ-O 3.41Å; K112-L441 PolarHBondContact NZ-OXT 2.94Å; K112-L441 WeakPolarHBondContact O-CD2 3.46Å; E113-L441 VanDerWaalsContact CA-CD2 3.43Å; E113-L441 HydrophobicContact CB-CD1 3.41Å; E113-L441 VanDerWaalsContact CB-CD1 3.41Å; E113-L441 HydrophobicContact CB-CD2 4.45Å; E113-L441 HydrophobicContact CG-CD1 3.95Å; E113-L441 VanDerWaalsContact N-CD1 3.25Å; A116-L441 HydrophobicContact CB-CD2 3.29Å; I437-L441 HydrophobicContact CG2-CD2 4.43Å; I437-L441 WeakPolarHBondContact O-CD2 3.41Å; I437-L441 WeakPolarHBondContact O-CG 3.42Å; I437-L441 PolarHBondContact O-N 3.48Å; D439-L441 VanDerWaalsContact C-N 3.26Å

Retrieved 441 of 441 residues in 552 ms (Link to these results)

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