A0A087X338_POEFO Loading...

Bromodomain-containing protein 9

AlphaFold DB , UniProt , Accession A0A087X338, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 658 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	36.5	Very low	251 Å²	251	169.7 Å²	169.7	100%	1.236	82%	0.816	S	S	*	*				0	147.2	0	-60.3	-171	-80.1	0	0	108.6
2	G	38	Very low	36.1	Very low	66 Å²	66	173.9 Å²	173.9	68%	0.68	82%	0.818	S	S	*	*			cis	-178.7	116.2	-10.3	0	0	0	0	0	111	K4	G2-K4 PolarHBondContact O-N 3.44Å
3	K	46.6	Very low	35.7	Very low	190 Å²	190	172 Å²	172	83%	0.826	81%	0.814	S	S	*	*			trans	-72.1	92	-178.7	-71	-177.6	178.6	178.1	0	111.5	H5	K3-H5 PolarHBondContact O-N 3.45Å; K3-H5 PolarHBondContact O-ND1 3.37Å
4	K	38.6	Very low	35.2	Very low	208 Å²	208	168.8 Å²	168.8	90%	0.904	81%	0.811	S	S	*	*			trans	-74.8	86.2	173.6	-76.6	-169.6	175.8	-178.7	0	111.5	G2 K6	G2-K4 PolarHBondContact O-N 3.44Å; K4-K6 PolarHBondContact O-N 3.13Å
5	H	36.9	Very low	35	Very low	160 Å²	160	167.5 Å²	167.5	74%	0.741	82%	0.817	S	S	*	*			trans	-60.5	124.7	164.7	-60.7	79.9	0	0	0	109.5	K3 K7	K3-H5 PolarHBondContact O-N 3.45Å; K3-H5 PolarHBondContact O-ND1 3.37Å; H5-K7 PolarHBondContact O-N 3.31Å
6	K	39.5	Very low	34.6	Very low	209 Å²	209	162.1 Å²	162.1	91%	0.909	81%	0.809	S	S	*	*			trans	-86.5	102.4	169.7	-165.2	169.4	-176.5	179.5	0	108.2	K4	K4-K6 PolarHBondContact O-N 3.13Å
7	K	35.5	Very low	34.4	Very low	196 Å²	196	161.2 Å²	161.2	85%	0.852	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-60.1	134.4	-178.8	-65.2	-176.2	177.1	-175	0	110.5	H5	H5-K7 PolarHBondContact O-N 3.31Å
8	H	33.5	Very low	34.2	Very low	181 Å²	181	162.4 Å²	162.4	84%	0.838	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-76.3	130.4	162.3	-153.7	-85.6	0	0	0	107.9
9	K	29.6	Very low	34.1	Very low	162 Å²	162	162 Å²	162	70%	0.704	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-102.2	136.5	162.7	-89.3	-165.4	171.7	-167.7	0	108
10	P	35.9	Very low	34.3	Very low	81 Å²	81	161.3 Å²	161.3	53%	0.526	80%	0.802	S	S	.	*	P	Polyproline II helix	trans	-76.6	146.8	153.2	34.1	-30.5	0	0	0	108.9	W12	P10-W12 HydrophobicContact CG-CZ2 4.22Å
11	E	30.8	Very low	34.3	Very low	163 Å²	163	161.8 Å²	161.8	76%	0.762	80%	0.799	S	S	*	*			trans	-124.4	133	164.9	-69.4	-175.7	165.1	0	0	107.5
12	W	32.3	Very low	34.5	Very low	220 Å²	220	154.2 Å²	154.2	83%	0.833	78%	0.777	S	S	*	*			trans	-112.6	118.6	-178	-43.6	-74.6	0	0	0	109	P10	P10-W12 HydrophobicContact CG-CZ2 4.22Å
13	I	30.6	Very low	34.5	Very low	149 Å²	149	157.7 Å²	157.7	76%	0.764	78%	0.779	S	S	*	*			trans	-140.6	89.6	171.9	-63.9	-176.8	0	0	0	104.2
14	T	28.9	Very low	34.4	Very low	127 Å²	127	157.5 Å²	157.5	78%	0.779	78%	0.781	S	S	*	*				60.6	126.4	94.3	59.8	0	0	0	0	114.2
15	V	31.7	Very low	34.5	Very low	149 Å²	149	155.3 Å²	155.3	90%	0.903	77%	0.771	S	S	*	*			trans	-94.1	126.9	-178.9	179.8	0	0	0	0	110
16	A	29.5	Very low	34.8	Very low	82 Å²	82	153.2 Å²	153.2	68%	0.678	77%	0.772	S	S	*	*			trans	-162.1	121.5	154.8	0	0	0	0	0	109.6
17	D	30.4	Very low	34.7	Very low	147 Å²	147	151.1 Å²	151.1	79%	0.786	77%	0.77	S	S	*	*			trans	33.5	119	149	-44.7	-29.5	0	0	0	120.9
18	F	30.6	Very low	35.2	Very low	182 Å²	182	151.3 Å²	151.3	80%	0.798	77%	0.771	S	S	*	*				-161.9	110.1	121.2	-122.2	-80	0	0	0	113
19	E	32.3	Very low	35.4	Very low	155 Å²	155	150 Å²	150	72%	0.724	77%	0.768	S	S	*	*			trans	55.5	138.3	154.4	-68.8	176.7	168.9	0	0	122.7
20	D	39.7	Very low	35.9	Very low	148 Å²	148	151.7 Å²	151.7	79%	0.791	78%	0.776	S	S	*	*			trans	-74.4	136.7	175.7	-177.8	16.4	0	0	0	112.7
21	K	33.8	Very low	35.8	Very low	172 Å²	172	154.7 Å²	154.7	75%	0.748	79%	0.787	S	S	*	*			trans	-141.9	98.5	167	-73.5	-171.2	176.9	164.6	0	110.7	L23	K21-L23 PolarHBondContact O-N 3.03Å
22	A	39.1	Very low	36.4	Very low	92 Å²	92	156.1 Å²	156.1	76%	0.76	79%	0.79	S	S	*	*			trans	-51.6	105.3	170.3	0	0	0	0	0	112	E24	A22-E24 PolarHBondContact O-N 3.25Å
23	L	38.8	Very low	36.5	Very low	138 Å²	138	150.6 Å²	150.6	72%	0.723	78%	0.78	S	S	*	*			trans	-94.5	77.5	173.4	-82.5	173.7	0	0	0	110.5	K21 K25	K21-L23 PolarHBondContact O-N 3.03Å; L23-K25 PolarHBondContact O-N 3.49Å
24	E	43.5	Very low	36.6	Very low	187 Å²	187	146.2 Å²	146.2	87%	0.874	77%	0.772	S	S	*	*			trans	-57.6	101.6	165	-80.8	-155.1	112.8	0	0	110.8	A22	A22-E24 PolarHBondContact O-N 3.25Å
25	K	41.4	Very low	36.6	Very low	161 Å²	161	143 Å²	143	70%	0.7	76%	0.764	S	S	*	*			trans	-137.3	90.5	169.6	-71.6	-176.3	-179	166.2	0	108.9	L23 L27	L23-K25 PolarHBondContact O-N 3.49Å; K25-L27 PolarHBondContact O-N 3Å
26	P	43	Very low	36.7	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	76%	0.758	S	S	*	*			trans	-61.5	124	-175.7	22.6	-32.9	0	0	0	111.5	K28	P26-K28 PolarHBondContact O-N 2.57Å
27	L	37.8	Very low	36.6	Very low	165 Å²	165	144.9 Å²	144.9	86%	0.864	76%	0.762	S	S	*	*			trans	-65.6	113.9	175.7	-72.1	171.4	0	0	0	109.6	K25 I29	K25-L27 PolarHBondContact O-N 3Å; L27-I29 PolarHBondContact O-N 2.92Å
28	K	45.5	Very low	36.5	Very low	199 Å²	199	144.1 Å²	144.1	87%	0.865	76%	0.762	S	S	*	*			trans	-72.6	89.6	179.5	-73.1	-175.7	175.4	178.9	0	111.3	P26 K30	P26-K28 PolarHBondContact O-N 2.57Å; K28-K30 PolarHBondContact O-N 3.46Å; K28-K30 VanDerWaalsContact O-N 3.13Å
29	I	38.2	Very low	36.4	Very low	155 Å²	155	142.2 Å²	142.2	80%	0.795	77%	0.765	S	S	*	*			trans	-57.3	113.8	165.9	-60.7	173.5	0	0	0	108.2	L27 L31	L27-I29 PolarHBondContact O-N 2.92Å; I29-L31 PolarHBondContact O-N 2.65Å
30	K	40.2	Very low	36.3	Very low	197 Å²	197	143.1 Å²	143.1	86%	0.857	77%	0.769	S	S	*	*			trans	-90.8	93.1	167.6	-83	-171.3	171.8	-176.9	0	109.3	K28 K32	K28-K30 PolarHBondContact O-N 3.46Å; K28-K30 VanDerWaalsContact O-N 3.13Å; K30-K32 PolarHBondContact O-N 2.91Å
31	L	34.2	Very low	35.8	Very low	144 Å²	144	141.8 Å²	141.8	75%	0.754	76%	0.762	S	S	*	*			trans	-63.3	117.3	165.8	-159.9	78.7	0	0	0	108.3	I29 V33	I29-L31 PolarHBondContact O-N 2.65Å; L31-V33 HydrophobicContact CD2-CB 4.45Å; L31-V33 HydrophobicContact CD2-CG2 4.05Å; L31-V33 HydrophobicContact CG-CG2 4.1Å
32	K	43.1	Very low	35.7	Very low	192 Å²	192	139.4 Å²	139.4	84%	0.835	77%	0.767	S	S	*	*			trans	-107.9	60	172.9	-177.1	46.8	-178.2	171.5	0	110	K30	K30-K32 PolarHBondContact O-N 2.91Å
33	V	34.2	Very low	35.1	Very low	104 Å²	104	137.2 Å²	137.2	63%	0.63	75%	0.753	S	S	*	*			trans	-80.1	137.4	149.2	178.5	0	0	0	0	105.2	L31	L31-V33 HydrophobicContact CD2-CB 4.45Å; L31-V33 HydrophobicContact CD2-CG2 4.05Å; L31-V33 HydrophobicContact CG-CG2 4.1Å
34	G	33.3	Very low	34.7	Very low	58 Å²	58	134.1 Å²	134.1	60%	0.598	74%	0.743	S	S	*	*			cis	97.3	8.7	18.2	0	0	0	0	0	112.1	S36	G34-S36 PolarHBondContact O-N 3.4Å
35	G	28.5	Very low	34	Very low	58 Å²	58	126.4 Å²	126.4	60%	0.598	71%	0.714	S	S	*	*			trans	-62.1	130.2	173.6	0	0	0	0	0	110.3
36	S	32.8	Very low	33.8	Very low	113 Å²	113	124.9 Å²	124.9	79%	0.79	71%	0.713	S	S	*	*			trans	-122.8	58	-179.6	55.9	0	0	0	0	108.1	G34	G34-S36 PolarHBondContact O-N 3.4Å
37	E	29.1	Very low	33.2	Very low	159 Å²	159	126.5 Å²	126.5	74%	0.743	72%	0.715	S	S	*	*			trans	-134.8	125.1	-172	-67.2	160.1	-91.7	0	0	104.6
38	V	27.7	Very low	33	Very low	131 Å²	131	128 Å²	128	79%	0.794	71%	0.71	S	S	*	*				55.6	92	62.2	-174.7	0	0	0	0	110.4
39	T	28.2	Very low	32.7	Very low	141 Å²	141	125.1 Å²	125.1	87%	0.865	71%	0.705	S	S	*	*			trans	-159	140.4	139.6	-3.9	0	0	0	0	111
40	E	30.5	Very low	32.8	Very low	174 Å²	174	124.8 Å²	124.8	81%	0.813	71%	0.705	S	S	*	*			trans	-57.2	147.6	-178.3	-66.2	146.5	-168.2	0	0	114.3
41	L	28.9	Very low	32.8	Very low	120 Å²	120	126.3 Å²	126.3	63%	0.628	71%	0.705	S	S	*	*			trans	5.7	116.6	130.6	-56.6	173.8	0	0	0	115.4	D468	L41-D468 HydrophobicContact CD1-CB 4.27Å
42	S	31.5	Very low	33.3	Very low	122 Å²	122	123.5 Å²	123.5	85%	0.853	70%	0.697	S	S	*	*				75.9	147.3	92	-63.3	0	0	0	0	115.1
43	G	26.9	Very low	33.7	Very low	46 Å²	46	119.2 Å²	119.2	47%	0.474	68%	0.684	S	S	.	*			cis	-140.1	176.6	5.7	0	0	0	0	0	113.3
44	S	29.4	Very low	34.5	Very low	73 Å²	73	119.7 Å²	119.7	51%	0.51	68%	0.679	S	S	.	*				61.8	133.2	96.7	71.5	0	0	0	0	114	H431	S44-H431 WeakPolarHBondContact O-CB 3.49Å
45	G	29.9	Very low	35.2	Very low	26 Å²	26	123.4 Å²	123.4	27%	0.268	68%	0.68	S	S	.	*			cis	-178.7	-167.8	1.4	0	0	0	0	0	105.6
46	L	37.3	Very low	36.4	Very low	129 Å²	129	128.2 Å²	128.2	68%	0.675	68%	0.681	S	S	*	*			cis	-161.6	142.6	-14.1	-112.5	172.7	0	0	0	104.7
47	D	30.2	Very low	37.5	Very low	150 Å²	150	128.1 Å²	128.1	80%	0.802	67%	0.668	S	S	*	*			trans	-152.6	153	167.2	-108.4	-39.8	0	0	0	112.3
48	Y	33	Very low	38.8	Very low	196 Å²	196	128 Å²	128	77%	0.769	66%	0.661	S	S	*	*			trans	-64.2	133.7	-149.6	-73.8	-102.3	0	0	0	118.8	D50	Y48-D50 PolarHBondContact O-N 2.71Å
49	D	39	Very low	40.5	Very low	140 Å²	140	127.9 Å²	127.9	75%	0.749	65%	0.651	S	S	*	*	S	Bend	trans	54.3	-26.3	141.2	-68.6	-50.9	0	0	0	124.4	R51	D49-R51 PolarHBondContact O-N 3.03Å
50	D	40.5	Very low	42.1	Very low	148 Å²	148	127 Å²	127	79%	0.791	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-22.9	-174.1	-167.7	51	0	0	0	114.1	Y48 S52	Y48-D50 PolarHBondContact O-N 2.71Å; D50-S52 PolarHBondContact O-N 3.07Å
51	R	39.8	Very low	43.9	Very low	228 Å²	228	123.1 Å²	123.1	86%	0.86	62%	0.617	S	S	*	*	H	α-helix	trans	-72.3	-23.3	-176.9	-89.9	-173.9	173.7	-176.8	1.6	115.2	D49 D53 H54 E55	D49-R51 PolarHBondContact O-N 3.03Å; R51-D53 PolarHBondContact O-N 3.31Å; R51-H54 PolarHBondContact O-N 2.89Å; R51-E55 PolarHBondContact O-N 2.95Å
52	S	46.4	Very low	45.8	Very low	85 Å²	85	123.4 Å²	123.4	59%	0.594	61%	0.613	S	S	*	*	H	α-helix	trans	-62.2	-47.2	-167.8	-174	0	0	0	0	112.4	D50 E55 R56	D50-S52 PolarHBondContact O-N 3.07Å; S52-E55 PolarHBondContact O-N 3.37Å; S52-R56 WeakPolarHBondContact O-CB 3.49Å; S52-R56 PolarHBondContact O-N 3.36Å
53	D	50.1	Low	47.8	Very low	103 Å²	103	125.3 Å²	125.3	55%	0.551	61%	0.606	S	S	*	*	H	α-helix	trans	-76.9	-28.2	-176.1	-139.2	6	0	0	0	112.1	R51 R56 E57	R51-D53 PolarHBondContact O-N 3.31Å; D53-R56 CarbonylContact O-C 3.52Å; D53-R56 PolarHBondContact O-N 2.85Å; D53-R56 WeakPolarHBondContact OD1-CD 3.39Å; D53-E57 WeakPolarHBondContact O-CB 3.46Å; D53-E57 PolarHBondContact O-N 3.42Å
54	H	50.7	Low	50	Low	113 Å²	113	131 Å²	131	52%	0.523	62%	0.618	S	S	.	*	H	α-helix	trans	-74.2	-31.4	175.8	-135.9	24.8	0	0	0	112.6	R51 E57 R58	R51-H54 PolarHBondContact O-N 2.89Å; H54-E57 IonicContact CE1-OE2 3.63Å; H54-E57 IonicContact ND1-OE2 3.91Å; H54-E57 PolarHBondContact ND1-OE2 2.83Å; H54-R58 VanDerWaalsContact O-CG 3.31Å; H54-R58 WeakPolarHBondContact O-CG 3.21Å; H54-R58 PolarHBondContact O-N 3.46Å
55	E	49.7	Very low	52.1	Low	136 Å²	136	133.6 Å²	133.6	64%	0.636	62%	0.62	S	S	*	*	H	α-helix	trans	-75.7	-38.1	168	-175.2	153.1	-122.3	0	0	112.3	R51 S52 E57 R58 H59	R51-E55 PolarHBondContact O-N 2.95Å; S52-E55 PolarHBondContact O-N 3.37Å; E55-E57 VanDerWaalsContact C-N 3.31Å; E55-E57 PolarHBondContact O-N 3.08Å; E55-R58 CarbonylContact O-C 3.57Å; E55-R58 PolarHBondContact O-N 3.25Å; E55-R58 VanDerWaalsContact O-N 3.15Å; E55-H59 WeakPolarHBondContact O-CB 3.39Å; E55-H59 PolarHBondContact O-N 2.98Å
56	R	53.8	Low	54.1	Low	160 Å²	160	140.5 Å²	140.5	60%	0.604	64%	0.642	S	S	*	*	H	α-helix	trans	-61.3	-37.8	171.7	176	172.7	-90.9	-143	-4.7	111.7	S52 D53 H59 K60	S52-R56 WeakPolarHBondContact O-CB 3.49Å; S52-R56 PolarHBondContact O-N 3.36Å; D53-R56 CarbonylContact O-C 3.52Å; D53-R56 PolarHBondContact O-N 2.85Å; D53-R56 WeakPolarHBondContact OD1-CD 3.39Å; R56-H59 PolarHBondContact O-N 2.87Å; R56-K60 HydrophobicContact CG-CD 4.32Å; R56-K60 WeakPolarHBondContact O-CB 3.25Å; R56-K60 WeakPolarHBondContact O-CD 3.36Å; R56-K60 WeakPolarHBondContact O-CG 3.45Å; R56-K60 PolarHBondContact O-N 3.05Å
57	E	55.6	Low	56	Low	110 Å²	110	140.7 Å²	140.7	51%	0.514	64%	0.638	S	S	.	*	H	α-helix	trans	-59.3	-56.4	166.3	-95.8	-148.7	115.1	0	0	111.1	D53 H54 E55 H59 K60 E61	D53-E57 WeakPolarHBondContact O-CB 3.46Å; D53-E57 PolarHBondContact O-N 3.42Å; H54-E57 IonicContact CE1-OE2 3.63Å; H54-E57 IonicContact ND1-OE2 3.91Å; H54-E57 PolarHBondContact ND1-OE2 2.83Å; E55-E57 VanDerWaalsContact C-N 3.31Å; E55-E57 PolarHBondContact O-N 3.08Å; E57-H59 PolarHBondContact O-N 3.06Å; E57-H59 VanDerWaalsContact O-N 3.14Å; E57-K60 CarbonylContact O-C 3.43Å; E57-K60 WeakPolarHBondContact O-CA 3.43Å; E57-K60 WeakPolarHBondContact O-CB 3.31Å; E57-K60 PolarHBondContact O-N 3.48Å; E57-K60 VanDerWaalsContact O-N 3.08Å; E57-E61 WeakPolarHBondContact O-CB 3.49Å; E57-E61 PolarHBondContact O-N 3.29Å
58	R	56.2	Low	58.2	Low	158 Å²	158	140.8 Å²	140.8	60%	0.596	63%	0.631	S	S	*	*	H	α-helix	trans	-57.4	-31.6	179.3	-75	172.3	-178.4	-116.7	-2.3	112.1	H54 E55 K62	H54-R58 VanDerWaalsContact O-CG 3.31Å; H54-R58 WeakPolarHBondContact O-CG 3.21Å; H54-R58 PolarHBondContact O-N 3.46Å; E55-R58 CarbonylContact O-C 3.57Å; E55-R58 PolarHBondContact O-N 3.25Å; E55-R58 VanDerWaalsContact O-N 3.15Å; R58-K62 VanDerWaalsContact O-CB 3.22Å; R58-K62 WeakPolarHBondContact O-CB 3.37Å; R58-K62 WeakPolarHBondContact O-CD 3.32Å; R58-K62 WeakPolarHBondContact O-CG 2.76Å; R58-K62 PolarHBondContact O-N 2.83Å
59	H	62.3	Low	60	Low	128 Å²	128	138 Å²	138	59%	0.593	62%	0.623	S	S	*	*	H	α-helix	trans	-77.9	-40.3	175.7	-148.5	-126.7	0	0	0	112.6	E55 R56 E57 E61 K63	E55-H59 WeakPolarHBondContact O-CB 3.39Å; E55-H59 PolarHBondContact O-N 2.98Å; R56-H59 PolarHBondContact O-N 2.87Å; E57-H59 PolarHBondContact O-N 3.06Å; E57-H59 VanDerWaalsContact O-N 3.14Å; H59-E61 VanDerWaalsContact C-N 3.29Å; H59-E61 PolarHBondContact O-N 2.82Å; H59-K63 VanDerWaalsContact O-CB 3.23Å; H59-K63 WeakPolarHBondContact O-CB 3.44Å; H59-K63 PolarHBondContact O-N 2.65Å
60	K	62.9	Low	61.4	Low	123 Å²	123	134.3 Å²	134.3	54%	0.535	61%	0.608	S	S	.	*	H	α-helix	trans	-57.4	-42.5	167.4	-73.5	162.6	-179.6	166.9	0	110.9	R56 E57 K63 K64	R56-K60 HydrophobicContact CG-CD 4.32Å; R56-K60 WeakPolarHBondContact O-CB 3.25Å; R56-K60 WeakPolarHBondContact O-CD 3.36Å; R56-K60 WeakPolarHBondContact O-CG 3.45Å; R56-K60 PolarHBondContact O-N 3.05Å; E57-K60 CarbonylContact O-C 3.43Å; E57-K60 WeakPolarHBondContact O-CA 3.43Å; E57-K60 WeakPolarHBondContact O-CB 3.31Å; E57-K60 PolarHBondContact O-N 3.48Å; E57-K60 VanDerWaalsContact O-N 3.08Å; K60-K63 PolarHBondContact O-N 2.68Å; K60-K64 VanDerWaalsContact O-CB 3.3Å; K60-K64 WeakPolarHBondContact O-CB 3.33Å; K60-K64 PolarHBondContact O-N 3.37Å
61	E	67.6	Low	62.9	Low	92 Å²	92	131.4 Å²	131.4	43%	0.43	59%	0.59	S	S	.	*	H	α-helix	trans	-74.5	-42.4	-177	-151.9	-117.9	176.6	0	0	111.9	E57 H59 K63 K64 K65	E57-E61 WeakPolarHBondContact O-CB 3.49Å; E57-E61 PolarHBondContact O-N 3.29Å; H59-E61 VanDerWaalsContact C-N 3.29Å; H59-E61 PolarHBondContact O-N 2.82Å; E61-K63 VanDerWaalsContact C-N 3.33Å; E61-K63 PolarHBondContact O-N 3.2Å; E61-K64 PolarHBondContact O-N 2.78Å; E61-K65 VanDerWaalsContact CD-CE 3.49Å; E61-K65 WeakPolarHBondContact O-CB 3.43Å; E61-K65 WeakPolarHBondContact O-CG 3.46Å; E61-K65 PolarHBondContact O-N 2.69Å; E61-K65 WeakPolarHBondContact OE1-CE 3.41Å; E61-K65 IonicContact OE1-NZ 3.23Å; E61-K65 PolarHBondContact OE1-NZ 2.91Å; E61-K65 WeakPolarHBondContact OE2-CE 3.37Å; E61-K65 IonicContact OE2-NZ 2.66Å; E61-K65 PolarHBondContact OE2-NZ 3Å
62	K	69.8	Low	64.4	Low	126 Å²	126	127.1 Å²	127.1	55%	0.548	58%	0.577	S	S	.	*	H	α-helix	trans	-56.7	-44	166.7	-77.4	167.3	-178.6	175.1	0	111.1	R58 K65 K66	R58-K62 VanDerWaalsContact O-CB 3.22Å; R58-K62 WeakPolarHBondContact O-CB 3.37Å; R58-K62 WeakPolarHBondContact O-CD 3.32Å; R58-K62 WeakPolarHBondContact O-CG 2.76Å; R58-K62 PolarHBondContact O-N 2.83Å; K62-K65 PolarHBondContact O-N 3.48Å; K62-K66 WeakPolarHBondContact O-CB 3.46Å; K62-K66 PolarHBondContact O-N 3.31Å
63	K	72.3	Confident	65.6	Low	162 Å²	162	126.7 Å²	126.7	70%	0.704	57%	0.568	S	S	*	*	H	α-helix	trans	-67.2	-38.7	177.6	-166.2	169.3	-176.7	174.9	0	111.9	H59 K60 E61 K66 K67	H59-K63 VanDerWaalsContact O-CB 3.23Å; H59-K63 WeakPolarHBondContact O-CB 3.44Å; H59-K63 PolarHBondContact O-N 2.65Å; K60-K63 PolarHBondContact O-N 2.68Å; E61-K63 VanDerWaalsContact C-N 3.33Å; E61-K63 PolarHBondContact O-N 3.2Å; K63-K66 PolarHBondContact O-N 3.38Å; K63-K67 WeakPolarHBondContact O-CB 3.4Å; K63-K67 PolarHBondContact O-N 3.38Å
64	K	72.9	Confident	66.8	Low	165 Å²	165	128.9 Å²	128.9	72%	0.717	57%	0.573	S	S	*	*	H	α-helix	trans	-68.2	-41.4	174.9	-164.6	172.5	-175.8	178	0	111.9	K60 E61 K68	K60-K64 VanDerWaalsContact O-CB 3.3Å; K60-K64 WeakPolarHBondContact O-CB 3.33Å; K60-K64 PolarHBondContact O-N 3.37Å; E61-K64 PolarHBondContact O-N 2.78Å; K64-K68 VanDerWaalsContact O-CB 3.32Å; K64-K68 WeakPolarHBondContact O-CB 3.37Å; K64-K68 PolarHBondContact O-N 2.81Å
65	K	74.1	Confident	67.9	Low	127 Å²	127	128.5 Å²	128.5	55%	0.552	58%	0.575	S	S	*	*	H	α-helix	trans	-64.4	-42.3	171.3	-79.6	171.4	172.5	159.4	0	111.9	E61 K62 K69	E61-K65 VanDerWaalsContact CD-CE 3.49Å; E61-K65 WeakPolarHBondContact O-CB 3.43Å; E61-K65 WeakPolarHBondContact O-CG 3.46Å; E61-K65 PolarHBondContact O-N 2.69Å; E61-K65 WeakPolarHBondContact OE1-CE 3.41Å; E61-K65 IonicContact OE1-NZ 3.23Å; E61-K65 PolarHBondContact OE1-NZ 2.91Å; E61-K65 WeakPolarHBondContact OE2-CE 3.37Å; E61-K65 IonicContact OE2-NZ 2.66Å; E61-K65 PolarHBondContact OE2-NZ 3Å; K62-K65 PolarHBondContact O-N 3.48Å; K65-K69 WeakPolarHBondContact O-CB 3.38Å; K65-K69 PolarHBondContact O-N 2.84Å
66	K	72.1	Confident	69.1	Low	172 Å²	172	128.3 Å²	128.3	75%	0.748	57%	0.572	S	S	*	*	H	α-helix	trans	-64.5	-44.7	175.4	-167.3	174.5	-177.8	179.9	0	111.4	K62 K63 K69 S70	K62-K66 WeakPolarHBondContact O-CB 3.46Å; K62-K66 PolarHBondContact O-N 3.31Å; K63-K66 PolarHBondContact O-N 3.38Å; K66-K69 PolarHBondContact O-N 3.36Å; K66-S70 PolarHBondContact O-N 2.75Å; K66-S70 PolarHBondContact O-OG 2.99Å
67	K	76.2	Confident	70	Confident	133 Å²	133	128.5 Å²	128.5	58%	0.578	57%	0.573	S	S	*	*	H	α-helix	trans	-59.1	-55.1	173.4	-175	177.5	175.2	-176.4	0	111	K63 K69 S70 E71	K63-K67 WeakPolarHBondContact O-CB 3.4Å; K63-K67 PolarHBondContact O-N 3.38Å; K67-K69 PolarHBondContact O-N 3.45Å; K67-S70 WeakPolarHBondContact CA-OG 3.47Å; K67-S70 CarbonylContact O-C 3.45Å; K67-S70 PolarHBondContact O-N 3.03Å; K67-S70 PolarHBondContact O-OG 3.01Å; K67-E71 VanDerWaalsContact O-CB 3.31Å; K67-E71 WeakPolarHBondContact O-CB 3.35Å; K67-E71 PolarHBondContact O-N 2.92Å
68	K	77.4	Confident	70.8	Confident	152 Å²	152	127.2 Å²	127.2	66%	0.661	57%	0.573	S	S	*	*	H	α-helix	trans	-61.1	-28.1	-179.3	-168.1	169.1	-173.7	173.1	0	113.1	K64 K72	K64-K68 VanDerWaalsContact O-CB 3.32Å; K64-K68 WeakPolarHBondContact O-CB 3.37Å; K64-K68 PolarHBondContact O-N 2.81Å; K68-K72 VanDerWaalsContact O-CB 3.32Å; K68-K72 WeakPolarHBondContact O-CB 3.32Å; K68-K72 PolarHBondContact O-N 3.22Å; K68-K72 VanDerWaalsContact O-N 3.09Å
69	K	70.3	Confident	71.8	Confident	137 Å²	137	124.6 Å²	124.6	60%	0.596	57%	0.571	S	S	*	*	H	α-helix	trans	-69.8	-52.1	168.8	-177.4	173.8	177.5	-174.6	0	111.5	K65 K66 K67 E71 K72 D73	K65-K69 WeakPolarHBondContact O-CB 3.38Å; K65-K69 PolarHBondContact O-N 2.84Å; K66-K69 PolarHBondContact O-N 3.36Å; K67-K69 PolarHBondContact O-N 3.45Å; K69-E71 PolarHBondContact O-N 3.19Å; K69-K72 PolarHBondContact O-N 2.98Å; K69-D73 WeakPolarHBondContact CE-OD2 3.38Å; K69-D73 VanDerWaalsContact CG-OD2 3.28Å; K69-D73 WeakPolarHBondContact CG-OD2 3.38Å; K69-D73 WeakPolarHBondContact O-CB 3.43Å; K69-D73 VanDerWaalsContact O-CG 3.31Å; K69-D73 PolarHBondContact O-N 3.33Å
70	S	67.8	Low	72.5	Confident	62 Å²	62	123.4 Å²	123.4	43%	0.434	57%	0.566	S	S	.	*	H	α-helix	trans	-62.3	-27.2	178.1	56.8	0	0	0	0	114	K66 K67 K74	K66-S70 PolarHBondContact O-N 2.75Å; K66-S70 PolarHBondContact O-OG 2.99Å; K67-S70 WeakPolarHBondContact CA-OG 3.47Å; K67-S70 CarbonylContact O-C 3.45Å; K67-S70 PolarHBondContact O-N 3.03Å; K67-S70 PolarHBondContact O-OG 3.01Å; S70-K74 WeakPolarHBondContact O-CB 3.27Å; S70-K74 VanDerWaalsContact O-CG 3.3Å; S70-K74 WeakPolarHBondContact O-CG 3.43Å; S70-K74 PolarHBondContact O-N 2.87Å; S70-K74 VanDerWaalsContact O-N 3.11Å
71	E	73.7	Confident	73.3	Confident	87 Å²	87	120.8 Å²	120.8	41%	0.407	56%	0.555	S	S	.	*	H	α-helix	trans	-70.6	-53.8	173.5	-160.1	158.7	-124	0	0	109.4	K67 K69 D73 K74 D75	K67-E71 VanDerWaalsContact O-CB 3.31Å; K67-E71 WeakPolarHBondContact O-CB 3.35Å; K67-E71 PolarHBondContact O-N 2.92Å; K69-E71 PolarHBondContact O-N 3.19Å; E71-D73 VanDerWaalsContact C-N 3.3Å; E71-D73 PolarHBondContact O-N 3.36Å; E71-K74 WeakPolarHBondContact O-CA 3.3Å; E71-K74 WeakPolarHBondContact O-CB 3.09Å; E71-K74 PolarHBondContact O-N 3.47Å; E71-D75 VanDerWaalsContact O-CG 3.29Å; E71-D75 PolarHBondContact O-N 2.82Å
72	K	71.3	Confident	73.8	Confident	139 Å²	139	119.8 Å²	119.8	60%	0.604	55%	0.553	S	S	*	*	H	α-helix	trans	-61.3	-32.9	175.3	-175.7	167.9	-175.6	169.6	0	114.4	K68 K69 K76	K68-K72 VanDerWaalsContact O-CB 3.32Å; K68-K72 WeakPolarHBondContact O-CB 3.32Å; K68-K72 PolarHBondContact O-N 3.22Å; K68-K72 VanDerWaalsContact O-N 3.09Å; K69-K72 PolarHBondContact O-N 2.98Å; K72-K76 WeakPolarHBondContact O-CG 3.4Å; K72-K76 PolarHBondContact O-N 3Å
73	D	71.9	Confident	74.1	Confident	75 Å²	75	121.7 Å²	121.7	40%	0.401	56%	0.557	S	S	.	*	H	α-helix	trans	-76.5	-26.7	176.2	-68.2	-24	0	0	0	111.3	K69 E71 Y77	K69-D73 WeakPolarHBondContact CE-OD2 3.38Å; K69-D73 VanDerWaalsContact CG-OD2 3.28Å; K69-D73 WeakPolarHBondContact CG-OD2 3.38Å; K69-D73 WeakPolarHBondContact O-CB 3.43Å; K69-D73 VanDerWaalsContact O-CG 3.31Å; K69-D73 PolarHBondContact O-N 3.33Å; E71-D73 VanDerWaalsContact C-N 3.3Å; E71-D73 PolarHBondContact O-N 3.36Å; D73-Y77 PolarHBondContact O-N 2.93Å
74	K	73.3	Confident	74.5	Confident	150 Å²	150	121.4 Å²	121.4	65%	0.652	55%	0.551	S	S	*	*	H	α-helix	trans	-72.7	-46.3	167.5	-81.1	-178.7	175.9	-163.3	0	112.3	S70 E71 K76 Y77 V78	S70-K74 WeakPolarHBondContact O-CB 3.27Å; S70-K74 VanDerWaalsContact O-CG 3.3Å; S70-K74 WeakPolarHBondContact O-CG 3.43Å; S70-K74 PolarHBondContact O-N 2.87Å; S70-K74 VanDerWaalsContact O-N 3.11Å; E71-K74 WeakPolarHBondContact O-CA 3.3Å; E71-K74 WeakPolarHBondContact O-CB 3.09Å; E71-K74 PolarHBondContact O-N 3.47Å; K74-K76 PolarHBondContact O-N 3.32Å; K74-Y77 WeakPolarHBondContact O-CA 3.48Å; K74-Y77 WeakPolarHBondContact O-CB 3.46Å; K74-Y77 PolarHBondContact O-N 2.66Å; K74-V78 PolarHBondContact O-N 3.12Å
75	D	75.5	Confident	74.8	Confident	104 Å²	104	120.4 Å²	120.4	56%	0.556	54%	0.543	S	S	*	.	H	α-helix	trans	-56.7	-40.1	177.9	-61.7	-24.4	0	0	0	111.2	E71 V78 D79	E71-D75 VanDerWaalsContact O-CG 3.29Å; E71-D75 PolarHBondContact O-N 2.82Å; D75-V78 PolarHBondContact O-N 2.77Å; D75-D79 PolarHBondContact O-N 3.21Å
76	K	74.1	Confident	75.1	Confident	132 Å²	132	122.2 Å²	122.2	57%	0.574	55%	0.546	S	S	*	.	H	α-helix	trans	-60.9	-42.1	171.7	-85.1	-176.4	163.9	-162.7	0	113.7	K72 K74 V78 E80	K72-K76 WeakPolarHBondContact O-CG 3.4Å; K72-K76 PolarHBondContact O-N 3Å; K74-K76 PolarHBondContact O-N 3.32Å; K76-V78 VanDerWaalsContact C-N 3.33Å; K76-E80 PolarHBondContact O-N 3.42Å
77	Y	72.4	Confident	75.5	Confident	164 Å²	164	121.2 Å²	121.2	64%	0.643	54%	0.542	S	S	*	.	H	α-helix	trans	-65.3	-40.9	178.6	-172.2	-86.5	0	0	0	110.7	D73 K74 E80 E81	D73-Y77 PolarHBondContact O-N 2.93Å; K74-Y77 WeakPolarHBondContact O-CA 3.48Å; K74-Y77 WeakPolarHBondContact O-CB 3.46Å; K74-Y77 PolarHBondContact O-N 2.66Å; Y77-E80 PolarHBondContact O-N 3.39Å; Y77-E81 WeakPolarHBondContact O-CB 3.3Å; Y77-E81 PolarHBondContact O-N 3.23Å
78	V	73.8	Confident	75.8	Confident	83 Å²	83	120.7 Å²	120.7	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-65.1	-45.3	176.1	177.3	0	0	0	0	111.6	K74 D75 K76 E80 E81 D82	K74-V78 PolarHBondContact O-N 3.12Å; D75-V78 PolarHBondContact O-N 2.77Å; K76-V78 VanDerWaalsContact C-N 3.33Å; V78-E80 VanDerWaalsContact C-N 3.32Å; V78-E80 PolarHBondContact O-N 2.92Å; V78-E81 PolarHBondContact O-N 2.94Å; V78-D82 PolarHBondContact O-N 3.43Å
79	D	75.7	Confident	76.2	Confident	104 Å²	104	120 Å²	120	56%	0.556	54%	0.54	S	S	*	.	H	α-helix	trans	-61.8	-38.3	174.6	-179.5	63.6	0	0	0	112.1	D75 R83	D75-D79 PolarHBondContact O-N 3.21Å; D79-R83 WeakPolarHBondContact O-CB 3.39Å; D79-R83 PolarHBondContact O-N 3.35Å
80	E	76.6	Confident	76.8	Confident	102 Å²	102	120.7 Å²	120.7	48%	0.477	54%	0.544	S	S	.	.	H	α-helix	trans	-70.3	-36.2	175.3	-156.7	-175	134.9	0	0	112.4	K76 Y77 V78 R83 R84	K76-E80 PolarHBondContact O-N 3.42Å; Y77-E80 PolarHBondContact O-N 3.39Å; V78-E80 VanDerWaalsContact C-N 3.32Å; V78-E80 PolarHBondContact O-N 2.92Å; E80-R83 PolarHBondContact O-N 3.41Å; E80-R84 VanDerWaalsContact O-CG 3.27Å; E80-R84 WeakPolarHBondContact O-CG 3.38Å; E80-R84 PolarHBondContact O-N 2.96Å; E80-R84 IonicContact OE1-CZ 3.85Å; E80-R84 IonicContact OE1-NE 3.64Å; E80-R84 PolarHBondContact OE1-NE 3.23Å; E80-R84 IonicContact OE1-NH2 3.18Å; E80-R84 PolarHBondContact OE1-NH2 2.86Å
81	E	79.9	Confident	77.6	Confident	68 Å²	68	124.8 Å²	124.8	32%	0.318	55%	0.55	S	S	.	.	H	α-helix	trans	-67.5	-47.6	175.4	-160.2	-170	143.8	0	0	111.7	Y77 V78 R83 R84 R85	Y77-E81 WeakPolarHBondContact O-CB 3.3Å; Y77-E81 PolarHBondContact O-N 3.23Å; V78-E81 PolarHBondContact O-N 2.94Å; E81-R83 PolarHBondContact O-N 2.87Å; E81-R84 CarbonylContact O-C 3.6Å; E81-R84 WeakPolarHBondContact O-CA 3.39Å; E81-R84 WeakPolarHBondContact O-CB 3.45Å; E81-R84 PolarHBondContact O-N 2.99Å; E81-R85 WeakPolarHBondContact O-CG 3.43Å; E81-R85 PolarHBondContact O-N 2.97Å; E81-R85 IonicContact OE1-CZ 2.65Å; E81-R85 IonicContact OE1-NE 2.99Å; E81-R85 PolarHBondContact OE1-NE 2.84Å; E81-R85 IonicContact OE1-NH2 2.68Å; E81-R85 PolarHBondContact OE1-NH2 2.79Å
82	D	79.3	Confident	78.1	Confident	72 Å²	72	127.7 Å²	127.7	39%	0.385	56%	0.561	S	S	.	*	H	α-helix	trans	-61.7	-34.1	174.1	-97.6	-1.9	0	0	0	111.8	V78 R84 R85 R86	V78-D82 PolarHBondContact O-N 3.43Å; D82-R84 VanDerWaalsContact C-N 3.34Å; D82-R85 PolarHBondContact O-N 3.4Å; D82-R86 WeakPolarHBondContact O-CB 3.4Å; D82-R86 VanDerWaalsContact O-CG 3.3Å; D82-R86 WeakPolarHBondContact O-CG 3.32Å; D82-R86 PolarHBondContact O-N 2.69Å
83	R	76.4	Confident	78.7	Confident	165 Å²	165	127.2 Å²	127.2	62%	0.623	56%	0.559	S	S	*	*	H	α-helix	trans	-70.8	-26.7	173	-172.3	171.8	-175.5	155.3	-0.6	113.1	D79 E80 E81 K87	D79-R83 WeakPolarHBondContact O-CB 3.39Å; D79-R83 PolarHBondContact O-N 3.35Å; E80-R83 PolarHBondContact O-N 3.41Å; E81-R83 PolarHBondContact O-N 2.87Å; R83-K87 WeakPolarHBondContact O-CG 3.32Å; R83-K87 PolarHBondContact O-N 3.33Å
84	R	79.1	Confident	79	Confident	157 Å²	157	132.3 Å²	132.3	59%	0.592	57%	0.572	S	S	*	*	H	α-helix	trans	-74	-49.7	168.8	-71.5	166	-175.3	-137.2	5.2	110.4	E80 E81 D82 R86 K87 E88	E80-R84 VanDerWaalsContact O-CG 3.27Å; E80-R84 WeakPolarHBondContact O-CG 3.38Å; E80-R84 PolarHBondContact O-N 2.96Å; E80-R84 IonicContact OE1-CZ 3.85Å; E80-R84 IonicContact OE1-NE 3.64Å; E80-R84 PolarHBondContact OE1-NE 3.23Å; E80-R84 IonicContact OE1-NH2 3.18Å; E80-R84 PolarHBondContact OE1-NH2 2.86Å; E81-R84 CarbonylContact O-C 3.6Å; E81-R84 WeakPolarHBondContact O-CA 3.39Å; E81-R84 WeakPolarHBondContact O-CB 3.45Å; E81-R84 PolarHBondContact O-N 2.99Å; D82-R84 VanDerWaalsContact C-N 3.34Å; R84-R86 PolarHBondContact O-N 2.95Å; R84-K87 WeakPolarHBondContact O-CA 3.31Å; R84-K87 WeakPolarHBondContact O-CB 3.45Å; R84-K87 PolarHBondContact O-N 3.27Å; R84-E88 PolarHBondContact O-N 3.18Å
85	R	80.6	Confident	79.2	Confident	144 Å²	144	128.5 Å²	128.5	54%	0.543	56%	0.557	S	S	.	*	H	α-helix	trans	-53.7	-48.3	175.5	-67.9	170.4	177	-137.9	2.1	111.7	E81 D82 K87 E88 E89	E81-R85 WeakPolarHBondContact O-CG 3.43Å; E81-R85 PolarHBondContact O-N 2.97Å; E81-R85 IonicContact OE1-CZ 2.65Å; E81-R85 IonicContact OE1-NE 2.99Å; E81-R85 PolarHBondContact OE1-NE 2.84Å; E81-R85 IonicContact OE1-NH2 2.68Å; E81-R85 PolarHBondContact OE1-NH2 2.79Å; D82-R85 PolarHBondContact O-N 3.4Å; R85-K87 VanDerWaalsContact C-N 3.32Å; R85-K87 PolarHBondContact O-N 3.46Å; R85-E88 PolarHBondContact O-N 2.87Å; R85-E89 WeakPolarHBondContact O-CB 3.48Å; R85-E89 PolarHBondContact O-N 3.02Å
86	R	79.1	Confident	79.3	Confident	165 Å²	165	132.4 Å²	132.4	62%	0.623	56%	0.564	S	S	*	*	H	α-helix	trans	-67	-23.8	175.5	-72.9	174.6	175.9	170.8	2.5	114.7	D82 R84 K90	D82-R86 WeakPolarHBondContact O-CB 3.4Å; D82-R86 VanDerWaalsContact O-CG 3.3Å; D82-R86 WeakPolarHBondContact O-CG 3.32Å; D82-R86 PolarHBondContact O-N 2.69Å; R84-R86 PolarHBondContact O-N 2.95Å; R86-K90 WeakPolarHBondContact O-CB 3.37Å; R86-K90 WeakPolarHBondContact O-CG 3.43Å; R86-K90 PolarHBondContact O-N 2.89Å
87	K	81.9	Confident	79.3	Confident	150 Å²	150	130.8 Å²	130.8	65%	0.652	56%	0.558	S	S	*	*	H	α-helix	trans	-75.2	-44	170.6	-86.6	178.6	172.3	-174.8	0	110.7	R83 R84 R85 K90 R91	R83-K87 WeakPolarHBondContact O-CG 3.32Å; R83-K87 PolarHBondContact O-N 3.33Å; R84-K87 WeakPolarHBondContact O-CA 3.31Å; R84-K87 WeakPolarHBondContact O-CB 3.45Å; R84-K87 PolarHBondContact O-N 3.27Å; R85-K87 VanDerWaalsContact C-N 3.32Å; R85-K87 PolarHBondContact O-N 3.46Å; K87-K90 CarbonylContact O-C 3.58Å; K87-K90 PolarHBondContact O-N 2.68Å; K87-R91 PolarHBondContact O-N 2.74Å
88	E	82.8	Confident	79.2	Confident	122 Å²	122	128.2 Å²	128.2	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-68.6	-42.7	-179.3	-175	158.6	-147.4	0	0	111.9	R84 R85 K90 R91 K92	R84-E88 PolarHBondContact O-N 3.18Å; R85-E88 PolarHBondContact O-N 2.87Å; E88-K90 VanDerWaalsContact C-N 3.3Å; E88-K90 PolarHBondContact O-N 3.04Å; E88-R91 CarbonylContact O-C 3.43Å; E88-R91 WeakPolarHBondContact O-CA 3.24Å; E88-R91 WeakPolarHBondContact O-CB 3.47Å; E88-R91 PolarHBondContact O-N 2.8Å; E88-K92 WeakPolarHBondContact O-CB 3.46Å; E88-K92 PolarHBondContact O-N 3.11Å
89	E	84.8	Confident	78.9	Confident	137 Å²	137	129.1 Å²	129.1	64%	0.64	55%	0.554	S	S	*	*	H	α-helix	trans	-57.1	-42.4	170.1	-174.1	-175.4	-159.9	0	0	111.6	R85 R91 K92 K93	R85-E89 WeakPolarHBondContact O-CB 3.48Å; R85-E89 PolarHBondContact O-N 3.02Å; E89-R91 VanDerWaalsContact C-N 3.34Å; E89-R91 PolarHBondContact O-N 3.3Å; E89-K92 PolarHBondContact O-N 3.11Å; E89-K93 VanDerWaalsContact O-CB 3.32Å; E89-K93 WeakPolarHBondContact O-CB 3.46Å; E89-K93 PolarHBondContact O-N 2.82Å
90	K	83.7	Confident	78.6	Confident	153 Å²	153	130.4 Å²	130.4	67%	0.665	56%	0.557	S	S	*	*	H	α-helix	trans	-68.1	-28.3	173.1	-81.6	-174.1	174.9	-175.8	0	113.9	R86 K87 E88 R94	R86-K90 WeakPolarHBondContact O-CB 3.37Å; R86-K90 WeakPolarHBondContact O-CG 3.43Å; R86-K90 PolarHBondContact O-N 2.89Å; K87-K90 CarbonylContact O-C 3.58Å; K87-K90 PolarHBondContact O-N 2.68Å; E88-K90 VanDerWaalsContact C-N 3.3Å; E88-K90 PolarHBondContact O-N 3.04Å; K90-R94 WeakPolarHBondContact O-CG 3.35Å; K90-R94 PolarHBondContact O-N 3.28Å
91	R	84.2	Confident	78.1	Confident	148 Å²	148	128.9 Å²	128.9	56%	0.558	56%	0.557	S	S	*	*	H	α-helix	trans	-70.7	-50.8	172.8	-148.7	-168.3	84.1	-157.8	0.5	109.6	K87 E88 E89 K93 R94 E95	K87-R91 PolarHBondContact O-N 2.74Å; E88-R91 CarbonylContact O-C 3.43Å; E88-R91 WeakPolarHBondContact O-CA 3.24Å; E88-R91 WeakPolarHBondContact O-CB 3.47Å; E88-R91 PolarHBondContact O-N 2.8Å; E89-R91 VanDerWaalsContact C-N 3.34Å; E89-R91 PolarHBondContact O-N 3.3Å; R91-K93 VanDerWaalsContact C-N 3.32Å; R91-K93 PolarHBondContact O-N 3.04Å; R91-R94 WeakPolarHBondContact O-CB 3.3Å; R91-R94 PolarHBondContact O-N 3.21Å; R91-E95 IonicContact CZ-OE1 3.65Å; R91-E95 IonicContact NE-OE1 3.11Å; R91-E95 PolarHBondContact NE-OE1 3.25Å; R91-E95 IonicContact NH2-OE1 3.69Å; R91-E95 PolarHBondContact NH2-OE1 2.83Å; R91-E95 IonicContact NH2-OE2 3.09Å; R91-E95 WeakPolarHBondContact O-CG 3.18Å; R91-E95 PolarHBondContact O-N 3.09Å
92	K	84.6	Confident	77.1	Confident	147 Å²	147	131.2 Å²	131.2	64%	0.639	57%	0.568	S	S	*	*	H	α-helix	trans	-63.7	-32.7	179	-163.1	168	-172.6	170.6	0	113.4	E88 E89 E95 R96	E88-K92 WeakPolarHBondContact O-CB 3.46Å; E88-K92 PolarHBondContact O-N 3.11Å; E89-K92 PolarHBondContact O-N 3.11Å; K92-E95 WeakPolarHBondContact CA-OE2 3.36Å; K92-R96 WeakPolarHBondContact O-CB 3.36Å; K92-R96 PolarHBondContact O-N 2.75Å
93	K	84.1	Confident	76.1	Confident	130 Å²	130	130.9 Å²	130.9	57%	0.565	58%	0.576	S	S	*	*	H	α-helix	trans	-65.9	-43.7	170.1	177.1	160.4	175.2	161.8	0	111.8	E89 R91 R96 E97	E89-K93 VanDerWaalsContact O-CB 3.32Å; E89-K93 WeakPolarHBondContact O-CB 3.46Å; E89-K93 PolarHBondContact O-N 2.82Å; R91-K93 VanDerWaalsContact C-N 3.32Å; R91-K93 PolarHBondContact O-N 3.04Å; K93-R96 PolarHBondContact O-N 3.21Å; K93-E97 WeakPolarHBondContact CE-OE1 3.28Å; K93-E97 HydrophobicContact CG-CG 4.34Å; K93-E97 IonicContact NZ-OE1 3.55Å; K93-E97 WeakPolarHBondContact O-CB 3.46Å; K93-E97 VanDerWaalsContact O-CG 3.31Å; K93-E97 WeakPolarHBondContact O-CG 3.06Å; K93-E97 PolarHBondContact O-N 3.2Å
94	R	76.7	Confident	75.1	Confident	182 Å²	182	126.6 Å²	126.6	69%	0.687	58%	0.576	S	S	*	*	H	α-helix	trans	-66	-40.6	175.6	-73.9	171.2	171.4	-164	-5.3	112.7	K90 R91 R96 E97 Q98	K90-R94 WeakPolarHBondContact O-CG 3.35Å; K90-R94 PolarHBondContact O-N 3.28Å; R91-R94 WeakPolarHBondContact O-CB 3.3Å; R91-R94 PolarHBondContact O-N 3.21Å; R94-R96 VanDerWaalsContact C-N 3.28Å; R94-R96 PolarHBondContact O-N 3.01Å; R94-E97 PolarHBondContact O-N 2.89Å; R94-Q98 VanDerWaalsContact O-CB 3.25Å; R94-Q98 WeakPolarHBondContact O-CB 3.38Å; R94-Q98 PolarHBondContact O-N 3.49Å
95	E	78.4	Confident	73.9	Confident	69 Å²	69	123 Å²	123	32%	0.322	58%	0.58	S	S	.	*	H	α-helix	trans	-58.7	-42	172.3	-70.1	162.8	-179.6	0	0	110.6	R91 K92 Q98 N99	R91-E95 IonicContact CZ-OE1 3.65Å; R91-E95 IonicContact NE-OE1 3.11Å; R91-E95 PolarHBondContact NE-OE1 3.25Å; R91-E95 IonicContact NH2-OE1 3.69Å; R91-E95 PolarHBondContact NH2-OE1 2.83Å; R91-E95 IonicContact NH2-OE2 3.09Å; R91-E95 WeakPolarHBondContact O-CG 3.18Å; R91-E95 PolarHBondContact O-N 3.09Å; K92-E95 WeakPolarHBondContact CA-OE2 3.36Å; E95-Q98 PolarHBondContact O-N 2.83Å; E95-N99 WeakPolarHBondContact O-CB 3.33Å; E95-N99 PolarHBondContact O-N 3.44Å; E95-N99 PolarHBondContact O-OD1 3.19Å; E95-N99 VanDerWaalsContact O-OD1 3.08Å
96	R	77	Confident	72.5	Confident	187 Å²	187	120.2 Å²	120.2	71%	0.706	59%	0.587	S	S	*	*	H	α-helix	trans	-67.3	-45.9	175.5	-165.6	175.2	-173.1	172.2	3.4	112.8	K92 K93 R94 Q98 N99 E100	K92-R96 WeakPolarHBondContact O-CB 3.36Å; K92-R96 PolarHBondContact O-N 2.75Å; K93-R96 PolarHBondContact O-N 3.21Å; R94-R96 VanDerWaalsContact C-N 3.28Å; R94-R96 PolarHBondContact O-N 3.01Å; R96-Q98 VanDerWaalsContact C-N 3.28Å; R96-Q98 PolarHBondContact O-N 2.96Å; R96-N99 PolarHBondContact O-N 3.36Å; R96-E100 WeakPolarHBondContact O-CB 3.23Å; R96-E100 PolarHBondContact O-N 3.05Å
97	E	74.8	Confident	70.8	Confident	97 Å²	97	115.6 Å²	115.6	45%	0.453	59%	0.591	S	S	.	*	H	α-helix	trans	-61.2	-36.8	175.9	-72.5	167.9	159.7	0	0	111.6	K93 R94 S101	K93-E97 WeakPolarHBondContact CE-OE1 3.28Å; K93-E97 HydrophobicContact CG-CG 4.34Å; K93-E97 IonicContact NZ-OE1 3.55Å; K93-E97 WeakPolarHBondContact O-CB 3.46Å; K93-E97 VanDerWaalsContact O-CG 3.31Å; K93-E97 WeakPolarHBondContact O-CG 3.06Å; K93-E97 PolarHBondContact O-N 3.2Å; R94-E97 PolarHBondContact O-N 2.89Å; E97-S101 WeakPolarHBondContact O-CB 3.3Å; E97-S101 PolarHBondContact O-N 3.46Å; E97-S101 PolarHBondContact O-OG 2.82Å
98	Q	70.8	Confident	69	Low	111 Å²	111	113 Å²	113	52%	0.519	60%	0.597	S	S	.	*	H	α-helix	trans	-67.5	-51.9	175	-176.5	171.3	-17.9	0	0	111.2	R94 E95 R96 E100 S101 E102	R94-Q98 VanDerWaalsContact O-CB 3.25Å; R94-Q98 WeakPolarHBondContact O-CB 3.38Å; R94-Q98 PolarHBondContact O-N 3.49Å; E95-Q98 PolarHBondContact O-N 2.83Å; R96-Q98 VanDerWaalsContact C-N 3.28Å; R96-Q98 PolarHBondContact O-N 2.96Å; Q98-E100 VanDerWaalsContact C-N 3.26Å; Q98-E100 PolarHBondContact O-N 3.44Å; Q98-S101 PolarHBondContact O-N 2.88Å; Q98-S101 VanDerWaalsContact O-N 3.07Å; Q98-S101 PolarHBondContact O-OG 2.67Å; Q98-E102 PolarHBondContact O-N 2.84Å
99	N	66.1	Low	66.6	Low	102 Å²	102	111.7 Å²	111.7	55%	0.545	61%	0.608	S	S	.	*	H	α-helix	trans	-60.9	-35	177.7	-66.6	8.4	0	0	0	112.4	E95 R96 E102 A103	E95-N99 WeakPolarHBondContact O-CB 3.33Å; E95-N99 PolarHBondContact O-N 3.44Å; E95-N99 PolarHBondContact O-OD1 3.19Å; E95-N99 VanDerWaalsContact O-OD1 3.08Å; R96-N99 PolarHBondContact O-N 3.36Å; N99-E102 PolarHBondContact O-N 2.92Å; N99-A103 WeakPolarHBondContact O-CB 3.22Å; N99-A103 PolarHBondContact O-N 3.17Å
100	E	70.1	Confident	64	Low	130 Å²	130	108.5 Å²	108.5	61%	0.607	61%	0.611	S	S	*	*	H	α-helix	trans	-69.9	-34.9	175.9	-169.4	161.1	-143.6	0	0	111.6	R96 Q98 A104	R96-E100 WeakPolarHBondContact O-CB 3.23Å; R96-E100 PolarHBondContact O-N 3.05Å; Q98-E100 VanDerWaalsContact C-N 3.26Å; Q98-E100 PolarHBondContact O-N 3.44Å; E100-A104 WeakPolarHBondContact O-CB 3.34Å; E100-A104 PolarHBondContact O-N 2.87Å
101	S	65.4	Low	61.6	Low	70 Å²	70	108.1 Å²	108.1	49%	0.49	62%	0.622	S	S	.	*	H	α-helix	trans	-72.5	-33.3	171.8	72.6	0	0	0	0	113.8	E97 Q98 A104 A105	E97-S101 WeakPolarHBondContact O-CB 3.3Å; E97-S101 PolarHBondContact O-N 3.46Å; E97-S101 PolarHBondContact O-OG 2.82Å; Q98-S101 PolarHBondContact O-N 2.88Å; Q98-S101 VanDerWaalsContact O-N 3.07Å; Q98-S101 PolarHBondContact O-OG 2.67Å; S101-A104 PolarHBondContact O-N 2.9Å; S101-A105 WeakPolarHBondContact O-CB 3.24Å; S101-A105 PolarHBondContact O-N 3.07Å
102	E	58.3	Low	59.2	Low	118 Å²	118	105.2 Å²	105.2	55%	0.551	63%	0.63	S	S	*	*	H	α-helix	trans	-70.2	-39.3	172.3	-72.2	-179.1	166.3	0	0	111.4	Q98 N99 A105 A106	Q98-E102 PolarHBondContact O-N 2.84Å; N99-E102 PolarHBondContact O-N 2.92Å; E102-A105 PolarHBondContact O-N 2.74Å; E102-A106 PolarHBondContact O-N 3.1Å; E102-A106 VanDerWaalsContact O-N 3.13Å
103	A	58.3	Low	57.1	Low	65 Å²	65	103.7 Å²	103.7	54%	0.537	64%	0.635	S	S	.	*	H	α-helix	trans	-62.5	-40.9	172.4	0	0	0	0	0	112.2	N99 A105 A106	N99-A103 WeakPolarHBondContact O-CB 3.22Å; N99-A103 PolarHBondContact O-N 3.17Å; A103-A105 VanDerWaalsContact C-N 3.35Å; A103-A106 PolarHBondContact O-N 3.01Å
104	A	56.4	Low	54.5	Low	75 Å²	75	105.3 Å²	105.3	62%	0.62	65%	0.648	S	S	*	*	H	α-helix	trans	-64.7	-37	174.3	0	0	0	0	0	112.5	E100 S101 A106 G107	E100-A104 WeakPolarHBondContact O-CB 3.34Å; E100-A104 PolarHBondContact O-N 2.87Å; S101-A104 PolarHBondContact O-N 2.9Å; A104-A106 VanDerWaalsContact C-N 3.3Å; A104-A106 PolarHBondContact O-N 3.36Å; A104-G107 PolarHBondContact O-N 3.47Å
105	A	53.4	Low	52.3	Low	82 Å²	82	104.3 Å²	104.3	68%	0.678	65%	0.651	S	S	*	*	H	α-helix	trans	-68.1	-26.4	176.5	0	0	0	0	0	113.4	S101 E102 A103	S101-A105 WeakPolarHBondContact O-CB 3.24Å; S101-A105 PolarHBondContact O-N 3.07Å; E102-A105 PolarHBondContact O-N 2.74Å; A103-A105 VanDerWaalsContact C-N 3.35Å
106	A	51.3	Low	50.6	Low	84 Å²	84	105.7 Å²	105.7	69%	0.694	67%	0.666	S	S	*	*	H	α-helix	trans	-78.3	-14.4	177.4	0	0	0	0	0	114.3	E102 A103 A104 A108	E102-A106 PolarHBondContact O-N 3.1Å; E102-A106 VanDerWaalsContact O-N 3.13Å; A103-A106 PolarHBondContact O-N 3.01Å; A104-A106 VanDerWaalsContact C-N 3.3Å; A104-A106 PolarHBondContact O-N 3.36Å; A106-A108 PolarHBondContact O-N 3Å
107	G	44.3	Very low	48.3	Very low	69 Å²	69	105.2 Å²	105.2	71%	0.711	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	2.3	-171.4	0	0	0	0	0	117	A104	A104-G107 PolarHBondContact O-N 3.47Å
108	A	42.5	Very low	46	Very low	94 Å²	94	106.7 Å²	106.7	78%	0.777	69%	0.685	S	S	*	*			trans	-108.8	59	-165.3	0	0	0	0	0	114.5	A106	A106-A108 PolarHBondContact O-N 3Å
109	A	33.6	Very low	44	Very low	96 Å²	96	108.5 Å²	108.5	79%	0.793	70%	0.697	S	S	*	*	S	Bend	trans	-147.1	76.4	178.9	0	0	0	0	0	114.4
110	G	30.3	Very low	42.1	Very low	70 Å²	70	109.2 Å²	109.2	72%	0.722	71%	0.711	S	S	*	*			trans	79.4	154.6	173.4	0	0	0	0	0	115
111	T	32.6	Very low	39.9	Very low	144 Å²	144	108.4 Å²	108.4	88%	0.883	72%	0.718	S	S	*	*			cis	-151	143.3	-3.8	-48.8	0	0	0	0	108.5
112	A	33.9	Very low	38	Very low	87 Å²	87	113 Å²	113	72%	0.719	74%	0.735	S	S	*	*			trans	-77.2	167.4	174.3	0	0	0	0	0	111.2
113	P	41.8	Very low	36.5	Very low	115 Å²	115	110.2 Å²	110.2	75%	0.747	74%	0.739	S	S	*	*				-156.1	-175.5	73	39.5	-16.9	0	0	0	117.6
114	I	29.2	Very low	35	Very low	164 Å²	164	115.6 Å²	115.6	84%	0.841	76%	0.757	S	S	*	*			trans	91.8	110.6	158.5	-57.2	178.4	0	0	0	119.1
115	E	30.3	Very low	33.7	Very low	162 Å²	162	120 Å²	120	76%	0.757	77%	0.765	S	S	*	*			trans	-79.7	173.6	162.1	-94.7	-110.2	172.4	0	0	111.2
116	P	43.3	Very low	33.2	Very low	98 Å²	98	121.1 Å²	121.1	64%	0.636	77%	0.765	S	S	*	*			cis	-154.3	174.4	35	45.5	-24.7	0	0	0	121.6
117	F	27.3	Very low	32	Very low	177 Å²	177	123.6 Å²	123.6	78%	0.776	76%	0.762	S	S	*	*			trans	64.9	155.3	157.6	-81.2	-69.7	0	0	0	117.9
118	T	27.5	Very low	31.3	Very low	128 Å²	128	125.5 Å²	125.5	79%	0.785	75%	0.753	S	S	*	*			cis	-135.8	168.8	11.8	51.9	0	0	0	0	114.8
119	L	28.7	Very low	30.5	Very low	148 Å²	148	127.8 Å²	127.8	78%	0.775	75%	0.751	S	S	*	*			trans	-57	153.3	176	-79.5	67	0	0	0	117.3
120	S	25.5	Very low	30.2	Very low	118 Å²	118	129 Å²	129	83%	0.825	74%	0.738	S	S	*	*				-162.2	154.5	113.9	62.6	0	0	0	0	113.2
121	C	23.8	Very low	30	Very low	113 Å²	113	134 Å²	134	76%	0.764	74%	0.74	S	S	*	*			trans	-86.2	170.7	175.7	-54.8	0	0	0	0	110.5
122	I	26.8	Very low	29.7	Very low	166 Å²	166	135.5 Å²	135.5	85%	0.851	73%	0.734	S	S	*	*				-165.4	151.5	54.2	-67.2	158.1	0	0	0	105.5
123	G	25.9	Very low	29.3	Very low	60 Å²	60	138.6 Å²	138.6	62%	0.619	73%	0.731	S	S	*	*			cis	124	115.4	5.9	0	0	0	0	0	111.7
124	L	26.9	Very low	28.5	Very low	178 Å²	178	140.3 Å²	140.3	93%	0.932	73%	0.73	S	S	*	*			trans	176.1	99	157	-100	171.2	0	0	0	112.4
125	E	28.7	Very low	28.3	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	72%	0.719	S	S	*	*			trans	-89.3	179.8	149.2	-82.6	-75.5	145.9	0	0	107.7
126	P	44	Very low	28	Very low	105 Å²	105	141.9 Å²	141.9	68%	0.682	72%	0.723	S	S	*	*			cis	-136.3	-149.9	20.5	37.2	-11	0	0	0	112.6
127	E	25.9	Very low	27.1	Very low	135 Å²	135	142.2 Å²	142.2	63%	0.631	72%	0.717	S	S	*	*			cis	-160.4	141.9	15	-134.9	-45.8	57.2	0	0	113.2
128	E	28.1	Very low	27	Very low	110 Å²	110	139.6 Å²	139.6	51%	0.514	72%	0.715	S	S	.	*			trans	44.2	179.9	152.6	-95.2	-168	174.6	0	0	122.5	K130	E128-K130 WeakPolarHBondContact OE1-CE 3.09Å; E128-K130 IonicContact OE1-NZ 2.65Å; E128-K130 PolarHBondContact OE1-NZ 2.76Å; E128-K130 IonicContact OE2-NZ 2.57Å; E128-K130 PolarHBondContact OE2-NZ 3.1Å
129	I	27.5	Very low	27	Very low	142 Å²	142	140.9 Å²	140.9	73%	0.728	71%	0.712	S	S	*	*			cis	-137.6	121.7	21.3	-71.9	176.6	0	0	0	113.4
130	K	27.1	Very low	26.7	Very low	122 Å²	122	138.4 Å²	138.4	53%	0.53	70%	0.703	S	S	.	*			trans	37.2	136.8	131.8	-51.1	177	163.1	89.9	0	123.9	E128	E128-K130 WeakPolarHBondContact OE1-CE 3.09Å; E128-K130 IonicContact OE1-NZ 2.65Å; E128-K130 PolarHBondContact OE1-NZ 2.76Å; E128-K130 IonicContact OE2-NZ 2.57Å; E128-K130 PolarHBondContact OE2-NZ 3.1Å
131	K	25.9	Very low	26.9	Very low	173 Å²	173	140.8 Å²	140.8	75%	0.752	70%	0.701	S	S	*	*			trans	71.6	157.6	139.7	-71.2	166.4	-172.7	177.7	0	119.1
132	K	25.8	Very low	27.1	Very low	177 Å²	177	140.4 Å²	140.4	77%	0.77	70%	0.695	S	S	*	*			cis	-162.3	167.8	-24.1	-119.5	-177.2	-179.2	-173.3	0	110.1
133	K	24.6	Very low	27	Very low	151 Å²	151	139.7 Å²	139.7	66%	0.657	69%	0.688	S	S	*	*			trans	24	136.6	133.1	-133.6	-160.3	165.7	-143.9	0	117.3
134	E	25.9	Very low	27.1	Very low	152 Å²	152	143.2 Å²	143.2	71%	0.71	69%	0.689	S	S	*	*			cis	-144	156.9	40	-76.9	163.7	158.9	0	0	110.8
135	R	24.8	Very low	27	Very low	163 Å²	163	142.1 Å²	142.1	62%	0.615	68%	0.677	S	S	*	*			cis	77.3	95.9	36.7	-159.4	-173	-136.6	-74.3	-12	115.1	E137	R135-E137 IonicContact CZ-OE1 3.66Å; R135-E137 IonicContact CZ-OE2 2.75Å; R135-E137 IonicContact NH1-OE2 2.81Å; R135-E137 PolarHBondContact NH1-OE2 2.9Å; R135-E137 IonicContact NH2-OE1 3.06Å; R135-E137 PolarHBondContact NH2-OE1 3.23Å; R135-E137 IonicContact NH2-OE2 3.45Å; R135-E137 PolarHBondContact NH2-OE2 3.37Å
136	F	23.7	Very low	26.9	Very low	195 Å²	195	141.1 Å²	141.1	86%	0.855	67%	0.672	S	S	*	*			trans	-142	126.7	141.5	-146.9	-94.8	0	0	0	109.6	V138	F136-V138 HydrophobicContact CE1-CG2 4.02Å
137	E	25.7	Very low	25.8	Very low	106 Å²	106	141 Å²	141	50%	0.495	67%	0.673	S	S	.	*			trans	-121	140.6	173.5	-68.4	156.3	179.3	0	0	106.7	R135	R135-E137 IonicContact CZ-OE1 3.66Å; R135-E137 IonicContact CZ-OE2 2.75Å; R135-E137 IonicContact NH1-OE2 2.81Å; R135-E137 PolarHBondContact NH1-OE2 2.9Å; R135-E137 IonicContact NH2-OE1 3.06Å; R135-E137 PolarHBondContact NH2-OE1 3.23Å; R135-E137 IonicContact NH2-OE2 3.45Å; R135-E137 PolarHBondContact NH2-OE2 3.37Å
138	V	25.3	Very low	25.8	Very low	122 Å²	122	141.5 Å²	141.5	74%	0.739	69%	0.685	S	S	*	*			trans	-169	104.2	159.9	160.6	0	0	0	0	100.8	F136	F136-V138 HydrophobicContact CE1-CG2 4.02Å
139	E	26.3	Very low	25.6	Very low	154 Å²	154	145.4 Å²	145.4	72%	0.72	70%	0.701	S	S	*	*			cis	61	148.6	49.8	-53.7	-166.2	148.8	0	0	111.5
140	T	23.6	Very low	25.5	Very low	97 Å²	97	144.6 Å²	144.6	60%	0.595	70%	0.702	S	S	*	*			cis	-153.9	151.5	24	-18.6	0	0	0	0	110.5
141	E	28.6	Very low	25.5	Very low	167 Å²	167	147.7 Å²	147.7	78%	0.78	72%	0.718	S	S	*	*			trans	54.3	166.5	131.9	-83	164.6	-158.9	0	0	123.3
142	V	27.4	Very low	25.4	Very low	105 Å²	105	142.7 Å²	142.7	64%	0.636	72%	0.716	S	S	*	*			cis	-129.3	-179.8	-17.3	-137.3	0	0	0	0	107
143	E	25.3	Very low	25.4	Very low	151 Å²	151	144 Å²	144	71%	0.706	72%	0.724	S	S	*	*			cis	-151.8	143.8	43.9	-73.2	-82.9	97.2	0	0	108.2
144	E	28	Very low	25.6	Very low	134 Å²	134	145.6 Å²	145.6	63%	0.626	73%	0.734	S	S	*	*				43.9	135.6	94.4	-62.5	-154.8	159.5	0	0	116.4
145	F	24.2	Very low	26.2	Very low	156 Å²	156	144.2 Å²	144.2	68%	0.684	74%	0.739	S	S	*	*			cis	-158.3	-176.3	5.1	-123.4	-23.8	0	0	0	109.2
146	H	26.6	Very low	26.4	Very low	147 Å²	147	139.8 Å²	139.8	68%	0.681	74%	0.744	S	S	*	*			cis	-145.3	-142.1	7.8	-156.2	64.2	0	0	0	111.7
147	S	22.3	Very low	26.8	Very low	101 Å²	101	138.5 Å²	138.5	71%	0.706	75%	0.746	S	S	*	*			trans	-146	162.2	178	-66.2	0	0	0	0	113.7
148	V	24.7	Very low	27.1	Very low	146 Å²	146	144.1 Å²	144.1	89%	0.885	76%	0.762	S	S	*	*			trans	-175.4	159.4	134.8	141.4	0	0	0	0	111.9
149	K	24.5	Very low	27.7	Very low	193 Å²	193	144.3 Å²	144.3	84%	0.839	77%	0.766	S	S	*	*			trans	-91.7	179.6	-175.1	-56.1	174.8	175.3	178.4	0	112.2
150	V	26.4	Very low	28.1	Very low	124 Å²	124	143.1 Å²	143.1	75%	0.752	77%	0.769	S	S	*	*				-166.7	162	65.5	164.3	0	0	0	0	111.9
151	E	25.8	Very low	28.6	Very low	188 Å²	188	149.9 Å²	149.9	88%	0.879	78%	0.784	S	S	*	*			trans	-33.1	162.8	173	-64.6	148.4	163.9	0	0	119.1
152	G	25.1	Very low	29.1	Very low	68 Å²	68	146 Å²	146	70%	0.701	78%	0.78	S	S	*	*			cis	175.6	-150.4	2.9	0	0	0	0	0	115.5
153	E	23.9	Very low	29.4	Very low	204 Å²	204	146.5 Å²	146.5	95%	0.953	79%	0.787	S	S	*	*			trans	77	141.5	-178.1	-60.6	-152.5	126.1	0	0	120.5
154	Q	30.3	Very low	30	Very low	184 Å²	184	151 Å²	151	86%	0.86	80%	0.798	S	S	*	*			trans	-150	156.4	169.7	-105.9	-164.6	41.1	0	0	105.1
155	P	38.3	Very low	30.5	Very low	124 Å²	124	150.5 Å²	150.5	81%	0.805	80%	0.804	S	S	*	*			cis	-142.3	176.2	41.4	40.8	-22.3	0	0	0	116
156	G	28.3	Very low	31.2	Very low	70 Å²	70	150.7 Å²	150.7	72%	0.722	81%	0.807	S	S	*	*			trans	165.9	86.1	168.7	0	0	0	0	0	115.7
157	D	31.8	Very low	31.7	Very low	168 Å²	168	151.9 Å²	151.9	90%	0.898	81%	0.813	S	S	*	*			trans	46.8	163.8	159.3	-101.1	-53.2	0	0	0	123.1
158	R	33.1	Very low	32.6	Very low	224 Å²	224	154.5 Å²	154.5	85%	0.845	81%	0.814	S	S	*	*			trans	-82.1	155.8	179.8	-63.1	175.9	177.5	168.9	-0.1	111.3
159	P	37.3	Very low	33.9	Very low	126 Å²	126	152.9 Å²	152.9	82%	0.818	80%	0.8	S	S	*	*				-121.2	166.5	101.1	-2.9	22.2	0	0	0	115.3
160	V	34.4	Very low	35.6	Very low	129 Å²	129	152.3 Å²	152.3	78%	0.782	80%	0.801	S	S	*	*			trans	-37.5	135.5	171.8	178.3	0	0	0	0	113.1	A162	V160-A162 VanDerWaalsContact C-N 3.35Å; V160-A162 PolarHBondContact O-N 2.87Å
161	R	35.6	Very low	37.9	Very low	238 Å²	238	149.2 Å²	149.2	90%	0.898	78%	0.784	S	S	*	*			trans	-54.9	97.2	163.6	178.8	-170.4	-126.2	154.7	3.4	108.5	C163	R161-C163 PolarHBondContact O-N 3.44Å
162	A	38	Very low	40.7	Very low	85 Å²	85	142.5 Å²	142.5	70%	0.702	76%	0.756	S	S	*	*			trans	-51.6	127.2	-179.4	0	0	0	0	0	109.4	V160 R164	V160-A162 VanDerWaalsContact C-N 3.35Å; V160-A162 PolarHBondContact O-N 2.87Å; A162-R164 PolarHBondContact O-N 3.48Å
163	C	33.5	Very low	43.5	Very low	117 Å²	117	141.6 Å²	141.6	79%	0.791	74%	0.738	S	S	*	*			trans	-51.4	128.1	161.9	-71.4	0	0	0	0	106.6	R161 T165	R161-C163 PolarHBondContact O-N 3.44Å; C163-T165 VanDerWaalsContact C-N 3.27Å; C163-T165 PolarHBondContact O-N 2.83Å
164	R	37.8	Very low	46.4	Very low	244 Å²	244	133.2 Å²	133.2	92%	0.921	70%	0.698	S	S	*	*			trans	-54.4	99.9	169.6	177.3	-175	-175	176.4	3.2	106.2	A162 Q166	A162-R164 PolarHBondContact O-N 3.48Å; R164-Q166 PolarHBondContact O-N 2.79Å; R164-Q166 VanDerWaalsContact O-N 3.12Å
165	T	37.8	Very low	49.3	Very low	124 Å²	124	125.7 Å²	125.7	76%	0.761	66%	0.663	S	S	*	*			trans	-54.8	124.8	175.6	28.5	0	0	0	0	105.7	C163 Q167	C163-T165 VanDerWaalsContact C-N 3.27Å; C163-T165 PolarHBondContact O-N 2.83Å; T165-Q167 PolarHBondContact O-N 3.28Å
166	Q	39.4	Very low	51.7	Low	161 Å²	161	123.4 Å²	123.4	75%	0.752	64%	0.641	S	S	*	*			trans	-58.4	125.4	151.2	-62	-171.3	39.1	0	0	103.5	R164 E168	R164-Q166 PolarHBondContact O-N 2.79Å; R164-Q166 VanDerWaalsContact O-N 3.12Å; Q166-E168 HydrophobicContact CB-CG 4.18Å; Q166-E168 PolarHBondContact O-N 2.81Å
167	Q	38.6	Very low	54.6	Low	171 Å²	171	120.2 Å²	120.2	80%	0.799	61%	0.608	S	S	*	*			trans	-68.5	85	166.2	-171.2	176.8	-1.8	0	0	104.3	T165 N169	T165-Q167 PolarHBondContact O-N 3.28Å; Q167-N169 PolarHBondContact O-N 3.36Å; Q167-N169 PolarHBondContact O-OD1 2.78Å
168	E	41	Very low	57.4	Low	157 Å²	157	112.2 Å²	112.2	73%	0.734	57%	0.565	S	S	*	*			trans	-65.5	93.7	172.1	-67.6	-167.1	-178.1	0	0	104.6	Q166 E170	Q166-E168 HydrophobicContact CB-CG 4.18Å; Q166-E168 PolarHBondContact O-N 2.81Å; E168-E170 PolarHBondContact O-N 3.43Å
169	N	51.1	Low	60.3	Low	112 Å²	112	103.4 Å²	103.4	60%	0.599	53%	0.533	S	S	*	.			trans	-61.6	96.3	173.9	-78	6	0	0	0	106.3	Q167 S171	Q167-N169 PolarHBondContact O-N 3.36Å; Q167-N169 PolarHBondContact O-OD1 2.78Å; N169-S171 PolarHBondContact O-N 2.96Å; N169-S171 PolarHBondContact O-OG 3.1Å
170	E	60.1	Low	62.9	Low	181 Å²	181	99.1 Å²	99.1	85%	0.846	50%	0.502	S	S	*	.			trans	-57	85.1	174.6	-68.1	-173.3	164.3	0	0	108	E168 T172	E168-E170 PolarHBondContact O-N 3.43Å; E170-T172 PolarHBondContact O-N 3.39Å
171	S	74.4	Confident	65.7	Low	58 Å²	58	93.3 Å²	93.3	41%	0.406	47%	0.466	S	S	.	.			trans	-70	112.1	-169.1	-63.3	0	0	0	0	105.8	N169 Q176	N169-S171 PolarHBondContact O-N 2.96Å; N169-S171 PolarHBondContact O-OG 3.1Å; S171-Q176 WeakPolarHBondContact O-CG 3.46Å; S171-Q176 PolarHBondContact O-NE2 3Å
172	T	85.6	Confident	68.5	Low	47 Å²	47	82 Å²	82	29%	0.288	42%	0.424	S	S	.	.			trans	-54.3	152	-172.1	58.3	0	0	0	0	110.6	E170 R174 Q175 Q176	E170-T172 PolarHBondContact O-N 3.39Å; T172-R174 CarbonylContact O-C 3.59Å; T172-R174 PolarHBondContact O-N 2.92Å; T172-R174 VanDerWaalsContact O-N 3.07Å; T172-Q175 WeakPolarHBondContact O-CA 3.34Å; T172-Q175 PolarHBondContact O-N 2.84Å; T172-Q175 WeakPolarHBondContact OG1-CB 3.43Å; T172-Q175 VanDerWaalsContact OG1-CG 3.24Å; T172-Q175 WeakPolarHBondContact OG1-CG 3.22Å; T172-Q175 PolarHBondContact OG1-N 3Å; T172-Q175 VanDerWaalsContact OG1-N 3.17Å; T172-Q175 PolarHBondContact OG1-OE1 3.41Å; T172-Q176 PolarHBondContact O-N 2.68Å
173	P	83.9	Confident	71.2	Confident	49 Å²	49	82.6 Å²	82.6	32%	0.318	41%	0.408	S	S	.	.	H	α-helix	trans	-50.2	-37.2	176.6	-30.5	37	0	0	0	112.8	Q176 L177 F284 M288	P173-Q176 PolarHBondContact O-N 3.17Å; P173-L177 WeakPolarHBondContact O-CB 3.37Å; P173-L177 PolarHBondContact O-N 3.22Å; P173-F284 HydrophobicContact CB-CD2 4.12Å; P173-F284 HydrophobicContact CB-CE2 4.45Å; P173-F284 WeakPolarHBondContact O-CE2 3.29Å; P173-M288 HydrophobicContact CB-CE 4.14Å; P173-M288 HydrophobicContact CB-CG 4.41Å; P173-M288 HydrophobicContact CB-SD 3.46Å; P173-M288 WeakPolarHBondContact CB-SD 3.33Å; P173-M288 HydrophobicContact CG-SD 4.21Å
174	R	84.5	Confident	74	Confident	29 Å²	29	79.4 Å²	79.4	11%	0.109	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-52	170.5	-177	173.4	44.6	49.4	-1.2	112.5	T172 Q176 L177 L178 N226 Y228 N229 I296	T172-R174 CarbonylContact O-C 3.59Å; T172-R174 PolarHBondContact O-N 2.92Å; T172-R174 VanDerWaalsContact O-N 3.07Å; R174-Q176 VanDerWaalsContact C-N 3.29Å; R174-Q176 PolarHBondContact O-N 2.86Å; R174-L177 WeakPolarHBondContact O-CB 3.36Å; R174-L177 PolarHBondContact O-N 3.15Å; R174-L177 VanDerWaalsContact O-N 3.14Å; R174-L178 HydrophobicContact CG-CD1 3.95Å; R174-L178 HydrophobicContact CG-CG 4.12Å; R174-L178 WeakPolarHBondContact O-CG 3.36Å; R174-L178 PolarHBondContact O-N 3.32Å; R174-N226 VanDerWaalsContact CZ-OD1 3.32Å; R174-N226 PolarHBondContact NH1-OD1 2.89Å; R174-N226 PolarHBondContact NH2-OD1 2.9Å; R174-Y228 PolarHBondContact NE-O 2.91Å; R174-Y228 VanDerWaalsContact NE-O 3.15Å; R174-Y228 PolarHBondContact NH1-O 2.99Å; R174-Y228 PolarHBondContact NH2-O 2.97Å; R174-N229 WeakPolarHBondContact CD-O 3.18Å; R174-N229 PolarHBondContact NE-O 3Å; R174-I296 HydrophobicContact CB-CD1 3.85Å; R174-I296 HydrophobicContact CB-CG1 4.03Å; R174-I296 HydrophobicContact CG-CG1 4.33Å; R174-I296 HydrophobicContact CG-CG2 4.48Å
175	Q	90.4	Very high	76.7	Confident	26 Å²	26	67.9 Å²	67.9	12%	0.121	34%	0.338	C	S	.	.	H	α-helix	trans	-57.7	-40.4	177	-73.7	168.2	-55.8	0	0	112.3	T172 L177 L178 E179 I223 R224	T172-Q175 WeakPolarHBondContact O-CA 3.34Å; T172-Q175 PolarHBondContact O-N 2.84Å; T172-Q175 WeakPolarHBondContact OG1-CB 3.43Å; T172-Q175 VanDerWaalsContact OG1-CG 3.24Å; T172-Q175 WeakPolarHBondContact OG1-CG 3.22Å; T172-Q175 PolarHBondContact OG1-N 3Å; T172-Q175 VanDerWaalsContact OG1-N 3.17Å; T172-Q175 PolarHBondContact OG1-OE1 3.41Å; Q175-L177 PolarHBondContact O-N 3.25Å; Q175-L178 PolarHBondContact O-N 3.14Å; Q175-E179 WeakPolarHBondContact O-CB 3.22Å; Q175-E179 PolarHBondContact O-N 2.96Å; Q175-I223 HydrophobicContact CB-CG2 4.06Å; Q175-I223 HydrophobicContact CG-CG2 4.11Å; Q175-I223 WeakPolarHBondContact CG-O 3.32Å; Q175-I223 PolarHBondContact NE2-O 3.29Å; Q175-R224 PolarHBondContact NE2-O 3.12Å
176	Q	89.1	Confident	79.5	Confident	75 Å²	75	65.2 Å²	65.2	35%	0.35	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-39.2	176.1	-64.2	-173.2	40	0	0	112.6	S171 T172 P173 R174 H180 F284	S171-Q176 WeakPolarHBondContact O-CG 3.46Å; S171-Q176 PolarHBondContact O-NE2 3Å; T172-Q176 PolarHBondContact O-N 2.68Å; P173-Q176 PolarHBondContact O-N 3.17Å; R174-Q176 VanDerWaalsContact C-N 3.29Å; R174-Q176 PolarHBondContact O-N 2.86Å; Q176-H180 WeakPolarHBondContact O-CB 3.31Å; Q176-H180 PolarHBondContact O-N 3.04Å; Q176-F284 HydrophobicContact CB-CD2 4.42Å; Q176-F284 HydrophobicContact CB-CE1 4.11Å; Q176-F284 HydrophobicContact CB-CE2 3.83Å; Q176-F284 HydrophobicContact CB-CZ 3.63Å
177	L	88.6	Confident	82.1	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-66.5	-46.8	174.8	177	65	0	0	0	112.2	P173 R174 Q175 H180 F181 V231 L275 L278 M285 I296	P173-L177 WeakPolarHBondContact O-CB 3.37Å; P173-L177 PolarHBondContact O-N 3.22Å; R174-L177 WeakPolarHBondContact O-CB 3.36Å; R174-L177 PolarHBondContact O-N 3.15Å; R174-L177 VanDerWaalsContact O-N 3.14Å; Q175-L177 PolarHBondContact O-N 3.25Å; L177-H180 WeakPolarHBondContact O-CB 3.42Å; L177-H180 PolarHBondContact O-N 3.12Å; L177-F181 HydrophobicContact CD1-CD2 4.14Å; L177-F181 HydrophobicContact CD1-CE2 3.52Å; L177-F181 HydrophobicContact CD1-CZ 4.03Å; L177-F181 HydrophobicContact CD2-CE2 4.3Å; L177-F181 HydrophobicContact CG-CD2 4.09Å; L177-F181 HydrophobicContact CG-CE2 3.71Å; L177-F181 VanDerWaalsContact O-CD2 3.32Å; L177-F181 WeakPolarHBondContact O-CD2 3.15Å; L177-F181 PolarHBondContact O-N 2.85Å; L177-V231 HydrophobicContact CD2-CG2 4.18Å; L177-L275 HydrophobicContact CD1-CD1 3.95Å; L177-L275 HydrophobicContact CD2-CD1 4.01Å; L177-L278 HydrophobicContact CD1-CD2 3.65Å; L177-M285 HydrophobicContact CD1-CE 3.9Å; L177-M285 HydrophobicContact CD1-SD 4.06Å; L177-M285 HydrophobicContact CD2-SD 4.29Å; L177-I296 HydrophobicContact CD2-CG2 3.99Å
178	L	92	Very high	84.7	Confident	0 Å²	0	62 Å²	62	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-45	178.7	-65.2	-177.4	0	0	0	111.6	R174 Q175 H180 F181 L182 I223 Y228 V231 F234	R174-L178 HydrophobicContact CG-CD1 3.95Å; R174-L178 HydrophobicContact CG-CG 4.12Å; R174-L178 WeakPolarHBondContact O-CG 3.36Å; R174-L178 PolarHBondContact O-N 3.32Å; Q175-L178 PolarHBondContact O-N 3.14Å; L178-H180 VanDerWaalsContact C-N 3.29Å; L178-H180 PolarHBondContact O-N 3.34Å; L178-F181 PolarHBondContact O-N 3.42Å; L178-F181 VanDerWaalsContact O-N 3.12Å; L178-L182 WeakPolarHBondContact O-CB 3.41Å; L178-L182 PolarHBondContact O-N 3.29Å; L178-I223 HydrophobicContact CB-CD1 3.74Å; L178-I223 HydrophobicContact CB-CG1 3.85Å; L178-I223 HydrophobicContact CB-CG2 4.43Å; L178-I223 HydrophobicContact CD1-CG1 4.27Å; L178-Y228 HydrophobicContact CD1-CD2 3.99Å; L178-Y228 HydrophobicContact CD1-CG 4.09Å; L178-V231 HydrophobicContact CD2-CG2 3.94Å; L178-F234 HydrophobicContact CB-CD2 4.43Å; L178-F234 HydrophobicContact CD1-CB 4.44Å; L178-F234 HydrophobicContact CD2-CB 3.71Å; L178-F234 HydrophobicContact CD2-CD1 3.94Å; L178-F234 HydrophobicContact CD2-CD2 4.1Å; L178-F234 HydrophobicContact CD2-CG 3.66Å
179	E	93.5	Very high	87.3	Confident	39 Å²	39	55.2 Å²	55.2	18%	0.182	26%	0.262	C	S	.	.	H	α-helix	trans	-66.5	-29.3	174.3	171.5	62.8	-148.7	0	0	111.2	Q175 R183 I223	Q175-E179 WeakPolarHBondContact O-CB 3.22Å; Q175-E179 PolarHBondContact O-N 2.96Å; E179-R183 WeakPolarHBondContact O-CB 3.45Å; E179-R183 VanDerWaalsContact O-CG 3.26Å; E179-R183 WeakPolarHBondContact O-CG 3.49Å; E179-R183 PolarHBondContact O-N 2.96Å; E179-R183 VanDerWaalsContact O-N 3.15Å; E179-R183 PolarHBondContact O-NE 3.49Å; E179-R183 WeakPolarHBondContact OE1-CD 3.38Å; E179-R183 WeakPolarHBondContact OE1-CG 3.32Å; E179-R183 IonicContact OE1-CZ 2.65Å; E179-R183 IonicContact OE1-NE 2.64Å; E179-R183 PolarHBondContact OE1-NE 3.25Å; E179-R183 IonicContact OE1-NH1 2.8Å; E179-I223 HydrophobicContact CB-CG2 4.38Å
180	H	91.5	Very high	89.3	Confident	36 Å²	36	55 Å²	55	17%	0.167	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-51.3	165.8	172.6	-97.6	0	0	0	111.7	Q176 L177 L178 L182 R183 Q184 M282	Q176-H180 WeakPolarHBondContact O-CB 3.31Å; Q176-H180 PolarHBondContact O-N 3.04Å; L177-H180 WeakPolarHBondContact O-CB 3.42Å; L177-H180 PolarHBondContact O-N 3.12Å; L178-H180 VanDerWaalsContact C-N 3.29Å; L178-H180 PolarHBondContact O-N 3.34Å; H180-L182 PolarHBondContact O-N 3.47Å; H180-R183 PolarHBondContact O-N 3.43Å; H180-Q184 PolarHBondContact NE2-NE2 2.99Å; H180-Q184 WeakPolarHBondContact O-CG 3.35Å; H180-Q184 PolarHBondContact O-N 2.94Å; H180-Q184 VanDerWaalsContact O-N 3.12Å; H180-M282 HydrophobicContact CB-CE 3.91Å
181	F	92.6	Very high	90.8	Very high	7 Å²	7	53.1 Å²	53.1	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-47.1	177.2	-73.2	-55.8	0	0	0	112.3	L177 L178 R183 Q184 L185 F234 M269 M270 L275 L278	L177-F181 HydrophobicContact CD1-CD2 4.14Å; L177-F181 HydrophobicContact CD1-CE2 3.52Å; L177-F181 HydrophobicContact CD1-CZ 4.03Å; L177-F181 HydrophobicContact CD2-CE2 4.3Å; L177-F181 HydrophobicContact CG-CD2 4.09Å; L177-F181 HydrophobicContact CG-CE2 3.71Å; L177-F181 VanDerWaalsContact O-CD2 3.32Å; L177-F181 WeakPolarHBondContact O-CD2 3.15Å; L177-F181 PolarHBondContact O-N 2.85Å; L178-F181 PolarHBondContact O-N 3.42Å; L178-F181 VanDerWaalsContact O-N 3.12Å; F181-R183 PolarHBondContact O-N 2.95Å; F181-Q184 CarbonylContact O-C 3.59Å; F181-Q184 WeakPolarHBondContact O-CA 3.48Å; F181-Q184 WeakPolarHBondContact O-CB 3.45Å; F181-Q184 PolarHBondContact O-N 2.84Å; F181-L185 WeakPolarHBondContact O-CG 3.26Å; F181-L185 PolarHBondContact O-N 3.5Å; F181-F234 HydrophobicContact CB-CE1 3.86Å; F181-F234 HydrophobicContact CB-CZ 4.08Å; F181-M269 WeakPolarHBondContact CE1-O 3.45Å; F181-M270 HydrophobicContact CD1-CG 3.89Å; F181-M270 HydrophobicContact CE1-CG 3.99Å; F181-M270 HydrophobicContact CG-CG 4.2Å; F181-M270 HydrophobicContact CG-SD 4.49Å; F181-M270 HydrophobicContact CZ-CG 4.36Å; F181-L275 HydrophobicContact CE2-CD1 4.05Å; F181-L275 HydrophobicContact CZ-CD1 3.81Å; F181-L278 HydrophobicContact CE1-CD2 3.96Å; F181-L278 HydrophobicContact CZ-CD2 3.79Å
182	L	94.9	Very high	91.7	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.4	-48.5	178.3	-176.6	68.3	0	0	0	111.8	L178 H180 Q184 L185 Q186 F216 M219 K220 I223 F234	L178-L182 WeakPolarHBondContact O-CB 3.41Å; L178-L182 PolarHBondContact O-N 3.29Å; H180-L182 PolarHBondContact O-N 3.47Å; L182-Q184 VanDerWaalsContact C-N 3.27Å; L182-Q184 PolarHBondContact O-N 3.15Å; L182-L185 PolarHBondContact O-N 2.81Å; L182-L185 VanDerWaalsContact O-N 3.16Å; L182-Q186 WeakPolarHBondContact O-CG 3.35Å; L182-Q186 PolarHBondContact O-N 2.89Å; L182-F216 HydrophobicContact CD1-CB 4.11Å; L182-F216 HydrophobicContact CD1-CD1 3.46Å; L182-F216 VanDerWaalsContact CD1-CD1 3.46Å; L182-F216 HydrophobicContact CD1-CE1 4.19Å; L182-F216 HydrophobicContact CD1-CG 4.11Å; L182-M219 HydrophobicContact CD1-CB 4.28Å; L182-K220 HydrophobicContact CD2-CB 3.63Å; L182-K220 HydrophobicContact CD2-CD 4.38Å; L182-K220 HydrophobicContact CD2-CG 3.77Å; L182-I223 HydrophobicContact CB-CD1 4.23Å; L182-I223 HydrophobicContact CD2-CD1 4.04Å; L182-F234 HydrophobicContact CB-CE2 4.42Å; L182-F234 HydrophobicContact CB-CZ 4.31Å
183	R	94.5	Very high	92.1	Very high	97 Å²	97	53.1 Å²	53.1	37%	0.366	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-28.6	176.1	-70.8	174.7	-64.5	-152.7	7	113.4	E179 H180 F181 R187	E179-R183 WeakPolarHBondContact O-CB 3.45Å; E179-R183 VanDerWaalsContact O-CG 3.26Å; E179-R183 WeakPolarHBondContact O-CG 3.49Å; E179-R183 PolarHBondContact O-N 2.96Å; E179-R183 VanDerWaalsContact O-N 3.15Å; E179-R183 PolarHBondContact O-NE 3.49Å; E179-R183 WeakPolarHBondContact OE1-CD 3.38Å; E179-R183 WeakPolarHBondContact OE1-CG 3.32Å; E179-R183 IonicContact OE1-CZ 2.65Å; E179-R183 IonicContact OE1-NE 2.64Å; E179-R183 PolarHBondContact OE1-NE 3.25Å; E179-R183 IonicContact OE1-NH1 2.8Å; H180-R183 PolarHBondContact O-N 3.43Å; F181-R183 PolarHBondContact O-N 2.95Å; R183-R187 VanDerWaalsContact O-CG 3.32Å; R183-R187 WeakPolarHBondContact O-CG 3.32Å; R183-R187 PolarHBondContact O-N 3.24Å
184	Q	93	Very high	92.7	Very high	50 Å²	50	51.5 Å²	51.5	23%	0.234	24%	0.244	C	C	.	.	H	α-helix	trans	-76.1	-37	173.4	-63	-60.6	1.8	0	0	112.2	H180 F181 L182 R187 M269	H180-Q184 PolarHBondContact NE2-NE2 2.99Å; H180-Q184 WeakPolarHBondContact O-CG 3.35Å; H180-Q184 PolarHBondContact O-N 2.94Å; H180-Q184 VanDerWaalsContact O-N 3.12Å; F181-Q184 CarbonylContact O-C 3.59Å; F181-Q184 WeakPolarHBondContact O-CA 3.48Å; F181-Q184 WeakPolarHBondContact O-CB 3.45Å; F181-Q184 PolarHBondContact O-N 2.84Å; L182-Q184 VanDerWaalsContact C-N 3.27Å; L182-Q184 PolarHBondContact O-N 3.15Å; Q184-R187 PolarHBondContact O-N 3.48Å; Q184-M269 HydrophobicContact CB-CE 3.62Å; Q184-M269 HydrophobicContact CG-CE 4.01Å
185	L	95	Very high	93.3	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-67.9	-43.9	177.1	-67.7	169.8	0	0	0	111.4	F181 L182 R187 K188 D189 F216 F234 F238 G266 M270	F181-L185 WeakPolarHBondContact O-CG 3.26Å; F181-L185 PolarHBondContact O-N 3.5Å; L182-L185 PolarHBondContact O-N 2.81Å; L182-L185 VanDerWaalsContact O-N 3.16Å; L185-R187 VanDerWaalsContact C-N 3.27Å; L185-R187 PolarHBondContact O-N 3.04Å; L185-K188 WeakPolarHBondContact O-CA 2.98Å; L185-K188 WeakPolarHBondContact O-CB 3.47Å; L185-K188 PolarHBondContact O-N 3.34Å; L185-D189 PolarHBondContact O-N 3.27Å; L185-F216 HydrophobicContact CB-CE1 3.68Å; L185-F216 HydrophobicContact CB-CZ 3.72Å; L185-F216 HydrophobicContact CD1-CE1 4.39Å; L185-F234 HydrophobicContact CD1-CE1 4.09Å; L185-F234 HydrophobicContact CD1-CZ 3.99Å; L185-F238 HydrophobicContact CB-CE2 4.48Å; L185-F238 HydrophobicContact CD1-CD2 3.7Å; L185-F238 HydrophobicContact CD1-CE2 3.88Å; L185-F238 HydrophobicContact CD1-CG 4.21Å; L185-F238 HydrophobicContact CD2-CD2 4.32Å; L185-F238 HydrophobicContact CD2-CE1 4.33Å; L185-F238 HydrophobicContact CD2-CE2 3.66Å; L185-F238 HydrophobicContact CD2-CZ 3.66Å; L185-F238 HydrophobicContact CG-CE2 4.2Å; L185-G266 VanDerWaalsContact CD2-CA 3.43Å; L185-M270 HydrophobicContact CD1-CE 4.41Å
186	Q	95.3	Very high	93.6	Very high	69 Å²	69	57.5 Å²	57.5	32%	0.322	28%	0.277	S	S	.	.	H	α-helix	trans	-57.3	-37.7	172.7	-73.2	170.8	-14.9	0	0	112	L182 K188 D189 F216	L182-Q186 WeakPolarHBondContact O-CG 3.35Å; L182-Q186 PolarHBondContact O-N 2.89Å; Q186-K188 PolarHBondContact O-N 3.03Å; Q186-K188 VanDerWaalsContact O-N 3.11Å; Q186-D189 CarbonylContact O-C 3.6Å; Q186-D189 PolarHBondContact O-N 3.22Å; Q186-F216 HydrophobicContact CG-CB 4.22Å; Q186-F216 HydrophobicContact CG-CD1 4.43Å; Q186-F216 HydrophobicContact CG-CD2 3.74Å; Q186-F216 HydrophobicContact CG-CE2 4.11Å; Q186-F216 HydrophobicContact CG-CG 3.92Å
187	R	94.9	Very high	94	Very high	159 Å²	159	57.1 Å²	57.1	60%	0.6	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-5.9	172.6	-70.4	175.2	-165	120.7	6.1	114.5	R183 Q184 L185	R183-R187 VanDerWaalsContact O-CG 3.32Å; R183-R187 WeakPolarHBondContact O-CG 3.32Å; R183-R187 PolarHBondContact O-N 3.24Å; Q184-R187 PolarHBondContact O-N 3.48Å; L185-R187 VanDerWaalsContact C-N 3.27Å; L185-R187 PolarHBondContact O-N 3.04Å
188	K	93.4	Very high	94.3	Very high	106 Å²	106	59.5 Å²	59.5	46%	0.461	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-8.9	171.2	-55.8	-55.8	-179.3	-176.2	0	113	L185 Q186 P190 L262 T265	L185-K188 WeakPolarHBondContact O-CA 2.98Å; L185-K188 WeakPolarHBondContact O-CB 3.47Å; L185-K188 PolarHBondContact O-N 3.34Å; Q186-K188 PolarHBondContact O-N 3.03Å; Q186-K188 VanDerWaalsContact O-N 3.11Å; K188-P190 VanDerWaalsContact C-CD 3.43Å; K188-P190 VanDerWaalsContact O-CD 3.26Å; K188-P190 WeakPolarHBondContact O-CD 3.13Å; K188-L262 HydrophobicContact CB-CD1 3.69Å; K188-T265 HydrophobicContact CD-CG2 3.94Å; K188-T265 HydrophobicContact CG-CG2 3.85Å
189	D	95.5	Very high	94.4	Very high	14 Å²	14	62.8 Å²	62.8	8%	0.075	32%	0.315	C	S	.	.			trans	-112.3	76.9	169.7	178.2	21.4	0	0	0	110.5	L185 Q186 H191 G192 F193 F194 F216	L185-D189 PolarHBondContact O-N 3.27Å; Q186-D189 CarbonylContact O-C 3.6Å; Q186-D189 PolarHBondContact O-N 3.22Å; D189-H191 PolarHBondContact O-N 2.98Å; D189-H191 PolarHBondContact OD1-N 2.8Å; D189-G192 PolarHBondContact O-N 3.49Å; D189-G192 PolarHBondContact OD1-N 2.74Å; D189-G192 VanDerWaalsContact OD2-CA 3.23Å; D189-G192 WeakPolarHBondContact OD2-CA 3.22Å; D189-G192 PolarHBondContact OD2-N 2.66Å; D189-F193 PolarHBondContact OD1-N 3.45Å; D189-F193 VanDerWaalsContact OD1-N 3.16Å; D189-F193 PolarHBondContact OD2-N 3.48Å; D189-F194 HydrophobicContact CB-CD2 4.25Å; D189-F194 WeakPolarHBondContact OD2-CD2 3.39Å; D189-F194 PolarHBondContact OD2-N 3.36Å; D189-F216 HydrophobicContact CB-CE2 4.1Å
190	P	92.7	Very high	94.5	Very high	107 Å²	107	64.2 Å²	64.2	70%	0.695	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-7.3	179.2	32.3	-37.5	0	0	0	113.6	K188	K188-P190 VanDerWaalsContact C-CD 3.43Å; K188-P190 VanDerWaalsContact O-CD 3.26Å; K188-P190 WeakPolarHBondContact O-CD 3.13Å
191	H	91.4	Very high	94.5	Very high	141 Å²	141	67.3 Å²	67.3	65%	0.653	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-14.2	178.6	-61.2	-69.3	0	0	0	112.7	D189 F193	D189-H191 PolarHBondContact O-N 2.98Å; D189-H191 PolarHBondContact OD1-N 2.8Å; H191-F193 VanDerWaalsContact C-N 3.32Å; H191-F193 HydrophobicContact CB-CD1 3.87Å; H191-F193 HydrophobicContact CB-CD2 3.96Å; H191-F193 HydrophobicContact CB-CE1 3.61Å; H191-F193 HydrophobicContact CB-CE2 3.71Å; H191-F193 HydrophobicContact CB-CG 4.04Å; H191-F193 HydrophobicContact CB-CZ 3.53Å; H191-F193 AromaticContact CD2-CE2 3.84Å; H191-F193 AromaticContact CG-CE2 3.94Å; H191-F193 AromaticContact CG-CZ 3.77Å
192	G	93.6	Very high	94.5	Very high	35 Å²	35	73.4 Å²	73.4	36%	0.361	39%	0.387	S	S	.	.			trans	72.6	20.9	-178.4	0	0	0	0	0	114.1	D189 F194 A195	D189-G192 PolarHBondContact O-N 3.49Å; D189-G192 PolarHBondContact OD1-N 2.74Å; D189-G192 VanDerWaalsContact OD2-CA 3.23Å; D189-G192 WeakPolarHBondContact OD2-CA 3.22Å; D189-G192 PolarHBondContact OD2-N 2.66Å; G192-F194 PolarHBondContact O-N 2.89Å; G192-F194 VanDerWaalsContact O-N 3.13Å; G192-A195 WeakPolarHBondContact O-CB 3.44Å; G192-A195 PolarHBondContact O-N 3.5Å; G192-A195 VanDerWaalsContact O-N 3.1Å
193	F	94.4	Very high	94.4	Very high	71 Å²	71	73.8 Å²	73.8	31%	0.311	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.6	178.7	-62	-34.6	0	0	0	113.5	D189 H191 V254 Y255 A258	D189-F193 PolarHBondContact OD1-N 3.45Å; D189-F193 VanDerWaalsContact OD1-N 3.16Å; D189-F193 PolarHBondContact OD2-N 3.48Å; H191-F193 VanDerWaalsContact C-N 3.32Å; H191-F193 HydrophobicContact CB-CD1 3.87Å; H191-F193 HydrophobicContact CB-CD2 3.96Å; H191-F193 HydrophobicContact CB-CE1 3.61Å; H191-F193 HydrophobicContact CB-CE2 3.71Å; H191-F193 HydrophobicContact CB-CG 4.04Å; H191-F193 HydrophobicContact CB-CZ 3.53Å; H191-F193 AromaticContact CD2-CE2 3.84Å; H191-F193 AromaticContact CG-CE2 3.94Å; H191-F193 AromaticContact CG-CZ 3.77Å; F193-V254 HydrophobicContact CZ-CG2 4.41Å; F193-Y255 HydrophobicContact CD1-CD1 4.03Å; F193-Y255 AromaticContact CD1-CE1 3.79Å; F193-Y255 HydrophobicContact CD1-CE1 3.79Å; F193-Y255 HydrophobicContact CD2-CD1 4.23Å; F193-Y255 HydrophobicContact CE1-CD1 4.16Å; F193-Y255 AromaticContact CE1-CE1 3.68Å; F193-Y255 HydrophobicContact CE1-CE1 3.68Å; F193-Y255 HydrophobicContact CE2-CD1 4.35Å; F193-Y255 HydrophobicContact CG-CD1 4.07Å; F193-Y255 HydrophobicContact CG-CE1 4.32Å; F193-Y255 HydrophobicContact CZ-CD1 4.32Å; F193-Y255 HydrophobicContact CZ-CE1 4.1Å; F193-A258 HydrophobicContact CD2-CB 3.92Å; F193-A258 HydrophobicContact CE2-CB 4.22Å
194	F	96.9	Very high	94.4	Very high	14 Å²	14	74 Å²	74	6%	0.061	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	11.9	-179.6	-54.8	-86.1	0	0	0	112.4	D189 G192 F216 M241 A245 A258 A259 L262	D189-F194 HydrophobicContact CB-CD2 4.25Å; D189-F194 WeakPolarHBondContact OD2-CD2 3.39Å; D189-F194 PolarHBondContact OD2-N 3.36Å; G192-F194 PolarHBondContact O-N 2.89Å; G192-F194 VanDerWaalsContact O-N 3.13Å; F194-F216 HydrophobicContact CB-CD2 3.76Å; F194-F216 HydrophobicContact CB-CE2 3.74Å; F194-F216 HydrophobicContact CB-CZ 4.48Å; F194-F216 WeakPolarHBondContact O-CB 3.32Å; F194-F216 VanDerWaalsContact O-CD2 3.27Å; F194-F216 WeakPolarHBondContact O-CD2 3.5Å; F194-F216 WeakPolarHBondContact O-CG 3.44Å; F194-F216 PolarHBondContact O-N 2.85Å; F194-M241 HydrophobicContact CB-CE 4.16Å; F194-M241 HydrophobicContact CB-CG 4.48Å; F194-M241 HydrophobicContact CB-SD 3.85Å; F194-M241 HydrophobicContact CD1-CE 4.07Å; F194-M241 HydrophobicContact CD1-CG 3.84Å; F194-M241 HydrophobicContact CD1-SD 4.17Å; F194-M241 HydrophobicContact CG-CE 4.17Å; F194-M241 HydrophobicContact CG-SD 4.33Å; F194-A245 HydrophobicContact CE1-CB 3.71Å; F194-A245 HydrophobicContact CZ-CB 4.28Å; F194-A258 HydrophobicContact CE2-CB 4.27Å; F194-A259 HydrophobicContact CE1-CB 4.25Å; F194-A259 HydrophobicContact CZ-CB 3.8Å; F194-L262 HydrophobicContact CD1-CD2 4.41Å; F194-L262 HydrophobicContact CD2-CD2 3.44Å; F194-L262 VanDerWaalsContact CD2-CD2 3.44Å; F194-L262 HydrophobicContact CE2-CD2 3.64Å; F194-L262 HydrophobicContact CG-CD2 3.87Å; F194-L262 HydrophobicContact CZ-CD2 4.22Å
195	A	95.8	Very high	94.4	Very high	29 Å²	29	73 Å²	73	24%	0.24	41%	0.408	C	S	.	.	S	Bend	trans	-76.2	-24.8	-170.8	0	0	0	0	0	114.8	G192 S217	G192-A195 WeakPolarHBondContact O-CB 3.44Å; G192-A195 PolarHBondContact O-N 3.5Å; G192-A195 VanDerWaalsContact O-N 3.1Å; A195-S217 WeakPolarHBondContact O-CB 3.36Å; A195-S217 PolarHBondContact O-N 3.45Å
196	F	97	Very high	94.5	Very high	152 Å²	152	73.7 Å²	73.7	67%	0.667	41%	0.411	S	S	*	.	S	Bend	trans	-144.5	163.5	-173.3	-62.9	-68.7	0	0	0	110.8	V198 D215	F196-V198 PolarHBondContact O-N 3.17Å; F196-D215 VanDerWaalsContact C-CG 3.41Å; F196-D215 WeakPolarHBondContact CA-OD1 3.45Å; F196-D215 WeakPolarHBondContact O-CB 3.14Å
197	P	96.5	Very high	94.5	Very high	68 Å²	68	74 Å²	74	44%	0.442	42%	0.42	S	S	.	.			trans	-62.4	136	178.9	-19.7	31.2	0	0	0	112	D215	P197-D215 WeakPolarHBondContact CG-OD2 3.31Å
198	V	95.8	Very high	94.5	Very high	53 Å²	53	69.8 Å²	69.8	32%	0.321	42%	0.416	S	S	.	.			trans	-74	130.1	174.8	-179	0	0	0	0	109.7	F196 A203 Y206	F196-V198 PolarHBondContact O-N 3.17Å; V198-A203 HydrophobicContact CG1-CB 3.51Å; V198-Y206 HydrophobicContact CB-CD1 4.07Å; V198-Y206 HydrophobicContact CB-CD2 4.38Å; V198-Y206 HydrophobicContact CB-CE1 3.79Å; V198-Y206 HydrophobicContact CB-CE2 4.11Å; V198-Y206 HydrophobicContact CB-CG 4.36Å; V198-Y206 HydrophobicContact CG1-CD1 3.94Å; V198-Y206 HydrophobicContact CG1-CD2 3.69Å; V198-Y206 HydrophobicContact CG1-CE1 4.09Å; V198-Y206 HydrophobicContact CG1-CE2 3.85Å; V198-Y206 HydrophobicContact CG1-CG 3.74Å; V198-Y206 HydrophobicContact CG2-CE2 4.35Å
199	T	94.6	Very high	94.6	Very high	69 Å²	69	69 Å²	69	42%	0.423	42%	0.415	S	S	.	.			trans	-112.4	154	178.4	63.8	0	0	0	0	111.4	A201 I202 A203	T199-A201 PolarHBondContact O-N 2.73Å; T199-A201 VanDerWaalsContact O-N 3.09Å; T199-I202 PolarHBondContact O-N 3.45Å; T199-A203 PolarHBondContact O-N 3.08Å
200	D	94.2	Very high	94.7	Very high	70 Å²	70	68.7 Å²	68.7	37%	0.374	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.6	-179.4	-69.1	-38.9	0	0	0	113.8	I202 A203 P204 Y206 S207	D200-I202 VanDerWaalsContact C-N 3.34Å; D200-A203 WeakPolarHBondContact CA-O 3.47Å; D200-A203 CarbonylContact O-C 3.59Å; D200-P204 WeakPolarHBondContact O-CA 3.2Å; D200-Y206 PolarHBondContact OD1-N 3.48Å; D200-S207 VanDerWaalsContact CG-OG 3.29Å; D200-S207 PolarHBondContact OD1-N 2.91Å; D200-S207 PolarHBondContact OD1-OG 2.73Å; D200-S207 VanDerWaalsContact OD2-CB 3.24Å; D200-S207 WeakPolarHBondContact OD2-CB 3.44Å; D200-S207 PolarHBondContact OD2-OG 3.4Å
201	A	92.6	Very high	94.9	Very high	100 Å²	100	70.8 Å²	70.8	83%	0.826	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-25.2	173	0	0	0	0	0	113.2	T199	T199-A201 PolarHBondContact O-N 2.73Å; T199-A201 VanDerWaalsContact O-N 3.09Å
202	I	92.1	Very high	95.1	Very high	135 Å²	135	70.4 Å²	70.4	69%	0.692	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-35.5	176	-59.6	170.9	0	0	0	110.1	T199 D200	T199-I202 PolarHBondContact O-N 3.45Å; D200-I202 VanDerWaalsContact C-N 3.34Å
203	A	92.6	Very high	95.2	Very high	8 Å²	8	72.2 Å²	72.2	7%	0.066	42%	0.416	C	S	.	.	S	Bend	trans	-132.7	88.3	-175.8	0	0	0	0	0	109.9	V198 T199 D200 G205 Y206 Y248	V198-A203 HydrophobicContact CG1-CB 3.51Å; T199-A203 PolarHBondContact O-N 3.08Å; D200-A203 WeakPolarHBondContact CA-O 3.47Å; D200-A203 CarbonylContact O-C 3.59Å; A203-G205 PolarHBondContact O-N 2.88Å; A203-Y206 HydrophobicContact CB-CD2 4.03Å; A203-Y206 HydrophobicContact CB-CG 4.21Å; A203-Y206 WeakPolarHBondContact O-CB 3.5Å; A203-Y206 PolarHBondContact O-N 2.77Å; A203-Y248 WeakPolarHBondContact CA-OH 3.36Å; A203-Y248 HydrophobicContact CB-CE1 3.76Å
204	P	95.5	Very high	95.4	Very high	101 Å²	101	70 Å²	70	66%	0.656	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	122.4	-174.7	-30.3	37	0	0	0	113.4	D200 Y206 Y248	D200-P204 WeakPolarHBondContact O-CA 3.2Å; P204-Y206 VanDerWaalsContact C-N 3.33Å; P204-Y206 PolarHBondContact O-N 2.73Å; P204-Y248 PolarHBondContact O-OH 3.14Å
205	G	93.6	Very high	95.4	Very high	31 Å²	31	69.5 Å²	69.5	32%	0.32	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	9.5	179	0	0	0	0	0	115.8	A203 S207 S208 I209	A203-G205 PolarHBondContact O-N 2.88Å; G205-S207 VanDerWaalsContact C-N 3.31Å; G205-S207 PolarHBondContact O-N 3Å; G205-S208 WeakPolarHBondContact O-CB 3.41Å; G205-S208 PolarHBondContact O-N 3.21Å; G205-S208 PolarHBondContact O-OG 2.94Å; G205-I209 PolarHBondContact O-N 2.99Å
206	Y	95.7	Very high	95.5	Very high	16 Å²	16	68.1 Å²	68.1	6%	0.063	39%	0.393	C	S	.	.	H	α-helix	trans	-53.4	-44.3	179.8	-174.7	-88.8	0	0	0	112.7	V198 D200 A203 P204 S208 I209 I210 P213 Y248	V198-Y206 HydrophobicContact CB-CD1 4.07Å; V198-Y206 HydrophobicContact CB-CD2 4.38Å; V198-Y206 HydrophobicContact CB-CE1 3.79Å; V198-Y206 HydrophobicContact CB-CE2 4.11Å; V198-Y206 HydrophobicContact CB-CG 4.36Å; V198-Y206 HydrophobicContact CG1-CD1 3.94Å; V198-Y206 HydrophobicContact CG1-CD2 3.69Å; V198-Y206 HydrophobicContact CG1-CE1 4.09Å; V198-Y206 HydrophobicContact CG1-CE2 3.85Å; V198-Y206 HydrophobicContact CG1-CG 3.74Å; V198-Y206 HydrophobicContact CG2-CE2 4.35Å; D200-Y206 PolarHBondContact OD1-N 3.48Å; A203-Y206 HydrophobicContact CB-CD2 4.03Å; A203-Y206 HydrophobicContact CB-CG 4.21Å; A203-Y206 WeakPolarHBondContact O-CB 3.5Å; A203-Y206 PolarHBondContact O-N 2.77Å; P204-Y206 VanDerWaalsContact C-N 3.33Å; P204-Y206 PolarHBondContact O-N 2.73Å; Y206-S208 PolarHBondContact O-N 2.86Å; Y206-I209 PolarHBondContact O-N 3.34Å; Y206-I209 VanDerWaalsContact O-N 3.12Å; Y206-I210 HydrophobicContact CD1-CB 4.17Å; Y206-I210 HydrophobicContact CD1-CG1 4.38Å; Y206-I210 HydrophobicContact CD2-CG1 4.11Å; Y206-I210 HydrophobicContact CE1-CB 3.8Å; Y206-I210 HydrophobicContact CE1-CG1 4.04Å; Y206-I210 HydrophobicContact CE1-CG2 3.92Å; Y206-I210 HydrophobicContact CE2-CB 4.45Å; Y206-I210 HydrophobicContact CE2-CG1 3.76Å; Y206-I210 HydrophobicContact CG-CG1 4.4Å; Y206-I210 PolarHBondContact O-N 2.57Å; Y206-P213 HydrophobicContact CE1-CB 4.33Å; Y206-Y248 AromaticContact CD2-CD1 3.99Å; Y206-Y248 HydrophobicContact CD2-CD1 3.99Å; Y206-Y248 AromaticContact CD2-CD2 3.6Å; Y206-Y248 HydrophobicContact CD2-CD2 3.6Å; Y206-Y248 HydrophobicContact CD2-CE1 4.39Å; Y206-Y248 HydrophobicContact CD2-CE2 4.03Å; Y206-Y248 AromaticContact CD2-CG 3.59Å; Y206-Y248 HydrophobicContact CD2-CG 3.59Å; Y206-Y248 HydrophobicContact CE2-CD1 4.47Å; Y206-Y248 HydrophobicContact CE2-CD2 4.43Å; Y206-Y248 HydrophobicContact CE2-CG 4.06Å; Y206-Y248 HydrophobicContact CG-CD2 4.31Å; Y206-Y248 HydrophobicContact CG-CE2 4.48Å
207	S	94.8	Very high	95.5	Very high	74 Å²	74	62.5 Å²	62.5	52%	0.517	37%	0.372	S	S	.	.	H	α-helix	trans	-61.9	-27	178.1	65.6	0	0	0	0	114.1	D200 G205	D200-S207 VanDerWaalsContact CG-OG 3.29Å; D200-S207 PolarHBondContact OD1-N 2.91Å; D200-S207 PolarHBondContact OD1-OG 2.73Å; D200-S207 VanDerWaalsContact OD2-CB 3.24Å; D200-S207 WeakPolarHBondContact OD2-CB 3.44Å; D200-S207 PolarHBondContact OD2-OG 3.4Å; G205-S207 VanDerWaalsContact C-N 3.31Å; G205-S207 PolarHBondContact O-N 3Å
208	S	95.9	Very high	95.6	Very high	72 Å²	72	61.6 Å²	61.6	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-76.2	-33	177.1	77.5	0	0	0	0	111.9	G205 Y206 K211	G205-S208 WeakPolarHBondContact O-CB 3.41Å; G205-S208 PolarHBondContact O-N 3.21Å; G205-S208 PolarHBondContact O-OG 2.94Å; Y206-S208 PolarHBondContact O-N 2.86Å; S208-K211 PolarHBondContact O-NZ 2.79Å
209	I	95.6	Very high	95.6	Very high	88 Å²	88	59.1 Å²	59.1	45%	0.451	35%	0.351	S	S	.	.	H	α-helix	trans	-89.1	-49.4	-175.5	-63.6	165.1	0	0	0	110.9	G205 Y206 V247 Y248	G205-I209 PolarHBondContact O-N 2.99Å; Y206-I209 PolarHBondContact O-N 3.34Å; Y206-I209 VanDerWaalsContact O-N 3.12Å; I209-V247 HydrophobicContact CG2-CG1 4.29Å; I209-Y248 HydrophobicContact CD1-CD2 3.84Å; I209-Y248 HydrophobicContact CD1-CE2 3.91Å
210	I	97.1	Very high	95.7	Very high	9 Å²	9	59.8 Å²	59.8	5%	0.046	35%	0.348	C	S	.	.			trans	-97	105.9	-173.6	-58.7	-58	0	0	0	110	Y206 N244 V247	Y206-I210 HydrophobicContact CD1-CB 4.17Å; Y206-I210 HydrophobicContact CD1-CG1 4.38Å; Y206-I210 HydrophobicContact CD2-CG1 4.11Å; Y206-I210 HydrophobicContact CE1-CB 3.8Å; Y206-I210 HydrophobicContact CE1-CG1 4.04Å; Y206-I210 HydrophobicContact CE1-CG2 3.92Å; Y206-I210 HydrophobicContact CE2-CB 4.45Å; Y206-I210 HydrophobicContact CE2-CG1 3.76Å; Y206-I210 HydrophobicContact CG-CG1 4.4Å; Y206-I210 PolarHBondContact O-N 2.57Å; I210-N244 HydrophobicContact CD1-CB 4.12Å; I210-N244 HydrophobicContact CG2-CB 4.02Å; I210-N244 VanDerWaalsContact CG2-CG 3.47Å; I210-V247 HydrophobicContact CD1-CB 4.07Å; I210-V247 HydrophobicContact CD1-CG1 3.86Å
211	K	96.4	Very high	95.8	Very high	150 Å²	150	59.7 Å²	59.7	65%	0.652	35%	0.347	S	S	*	.	S	Bend	trans	-75.2	-26.1	-177.2	-56.5	-49.8	-173.4	-166	0	114.5	S208	S208-K211 PolarHBondContact O-NZ 2.79Å
212	H	96.3	Very high	96	Very high	133 Å²	133	57 Å²	57	62%	0.616	32%	0.317	S	S	*	.	S	Bend	trans	-131.1	80.6	-176.4	-58.2	-62.2	0	0	0	109.3	L240 N244	H212-L240 HydrophobicContact CB-CD1 4.43Å; H212-L240 HydrophobicContact CB-CD2 4.04Å; H212-N244 PolarHBondContact O-ND2 3.1Å
213	P	96.6	Very high	96.1	Very high	74 Å²	74	50.9 Å²	50.9	48%	0.481	29%	0.286	S	S	.	.			trans	-63.1	148.3	176	28	-35.2	0	0	0	110.8	Y206	Y206-P213 HydrophobicContact CE1-CB 4.33Å
214	M	97.9	Very high	96.2	Very high	23 Å²	23	58 Å²	58	11%	0.113	31%	0.311	C	S	.	.			trans	-154.3	143.9	177.3	-171.9	54.2	59.4	0	0	109.6	T218 M219 K222 D237 L240 M241	M214-T218 HydrophobicContact CE-CG2 4.04Å; M214-T218 HydrophobicContact SD-CG2 3.74Å; M214-M219 HydrophobicContact CG-CG 4.04Å; M214-M219 HydrophobicContact CG-SD 4.48Å; M214-M219 HydrophobicContact SD-CG 3.58Å; M214-M219 VanDerWaalsContact SD-CG 3.58Å; M214-K222 HydrophobicContact CE-CD 4.47Å; M214-D237 HydrophobicContact CE-CB 4.38Å; M214-D237 HydrophobicContact CG-CB 4.03Å; M214-D237 WeakPolarHBondContact CG-O 3.22Å; M214-D237 HydrophobicContact SD-CB 4.19Å; M214-L240 HydrophobicContact CB-CD2 4.24Å; M214-L240 HydrophobicContact CB-CG 4.29Å; M214-M241 HydrophobicContact CB-CB 4.11Å; M214-M241 HydrophobicContact CG-CB 4.09Å; M214-M241 WeakPolarHBondContact O-CG 3.32Å
215	D	97.8	Very high	96.1	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.306	C	S	.	.			trans	-157.7	166.9	-176	72.6	96.5	0	0	0	111	F196 P197 S217 T218 M219	F196-D215 VanDerWaalsContact C-CG 3.41Å; F196-D215 WeakPolarHBondContact CA-OD1 3.45Å; F196-D215 WeakPolarHBondContact O-CB 3.14Å; P197-D215 WeakPolarHBondContact CG-OD2 3.31Å; D215-S217 VanDerWaalsContact C-N 3.3Å; D215-S217 PolarHBondContact O-N 3.27Å; D215-S217 WeakPolarHBondContact OD1-CA 3.42Å; D215-S217 VanDerWaalsContact OD1-CB 3.31Å; D215-S217 WeakPolarHBondContact OD1-CB 3.26Å; D215-S217 PolarHBondContact OD1-N 3.23Å; D215-S217 PolarHBondContact OD1-OG 3.07Å; D215-T218 PolarHBondContact O-N 3.15Å; D215-T218 PolarHBondContact OD1-N 3.47Å; D215-T218 WeakPolarHBondContact OD2-CB 3.35Å; D215-T218 PolarHBondContact OD2-OG1 2.92Å; D215-M219 VanDerWaalsContact O-CG 3.32Å; D215-M219 WeakPolarHBondContact O-CG 3.36Å; D215-M219 PolarHBondContact O-N 3.32Å
216	F	97.8	Very high	96	Very high	1 Å²	1	59.7 Å²	59.7	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-22.4	-176.2	-70.7	-44.4	0	0	0	115.4	L182 L185 Q186 D189 F194 M219 K220 F238 M241 L262	L182-F216 HydrophobicContact CD1-CB 4.11Å; L182-F216 HydrophobicContact CD1-CD1 3.46Å; L182-F216 VanDerWaalsContact CD1-CD1 3.46Å; L182-F216 HydrophobicContact CD1-CE1 4.19Å; L182-F216 HydrophobicContact CD1-CG 4.11Å; L185-F216 HydrophobicContact CB-CE1 3.68Å; L185-F216 HydrophobicContact CB-CZ 3.72Å; L185-F216 HydrophobicContact CD1-CE1 4.39Å; Q186-F216 HydrophobicContact CG-CB 4.22Å; Q186-F216 HydrophobicContact CG-CD1 4.43Å; Q186-F216 HydrophobicContact CG-CD2 3.74Å; Q186-F216 HydrophobicContact CG-CE2 4.11Å; Q186-F216 HydrophobicContact CG-CG 3.92Å; D189-F216 HydrophobicContact CB-CE2 4.1Å; F194-F216 HydrophobicContact CB-CD2 3.76Å; F194-F216 HydrophobicContact CB-CE2 3.74Å; F194-F216 HydrophobicContact CB-CZ 4.48Å; F194-F216 WeakPolarHBondContact O-CB 3.32Å; F194-F216 VanDerWaalsContact O-CD2 3.27Å; F194-F216 WeakPolarHBondContact O-CD2 3.5Å; F194-F216 WeakPolarHBondContact O-CG 3.44Å; F194-F216 PolarHBondContact O-N 2.85Å; F216-M219 HydrophobicContact CD1-SD 4.36Å; F216-K220 WeakPolarHBondContact O-CB 3.29Å; F216-K220 PolarHBondContact O-N 3.5Å; F216-K220 VanDerWaalsContact O-N 3.15Å; F216-F238 HydrophobicContact CE1-CD2 4.3Å; F216-F238 HydrophobicContact CE1-CE2 4.33Å; F216-M241 HydrophobicContact CD1-CE 4.26Å; F216-M241 HydrophobicContact CD1-SD 3.85Å; F216-M241 HydrophobicContact CE1-CE 3.67Å; F216-M241 HydrophobicContact CE1-SD 3.89Å; F216-M241 HydrophobicContact CE2-CE 4.44Å; F216-M241 HydrophobicContact CG-SD 4.24Å; F216-M241 HydrophobicContact CZ-CE 3.78Å; F216-M241 HydrophobicContact CZ-SD 4.3Å; F216-L262 HydrophobicContact CE2-CD2 4.38Å; F216-L262 HydrophobicContact CZ-CD1 4.42Å; F216-L262 HydrophobicContact CZ-CD2 4.03Å
217	S	97.1	Very high	95.9	Very high	33 Å²	33	63.4 Å²	63.4	23%	0.231	33%	0.325	C	S	.	.	H	α-helix	trans	-78.2	-44.4	174.2	72.9	0	0	0	0	111.1	A195 D215 M219 K220 D221	A195-S217 WeakPolarHBondContact O-CB 3.36Å; A195-S217 PolarHBondContact O-N 3.45Å; D215-S217 VanDerWaalsContact C-N 3.3Å; D215-S217 PolarHBondContact O-N 3.27Å; D215-S217 WeakPolarHBondContact OD1-CA 3.42Å; D215-S217 VanDerWaalsContact OD1-CB 3.31Å; D215-S217 WeakPolarHBondContact OD1-CB 3.26Å; D215-S217 PolarHBondContact OD1-N 3.23Å; D215-S217 PolarHBondContact OD1-OG 3.07Å; S217-M219 PolarHBondContact O-N 3.19Å; S217-K220 WeakPolarHBondContact O-CB 3.46Å; S217-K220 PolarHBondContact O-N 2.84Å; S217-K220 VanDerWaalsContact O-N 3.07Å; S217-D221 PolarHBondContact O-N 3.49Å
218	T	97.1	Very high	95.8	Very high	50 Å²	50	59.9 Å²	59.9	31%	0.307	30%	0.3	S	S	.	.	H	α-helix	trans	-57	-49.6	170.9	-60.8	0	0	0	0	110.8	M214 D215 K220 D221 K222	M214-T218 HydrophobicContact CE-CG2 4.04Å; M214-T218 HydrophobicContact SD-CG2 3.74Å; D215-T218 PolarHBondContact O-N 3.15Å; D215-T218 PolarHBondContact OD1-N 3.47Å; D215-T218 WeakPolarHBondContact OD2-CB 3.35Å; D215-T218 PolarHBondContact OD2-OG1 2.92Å; T218-K220 PolarHBondContact O-N 3.47Å; T218-D221 PolarHBondContact O-N 3.08Å; T218-D221 VanDerWaalsContact O-N 3.17Å; T218-K222 HydrophobicContact CG2-CD 4.49Å; T218-K222 WeakPolarHBondContact O-CG 3.38Å; T218-K222 PolarHBondContact O-N 3.34Å
219	M	97.2	Very high	95.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-33.3	175.9	-67.8	-174	77.4	0	0	113	L182 M214 D215 F216 S217 I223 F234 D237 F238 M241	L182-M219 HydrophobicContact CD1-CB 4.28Å; M214-M219 HydrophobicContact CG-CG 4.04Å; M214-M219 HydrophobicContact CG-SD 4.48Å; M214-M219 HydrophobicContact SD-CG 3.58Å; M214-M219 VanDerWaalsContact SD-CG 3.58Å; D215-M219 VanDerWaalsContact O-CG 3.32Å; D215-M219 WeakPolarHBondContact O-CG 3.36Å; D215-M219 PolarHBondContact O-N 3.32Å; F216-M219 HydrophobicContact CD1-SD 4.36Å; S217-M219 PolarHBondContact O-N 3.19Å; M219-I223 WeakPolarHBondContact O-CG1 3.46Å; M219-I223 PolarHBondContact O-N 3.5Å; M219-I223 VanDerWaalsContact O-N 3.12Å; M219-F234 HydrophobicContact CE-CD2 3.52Å; M219-F234 HydrophobicContact CE-CE1 4.46Å; M219-F234 HydrophobicContact CE-CE2 3.42Å; M219-F234 VanDerWaalsContact CE-CE2 3.42Å; M219-F234 HydrophobicContact CE-CG 4.1Å; M219-F234 HydrophobicContact CE-CZ 3.93Å; M219-F234 WeakPolarHBondContact CE-O 3.45Å; M219-D237 HydrophobicContact CE-CB 3.9Å; M219-D237 HydrophobicContact CG-CB 4.36Å; M219-D237 HydrophobicContact SD-CB 4.41Å; M219-F238 HydrophobicContact CE-CB 3.99Å; M219-M241 HydrophobicContact SD-SD 4.4Å
220	K	96.3	Very high	95.1	Very high	83 Å²	83	57.8 Å²	57.8	36%	0.361	29%	0.285	S	S	.	.	H	α-helix	trans	-68.2	-43.2	177.1	-165.1	176.6	-175.7	-178.2	0	112.1	L182 F216 S217 T218 I223 R224	L182-K220 HydrophobicContact CD2-CB 3.63Å; L182-K220 HydrophobicContact CD2-CD 4.38Å; L182-K220 HydrophobicContact CD2-CG 3.77Å; F216-K220 WeakPolarHBondContact O-CB 3.29Å; F216-K220 PolarHBondContact O-N 3.5Å; F216-K220 VanDerWaalsContact O-N 3.15Å; S217-K220 WeakPolarHBondContact O-CB 3.46Å; S217-K220 PolarHBondContact O-N 2.84Å; S217-K220 VanDerWaalsContact O-N 3.07Å; T218-K220 PolarHBondContact O-N 3.47Å; K220-I223 WeakPolarHBondContact O-CB 3.24Å; K220-I223 PolarHBondContact O-N 3.22Å; K220-R224 WeakPolarHBondContact O-CG 3.46Å; K220-R224 PolarHBondContact O-N 3.28Å
221	D	96.6	Very high	94.7	Very high	69 Å²	69	57.9 Å²	57.9	37%	0.369	29%	0.286	S	S	.	.	H	α-helix	trans	-73	-34.5	-179.1	-73	-10.3	0	0	0	111	S217 T218 I223 R224 N225	S217-D221 PolarHBondContact O-N 3.49Å; T218-D221 PolarHBondContact O-N 3.08Å; T218-D221 VanDerWaalsContact O-N 3.17Å; D221-I223 VanDerWaalsContact C-N 3.33Å; D221-I223 PolarHBondContact O-N 3.39Å; D221-R224 PolarHBondContact O-N 2.92Å; D221-R224 VanDerWaalsContact O-N 3.1Å; D221-R224 WeakPolarHBondContact OD1-CD 3.32Å; D221-R224 IonicContact OD1-CZ 2.78Å; D221-R224 IonicContact OD1-NE 2.93Å; D221-R224 IonicContact OD1-NH1 3.18Å; D221-R224 PolarHBondContact OD1-NH1 3.41Å; D221-R224 IonicContact OD2-NH1 2.69Å; D221-N225 WeakPolarHBondContact O-CB 3.33Å; D221-N225 PolarHBondContact O-N 3.16Å; D221-N225 PolarHBondContact O-ND2 2.97Å; D221-N225 PolarHBondContact O-OD1 3.12Å
222	K	95.9	Very high	94.4	Very high	44 Å²	44	53.8 Å²	53.8	19%	0.191	27%	0.273	C	S	.	.	H	α-helix	trans	-57.3	-40.5	166.3	-68.4	-167.9	65.4	-179.8	0	113.2	M214 T218 N226 E227 Y228 D237	M214-K222 HydrophobicContact CE-CD 4.47Å; T218-K222 HydrophobicContact CG2-CD 4.49Å; T218-K222 WeakPolarHBondContact O-CG 3.38Å; T218-K222 PolarHBondContact O-N 3.34Å; K222-N226 PolarHBondContact O-N 3.44Å; K222-E227 HydrophobicContact CB-CB 4.2Å; K222-E227 WeakPolarHBondContact CG-OE2 3.45Å; K222-E227 PolarHBondContact O-N 3.45Å; K222-Y228 HydrophobicContact CB-CD2 4.03Å; K222-Y228 HydrophobicContact CB-CE2 3.44Å; K222-Y228 VanDerWaalsContact CB-CE2 3.44Å; K222-Y228 HydrophobicContact CD-CE1 4.46Å; K222-D237 IonicContact NZ-OD1 2.69Å; K222-D237 IonicContact NZ-OD2 3.38Å; K222-D237 PolarHBondContact NZ-OD2 2.81Å
223	I	94.9	Very high	94.3	Very high	6 Å²	6	50.7 Å²	50.7	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-48.2	171.7	-67.9	163.6	0	0	0	110.7	Q175 L178 E179 L182 M219 K220 D221 N225 N226 Y228 F234	Q175-I223 HydrophobicContact CB-CG2 4.06Å; Q175-I223 HydrophobicContact CG-CG2 4.11Å; Q175-I223 WeakPolarHBondContact CG-O 3.32Å; Q175-I223 PolarHBondContact NE2-O 3.29Å; L178-I223 HydrophobicContact CB-CD1 3.74Å; L178-I223 HydrophobicContact CB-CG1 3.85Å; L178-I223 HydrophobicContact CB-CG2 4.43Å; L178-I223 HydrophobicContact CD1-CG1 4.27Å; E179-I223 HydrophobicContact CB-CG2 4.38Å; L182-I223 HydrophobicContact CB-CD1 4.23Å; L182-I223 HydrophobicContact CD2-CD1 4.04Å; M219-I223 WeakPolarHBondContact O-CG1 3.46Å; M219-I223 PolarHBondContact O-N 3.5Å; M219-I223 VanDerWaalsContact O-N 3.12Å; K220-I223 WeakPolarHBondContact O-CB 3.24Å; K220-I223 PolarHBondContact O-N 3.22Å; D221-I223 VanDerWaalsContact C-N 3.33Å; D221-I223 PolarHBondContact O-N 3.39Å; I223-N225 VanDerWaalsContact C-N 3.35Å; I223-N225 PolarHBondContact O-N 2.88Å; I223-N226 PolarHBondContact O-N 3.35Å; I223-Y228 HydrophobicContact CG1-CD2 3.71Å; I223-Y228 HydrophobicContact CG1-CE2 3.84Å; I223-F234 HydrophobicContact CD1-CD2 4.31Å; I223-F234 HydrophobicContact CD1-CE2 3.9Å
224	R	93.8	Very high	94.2	Very high	158 Å²	158	47.1 Å²	47.1	60%	0.596	24%	0.236	S	C	*	.	H	α-helix	trans	-61.9	-40.8	-178.1	-72.2	170.6	57.8	-141.2	-8.3	112.7	Q175 K220 D221 N226	Q175-R224 PolarHBondContact NE2-O 3.12Å; K220-R224 WeakPolarHBondContact O-CG 3.46Å; K220-R224 PolarHBondContact O-N 3.28Å; D221-R224 PolarHBondContact O-N 2.92Å; D221-R224 VanDerWaalsContact O-N 3.1Å; D221-R224 WeakPolarHBondContact OD1-CD 3.32Å; D221-R224 IonicContact OD1-CZ 2.78Å; D221-R224 IonicContact OD1-NE 2.93Å; D221-R224 IonicContact OD1-NH1 3.18Å; D221-R224 PolarHBondContact OD1-NH1 3.41Å; D221-R224 IonicContact OD2-NH1 2.69Å; R224-N226 PolarHBondContact O-N 3.4Å
225	N	93.6	Very high	94	Very high	102 Å²	102	49.4 Å²	49.4	55%	0.545	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-6.9	176.7	-63.4	-11.2	0	0	0	112.9	D221 I223 E227	D221-N225 WeakPolarHBondContact O-CB 3.33Å; D221-N225 PolarHBondContact O-N 3.16Å; D221-N225 PolarHBondContact O-ND2 2.97Å; D221-N225 PolarHBondContact O-OD1 3.12Å; I223-N225 VanDerWaalsContact C-N 3.35Å; I223-N225 PolarHBondContact O-N 2.88Å; N225-E227 VanDerWaalsContact C-N 3.28Å; N225-E227 HydrophobicContact CB-CG 3.81Å; N225-E227 VanDerWaalsContact CB-OE1 3.22Å; N225-E227 WeakPolarHBondContact CB-OE1 3.37Å; N225-E227 PolarHBondContact ND2-OE1 3.07Å; N225-E227 PolarHBondContact O-N 3.32Å
226	N	91.6	Very high	93.9	Very high	64 Å²	64	51.8 Å²	51.8	34%	0.342	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	26.3	-176.3	-159.1	45.4	0	0	0	114.4	R174 K222 I223 R224 Y228	R174-N226 VanDerWaalsContact CZ-OD1 3.32Å; R174-N226 PolarHBondContact NH1-OD1 2.89Å; R174-N226 PolarHBondContact NH2-OD1 2.9Å; K222-N226 PolarHBondContact O-N 3.44Å; I223-N226 PolarHBondContact O-N 3.35Å; R224-N226 PolarHBondContact O-N 3.4Å; N226-Y228 PolarHBondContact O-N 3.24Å
227	E	93.4	Very high	93.9	Very high	95 Å²	95	52.7 Å²	52.7	44%	0.444	27%	0.271	S	S	.	.			trans	-70.9	-15.5	-177.9	-69.6	171.5	-129.6	0	0	114.2	K222 N225	K222-E227 HydrophobicContact CB-CB 4.2Å; K222-E227 WeakPolarHBondContact CG-OE2 3.45Å; K222-E227 PolarHBondContact O-N 3.45Å; N225-E227 VanDerWaalsContact C-N 3.28Å; N225-E227 HydrophobicContact CB-CG 3.81Å; N225-E227 VanDerWaalsContact CB-OE1 3.22Å; N225-E227 WeakPolarHBondContact CB-OE1 3.37Å; N225-E227 PolarHBondContact ND2-OE1 3.07Å; N225-E227 PolarHBondContact O-N 3.32Å
228	Y	93.2	Very high	93.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.26	C	S	.	.			trans	-88.8	109.6	171.8	-66.5	-61.3	0	0	0	110.2	R174 L178 K222 I223 N226 E233 F234 D237	R174-Y228 PolarHBondContact NE-O 2.91Å; R174-Y228 VanDerWaalsContact NE-O 3.15Å; R174-Y228 PolarHBondContact NH1-O 2.99Å; R174-Y228 PolarHBondContact NH2-O 2.97Å; L178-Y228 HydrophobicContact CD1-CD2 3.99Å; L178-Y228 HydrophobicContact CD1-CG 4.09Å; K222-Y228 HydrophobicContact CB-CD2 4.03Å; K222-Y228 HydrophobicContact CB-CE2 3.44Å; K222-Y228 VanDerWaalsContact CB-CE2 3.44Å; K222-Y228 HydrophobicContact CD-CE1 4.46Å; I223-Y228 HydrophobicContact CG1-CD2 3.71Å; I223-Y228 HydrophobicContact CG1-CE2 3.84Å; N226-Y228 PolarHBondContact O-N 3.24Å; Y228-E233 VanDerWaalsContact CA-OE2 3.24Å; Y228-E233 WeakPolarHBondContact CA-OE2 3.37Å; Y228-E233 HydrophobicContact CD1-CB 3.83Å; Y228-E233 HydrophobicContact CE1-CB 4.45Å; Y228-F234 HydrophobicContact CD1-CB 4.11Å; Y228-F234 HydrophobicContact CD2-CD2 4.27Å; Y228-F234 HydrophobicContact CE1-CB 4.21Å; Y228-F234 AromaticContact CE2-CD2 3.9Å; Y228-F234 HydrophobicContact CE2-CD2 3.9Å; Y228-F234 HydrophobicContact CG-CB 4.27Å; Y228-D237 HydrophobicContact CE1-CB 4.28Å; Y228-D237 WeakPolarHBondContact CE1-OD2 3.28Å; Y228-D237 VanDerWaalsContact CZ-OD2 3.24Å; Y228-D237 PolarHBondContact OH-OD2 3.39Å
229	N	89.1	Confident	93.9	Very high	103 Å²	103	53.3 Å²	53.3	55%	0.551	27%	0.265	S	S	*	.	S	Bend	trans	-71.2	-40	171.4	-53.7	-66.9	0	0	0	111	R174 E233	R174-N229 WeakPolarHBondContact CD-O 3.18Å; R174-N229 PolarHBondContact NE-O 3Å; N229-E233 PolarHBondContact N-OE2 3.41Å; N229-E233 PolarHBondContact ND2-OE1 3.43Å
230	T	87.7	Confident	94	Very high	12 Å²	12	55.8 Å²	55.8	7%	0.074	28%	0.278	C	S	.	.	S	Bend	trans	-128.4	165.3	-171.2	64.7	0	0	0	0	112.5	T232 E233	T230-T232 VanDerWaalsContact C-N 3.31Å; T230-T232 WeakPolarHBondContact CB-OG1 3.39Å; T230-T232 PolarHBondContact OG1-OG1 3.49Å; T230-E233 PolarHBondContact N-OE2 3.18Å; T230-E233 WeakPolarHBondContact OG1-CG 3.44Å; T230-E233 PolarHBondContact OG1-N 2.88Å
231	V	88.4	Confident	94	Very high	12 Å²	12	52 Å²	52	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-74.1	-23	170	174.1	0	0	0	0	111.5	L177 L178 F234 K235 I296	L177-V231 HydrophobicContact CD2-CG2 4.18Å; L178-V231 HydrophobicContact CD2-CG2 3.94Å; V231-F234 PolarHBondContact O-N 3.41Å; V231-K235 VanDerWaalsContact O-CB 3.28Å; V231-K235 WeakPolarHBondContact O-CB 3.22Å; V231-K235 PolarHBondContact O-N 2.91Å; V231-I296 WeakPolarHBondContact CB-O 3.37Å; V231-I296 HydrophobicContact CG2-CG2 3.65Å; V231-I296 VanDerWaalsContact CG2-O 3.26Å; V231-I296 WeakPolarHBondContact CG2-O 3.3Å; V231-I296 PolarHBondContact N-O 3.47Å
232	T	90.4	Very high	94.1	Very high	64 Å²	64	48.7 Å²	48.7	39%	0.393	24%	0.244	S	C	.	.	H	α-helix	trans	-67.3	-41.1	176.3	45.7	0	0	0	0	112	T230 K235 A236 L297	T230-T232 VanDerWaalsContact C-N 3.31Å; T230-T232 WeakPolarHBondContact CB-OG1 3.39Å; T230-T232 PolarHBondContact OG1-OG1 3.49Å; T232-K235 PolarHBondContact O-N 3.5Å; T232-A236 WeakPolarHBondContact O-CB 3.39Å; T232-A236 PolarHBondContact O-N 3.02Å; T232-L297 WeakPolarHBondContact CG2-O 3.47Å
233	E	93.4	Very high	94.2	Very high	67 Å²	67	48.5 Å²	48.5	31%	0.313	25%	0.245	S	C	.	.	H	α-helix	trans	-60.8	-47.1	172.8	-70.3	167.4	173.2	0	0	112.2	Y228 N229 T230 K235 A236 D237	Y228-E233 VanDerWaalsContact CA-OE2 3.24Å; Y228-E233 WeakPolarHBondContact CA-OE2 3.37Å; Y228-E233 HydrophobicContact CD1-CB 3.83Å; Y228-E233 HydrophobicContact CE1-CB 4.45Å; N229-E233 PolarHBondContact N-OE2 3.41Å; N229-E233 PolarHBondContact ND2-OE1 3.43Å; T230-E233 PolarHBondContact N-OE2 3.18Å; T230-E233 WeakPolarHBondContact OG1-CG 3.44Å; T230-E233 PolarHBondContact OG1-N 2.88Å; E233-K235 VanDerWaalsContact C-N 3.28Å; E233-K235 PolarHBondContact O-N 3.07Å; E233-A236 WeakPolarHBondContact O-CB 3.47Å; E233-A236 PolarHBondContact O-N 3.02Å; E233-A236 VanDerWaalsContact O-N 3.1Å; E233-D237 PolarHBondContact O-N 3.15Å
234	F	94.9	Very high	94.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-39.4	176	173.5	-93.2	0	0	0	112.1	L178 F181 L182 L185 M219 I223 Y228 V231 A236 F238 M270	L178-F234 HydrophobicContact CB-CD2 4.43Å; L178-F234 HydrophobicContact CD1-CB 4.44Å; L178-F234 HydrophobicContact CD2-CB 3.71Å; L178-F234 HydrophobicContact CD2-CD1 3.94Å; L178-F234 HydrophobicContact CD2-CD2 4.1Å; L178-F234 HydrophobicContact CD2-CG 3.66Å; F181-F234 HydrophobicContact CB-CE1 3.86Å; F181-F234 HydrophobicContact CB-CZ 4.08Å; L182-F234 HydrophobicContact CB-CE2 4.42Å; L182-F234 HydrophobicContact CB-CZ 4.31Å; L185-F234 HydrophobicContact CD1-CE1 4.09Å; L185-F234 HydrophobicContact CD1-CZ 3.99Å; M219-F234 HydrophobicContact CE-CD2 3.52Å; M219-F234 HydrophobicContact CE-CE1 4.46Å; M219-F234 HydrophobicContact CE-CE2 3.42Å; M219-F234 VanDerWaalsContact CE-CE2 3.42Å; M219-F234 HydrophobicContact CE-CG 4.1Å; M219-F234 HydrophobicContact CE-CZ 3.93Å; M219-F234 WeakPolarHBondContact CE-O 3.45Å; I223-F234 HydrophobicContact CD1-CD2 4.31Å; I223-F234 HydrophobicContact CD1-CE2 3.9Å; Y228-F234 HydrophobicContact CD1-CB 4.11Å; Y228-F234 HydrophobicContact CD2-CD2 4.27Å; Y228-F234 HydrophobicContact CE1-CB 4.21Å; Y228-F234 AromaticContact CE2-CD2 3.9Å; Y228-F234 HydrophobicContact CE2-CD2 3.9Å; Y228-F234 HydrophobicContact CG-CB 4.27Å; V231-F234 PolarHBondContact O-N 3.41Å; F234-A236 VanDerWaalsContact C-N 3.34Å; F234-F238 WeakPolarHBondContact O-CB 3.31Å; F234-F238 PolarHBondContact O-N 3.46Å; F234-M270 HydrophobicContact CD1-SD 3.93Å; F234-M270 HydrophobicContact CE1-SD 3.69Å
235	K	94.2	Very high	94.4	Very high	70 Å²	70	41.9 Å²	41.9	30%	0.304	22%	0.223	S	C	.	.	H	α-helix	trans	-69.4	-30.9	176	-176.3	178.4	175.1	-178	0	112.2	V231 T232 E233 K239 F267 M270	V231-K235 VanDerWaalsContact O-CB 3.28Å; V231-K235 WeakPolarHBondContact O-CB 3.22Å; V231-K235 PolarHBondContact O-N 2.91Å; T232-K235 PolarHBondContact O-N 3.5Å; E233-K235 VanDerWaalsContact C-N 3.28Å; E233-K235 PolarHBondContact O-N 3.07Å; K235-K239 WeakPolarHBondContact O-CB 3.45Å; K235-K239 PolarHBondContact O-N 2.97Å; K235-F267 VanDerWaalsContact CE-CE1 3.48Å; K235-F267 HydrophobicContact CG-CE1 4.38Å; K235-F267 HydrophobicContact CG-CE2 4.3Å; K235-F267 HydrophobicContact CG-CZ 3.98Å; K235-M270 HydrophobicContact CG-CE 4.46Å
236	A	95.9	Very high	94.6	Very high	54 Å²	54	38 Å²	38	45%	0.446	20%	0.203	S	C	.	.	H	α-helix	trans	-69.2	-47.5	173.1	0	0	0	0	0	111.5	T232 E233 F234 F238 K239 L240	T232-A236 WeakPolarHBondContact O-CB 3.39Å; T232-A236 PolarHBondContact O-N 3.02Å; E233-A236 WeakPolarHBondContact O-CB 3.47Å; E233-A236 PolarHBondContact O-N 3.02Å; E233-A236 VanDerWaalsContact O-N 3.1Å; F234-A236 VanDerWaalsContact C-N 3.34Å; A236-F238 VanDerWaalsContact C-N 3.35Å; A236-F238 PolarHBondContact O-N 2.58Å; A236-K239 WeakPolarHBondContact O-CB 3.49Å; A236-K239 PolarHBondContact O-N 3.1Å; A236-K239 VanDerWaalsContact O-N 3.13Å; A236-L240 WeakPolarHBondContact O-CB 3.43Å; A236-L240 PolarHBondContact O-N 2.67Å
237	D	97.4	Very high	94.8	Very high	21 Å²	21	39.7 Å²	39.7	11%	0.112	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-41.4	174.5	-85.1	-5	0	0	0	112	M214 M219 K222 Y228 E233 K239 L240 M241	M214-D237 HydrophobicContact CE-CB 4.38Å; M214-D237 HydrophobicContact CG-CB 4.03Å; M214-D237 WeakPolarHBondContact CG-O 3.22Å; M214-D237 HydrophobicContact SD-CB 4.19Å; M219-D237 HydrophobicContact CE-CB 3.9Å; M219-D237 HydrophobicContact CG-CB 4.36Å; M219-D237 HydrophobicContact SD-CB 4.41Å; K222-D237 IonicContact NZ-OD1 2.69Å; K222-D237 IonicContact NZ-OD2 3.38Å; K222-D237 PolarHBondContact NZ-OD2 2.81Å; Y228-D237 HydrophobicContact CE1-CB 4.28Å; Y228-D237 WeakPolarHBondContact CE1-OD2 3.28Å; Y228-D237 VanDerWaalsContact CZ-OD2 3.24Å; Y228-D237 PolarHBondContact OH-OD2 3.39Å; E233-D237 PolarHBondContact O-N 3.15Å; D237-K239 VanDerWaalsContact C-N 3.31Å; D237-K239 PolarHBondContact O-N 3.36Å; D237-L240 PolarHBondContact O-N 2.98Å; D237-M241 WeakPolarHBondContact O-CB 3.43Å; D237-M241 PolarHBondContact O-N 3.45Å
238	F	97.3	Very high	95	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-38.7	173.7	176.1	-107.7	0	0	0	112.7	L185 F216 M219 F234 A236 M241 C242 L262 L263 F267 M270	L185-F238 HydrophobicContact CB-CE2 4.48Å; L185-F238 HydrophobicContact CD1-CD2 3.7Å; L185-F238 HydrophobicContact CD1-CE2 3.88Å; L185-F238 HydrophobicContact CD1-CG 4.21Å; L185-F238 HydrophobicContact CD2-CD2 4.32Å; L185-F238 HydrophobicContact CD2-CE1 4.33Å; L185-F238 HydrophobicContact CD2-CE2 3.66Å; L185-F238 HydrophobicContact CD2-CZ 3.66Å; L185-F238 HydrophobicContact CG-CE2 4.2Å; F216-F238 HydrophobicContact CE1-CD2 4.3Å; F216-F238 HydrophobicContact CE1-CE2 4.33Å; M219-F238 HydrophobicContact CE-CB 3.99Å; F234-F238 WeakPolarHBondContact O-CB 3.31Å; F234-F238 PolarHBondContact O-N 3.46Å; A236-F238 VanDerWaalsContact C-N 3.35Å; A236-F238 PolarHBondContact O-N 2.58Å; F238-M241 HydrophobicContact CD2-CE 3.61Å; F238-M241 HydrophobicContact CE2-CE 3.63Å; F238-C242 PolarHBondContact O-N 3.29Å; F238-C242 PolarHBondContact O-SG 2.59Å; F238-L262 HydrophobicContact CE2-CD1 4.27Å; F238-L262 HydrophobicContact CE2-CD2 4.38Å; F238-L262 HydrophobicContact CE2-CG 3.95Å; F238-L262 HydrophobicContact CZ-CD1 4.31Å; F238-L262 HydrophobicContact CZ-CG 3.97Å; F238-L263 HydrophobicContact CE1-CD1 4.24Å; F238-F267 HydrophobicContact CD1-CD2 4.17Å; F238-F267 HydrophobicContact CD1-CE2 4.07Å; F238-F267 HydrophobicContact CE1-CD2 4.07Å; F238-F267 HydrophobicContact CE1-CE2 4.37Å; F238-M270 HydrophobicContact CB-CE 4.47Å; F238-M270 HydrophobicContact CD1-CE 3.57Å; F238-M270 HydrophobicContact CE1-CE 4.05Å; F238-M270 HydrophobicContact CG-CE 4.09Å
239	K	97.1	Very high	95.1	Very high	95 Å²	95	39.6 Å²	39.6	41%	0.413	21%	0.214	S	C	.	.	H	α-helix	trans	-66.8	-47.1	174.9	-175.7	-179.4	179.7	-68	0	110.5	K235 A236 D237 M241 C242 D243 L263 F267	K235-K239 WeakPolarHBondContact O-CB 3.45Å; K235-K239 PolarHBondContact O-N 2.97Å; A236-K239 WeakPolarHBondContact O-CB 3.49Å; A236-K239 PolarHBondContact O-N 3.1Å; A236-K239 VanDerWaalsContact O-N 3.13Å; D237-K239 VanDerWaalsContact C-N 3.31Å; D237-K239 PolarHBondContact O-N 3.36Å; K239-M241 PolarHBondContact O-N 2.99Å; K239-C242 PolarHBondContact O-N 3Å; K239-D243 WeakPolarHBondContact CG-OD2 3.27Å; K239-D243 IonicContact NZ-OD2 2.6Å; K239-D243 PolarHBondContact NZ-OD2 3.37Å; K239-D243 WeakPolarHBondContact O-CB 3.25Å; K239-D243 PolarHBondContact O-N 3.22Å; K239-L263 HydrophobicContact CB-CD1 4.42Å; K239-L263 HydrophobicContact CG-CD1 4.26Å; K239-F267 HydrophobicContact CB-CE2 4.06Å; K239-F267 HydrophobicContact CB-CZ 4.08Å; K239-F267 HydrophobicContact CD-CZ 4.1Å; K239-F267 HydrophobicContact CG-CE2 4.44Å; K239-F267 HydrophobicContact CG-CZ 4.27Å
240	L	97.9	Very high	95.4	Very high	52 Å²	52	43.7 Å²	43.7	27%	0.272	22%	0.221	S	C	.	.	H	α-helix	trans	-56.7	-48.6	177.9	175.8	62.1	0	0	0	111.8	H212 M214 A236 D237 C242 D243 N244	H212-L240 HydrophobicContact CB-CD1 4.43Å; H212-L240 HydrophobicContact CB-CD2 4.04Å; M214-L240 HydrophobicContact CB-CD2 4.24Å; M214-L240 HydrophobicContact CB-CG 4.29Å; A236-L240 WeakPolarHBondContact O-CB 3.43Å; A236-L240 PolarHBondContact O-N 2.67Å; D237-L240 PolarHBondContact O-N 2.98Å; L240-C242 VanDerWaalsContact C-N 3.33Å; L240-C242 PolarHBondContact O-N 2.95Å; L240-D243 PolarHBondContact O-N 2.95Å; L240-N244 WeakPolarHBondContact CD1-OD1 3.33Å; L240-N244 VanDerWaalsContact O-CB 3.27Å; L240-N244 WeakPolarHBondContact O-CB 3.43Å; L240-N244 PolarHBondContact O-N 3.5Å; L240-N244 PolarHBondContact O-ND2 2.85Å
241	M	97.9	Very high	95.8	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.02	24%	0.238	C	C	.	.	H	α-helix	trans	-53	-48	174.3	178.4	-168	80.1	0	0	112.3	F194 M214 F216 M219 D237 F238 K239 A245 L262	F194-M241 HydrophobicContact CB-CE 4.16Å; F194-M241 HydrophobicContact CB-CG 4.48Å; F194-M241 HydrophobicContact CB-SD 3.85Å; F194-M241 HydrophobicContact CD1-CE 4.07Å; F194-M241 HydrophobicContact CD1-CG 3.84Å; F194-M241 HydrophobicContact CD1-SD 4.17Å; F194-M241 HydrophobicContact CG-CE 4.17Å; F194-M241 HydrophobicContact CG-SD 4.33Å; M214-M241 HydrophobicContact CB-CB 4.11Å; M214-M241 HydrophobicContact CG-CB 4.09Å; M214-M241 WeakPolarHBondContact O-CG 3.32Å; F216-M241 HydrophobicContact CD1-CE 4.26Å; F216-M241 HydrophobicContact CD1-SD 3.85Å; F216-M241 HydrophobicContact CE1-CE 3.67Å; F216-M241 HydrophobicContact CE1-SD 3.89Å; F216-M241 HydrophobicContact CE2-CE 4.44Å; F216-M241 HydrophobicContact CG-SD 4.24Å; F216-M241 HydrophobicContact CZ-CE 3.78Å; F216-M241 HydrophobicContact CZ-SD 4.3Å; M219-M241 HydrophobicContact SD-SD 4.4Å; D237-M241 WeakPolarHBondContact O-CB 3.43Å; D237-M241 PolarHBondContact O-N 3.45Å; F238-M241 HydrophobicContact CD2-CE 3.61Å; F238-M241 HydrophobicContact CE2-CE 3.63Å; K239-M241 PolarHBondContact O-N 2.99Å; M241-A245 PolarHBondContact O-N 2.87Å; M241-L262 HydrophobicContact CE-CD2 3.79Å
242	C	97.7	Very high	96.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.9	-42.9	178	-64.2	0	0	0	0	112.5	F238 K239 L240 A245 T246 L263	F238-C242 PolarHBondContact O-N 3.29Å; F238-C242 PolarHBondContact O-SG 2.59Å; K239-C242 PolarHBondContact O-N 3Å; L240-C242 VanDerWaalsContact C-N 3.33Å; L240-C242 PolarHBondContact O-N 2.95Å; C242-A245 PolarHBondContact O-N 3.47Å; C242-T246 PolarHBondContact O-N 2.97Å; C242-L263 HydrophobicContact CB-CB 3.84Å; C242-L263 HydrophobicContact CB-CD1 3.9Å; C242-L263 HydrophobicContact CB-CD2 4.34Å; C242-L263 HydrophobicContact CB-CG 4.24Å
243	D	97.8	Very high	96.3	Very high	39 Å²	39	50.6 Å²	50.6	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-66.7	-44.9	-177.3	-77.4	-13.9	0	0	0	111.1	K239 L240 A245 T246 V247	K239-D243 WeakPolarHBondContact CG-OD2 3.27Å; K239-D243 IonicContact NZ-OD2 2.6Å; K239-D243 PolarHBondContact NZ-OD2 3.37Å; K239-D243 WeakPolarHBondContact O-CB 3.25Å; K239-D243 PolarHBondContact O-N 3.22Å; L240-D243 PolarHBondContact O-N 2.95Å; D243-A245 VanDerWaalsContact C-N 3.27Å; D243-A245 PolarHBondContact O-N 3.35Å; D243-T246 WeakPolarHBondContact CA-OG1 3.49Å; D243-T246 CarbonylContact O-C 3.56Å; D243-T246 WeakPolarHBondContact O-CA 3.34Å; D243-T246 PolarHBondContact O-N 2.91Å; D243-T246 PolarHBondContact O-OG1 3.21Å; D243-V247 WeakPolarHBondContact O-CG2 3.42Å; D243-V247 PolarHBondContact O-N 3.34Å
244	N	97.5	Very high	96.4	Very high	15 Å²	15	51.9 Å²	51.9	8%	0.08	27%	0.268	C	S	.	.	H	α-helix	trans	-50.7	-46.4	173.4	-74.7	-19.7	0	0	0	111.8	I210 H212 L240 T246 V247 Y248	I210-N244 HydrophobicContact CD1-CB 4.12Å; I210-N244 HydrophobicContact CG2-CB 4.02Å; I210-N244 VanDerWaalsContact CG2-CG 3.47Å; H212-N244 PolarHBondContact O-ND2 3.1Å; L240-N244 WeakPolarHBondContact CD1-OD1 3.33Å; L240-N244 VanDerWaalsContact O-CB 3.27Å; L240-N244 WeakPolarHBondContact O-CB 3.43Å; L240-N244 PolarHBondContact O-N 3.5Å; L240-N244 PolarHBondContact O-ND2 2.85Å; N244-T246 VanDerWaalsContact C-N 3.29Å; N244-T246 PolarHBondContact O-N 3.21Å; N244-V247 PolarHBondContact O-N 2.87Å; N244-Y248 PolarHBondContact O-N 3.08Å
245	A	96.8	Very high	96.5	Very high	11 Å²	11	57 Å²	57	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-31	176.4	0	0	0	0	0	112.7	F194 M241 C242 D243 N249 A259	F194-A245 HydrophobicContact CE1-CB 3.71Å; F194-A245 HydrophobicContact CZ-CB 4.28Å; M241-A245 PolarHBondContact O-N 2.87Å; C242-A245 PolarHBondContact O-N 3.47Å; D243-A245 VanDerWaalsContact C-N 3.27Å; D243-A245 PolarHBondContact O-N 3.35Å; A245-N249 VanDerWaalsContact O-CB 3.25Å; A245-N249 WeakPolarHBondContact O-CB 3.3Å; A245-N249 PolarHBondContact O-N 3.02Å; A245-N249 VanDerWaalsContact O-N 3.15Å; A245-N249 PolarHBondContact O-ND2 3.11Å; A245-A259 HydrophobicContact CB-CB 3.81Å
246	T	96.3	Very high	96.6	Very high	21 Å²	21	56.3 Å²	56.3	13%	0.129	28%	0.284	C	S	.	.	H	α-helix	trans	-84.4	-14.1	174.5	65.2	0	0	0	0	115.1	C242 D243 N244 Y256 A259 K260	C242-T246 PolarHBondContact O-N 2.97Å; D243-T246 WeakPolarHBondContact CA-OG1 3.49Å; D243-T246 CarbonylContact O-C 3.56Å; D243-T246 WeakPolarHBondContact O-CA 3.34Å; D243-T246 PolarHBondContact O-N 2.91Å; D243-T246 PolarHBondContact O-OG1 3.21Å; N244-T246 VanDerWaalsContact C-N 3.29Å; N244-T246 PolarHBondContact O-N 3.21Å; T246-Y256 HydrophobicContact CG2-CD1 4.48Å; T246-Y256 HydrophobicContact CG2-CD2 3.85Å; T246-Y256 HydrophobicContact CG2-CE2 3.94Å; T246-Y256 HydrophobicContact CG2-CG 4.13Å; T246-Y256 WeakPolarHBondContact O-CE2 3.28Å; T246-A259 HydrophobicContact CG2-CB 3.68Å; T246-K260 HydrophobicContact CG2-CD 3.86Å; T246-K260 HydrophobicContact CG2-CG 3.98Å
247	V	97	Very high	96.7	Very high	99 Å²	99	59.7 Å²	59.7	60%	0.6	29%	0.289	S	S	*	.	H	α-helix	trans	-84.4	-42.9	172.1	168.3	0	0	0	0	110.6	I209 I210 D243 N244	I209-V247 HydrophobicContact CG2-CG1 4.29Å; I210-V247 HydrophobicContact CD1-CB 4.07Å; I210-V247 HydrophobicContact CD1-CG1 3.86Å; D243-V247 WeakPolarHBondContact O-CG2 3.42Å; D243-V247 PolarHBondContact O-N 3.34Å; N244-V247 PolarHBondContact O-N 2.87Å
248	Y	97	Very high	96.6	Very high	60 Å²	60	59.8 Å²	59.8	24%	0.235	29%	0.293	C	S	.	.	H	α-helix	trans	-78	-41.9	-179.9	-178.5	-92	0	0	0	113.3	A203 P204 Y206 I209 N244	A203-Y248 WeakPolarHBondContact CA-OH 3.36Å; A203-Y248 HydrophobicContact CB-CE1 3.76Å; P204-Y248 PolarHBondContact O-OH 3.14Å; Y206-Y248 AromaticContact CD2-CD1 3.99Å; Y206-Y248 HydrophobicContact CD2-CD1 3.99Å; Y206-Y248 AromaticContact CD2-CD2 3.6Å; Y206-Y248 HydrophobicContact CD2-CD2 3.6Å; Y206-Y248 HydrophobicContact CD2-CE1 4.39Å; Y206-Y248 HydrophobicContact CD2-CE2 4.03Å; Y206-Y248 AromaticContact CD2-CG 3.59Å; Y206-Y248 HydrophobicContact CD2-CG 3.59Å; Y206-Y248 HydrophobicContact CE2-CD1 4.47Å; Y206-Y248 HydrophobicContact CE2-CD2 4.43Å; Y206-Y248 HydrophobicContact CE2-CG 4.06Å; Y206-Y248 HydrophobicContact CG-CD2 4.31Å; Y206-Y248 HydrophobicContact CG-CE2 4.48Å; I209-Y248 HydrophobicContact CD1-CD2 3.84Å; I209-Y248 HydrophobicContact CD1-CE2 3.91Å; N244-Y248 PolarHBondContact O-N 3.08Å
249	N	96.3	Very high	96.6	Very high	33 Å²	33	59.8 Å²	59.8	18%	0.176	29%	0.293	C	S	.	.	S	Bend	trans	-93.3	147.4	-175.6	-60.2	-85.2	0	0	0	112.2	A245 T253 Y255 Y256	A245-N249 VanDerWaalsContact O-CB 3.25Å; A245-N249 WeakPolarHBondContact O-CB 3.3Å; A245-N249 PolarHBondContact O-N 3.02Å; A245-N249 VanDerWaalsContact O-N 3.15Å; A245-N249 PolarHBondContact O-ND2 3.11Å; N249-T253 HydrophobicContact CB-CG2 4.47Å; N249-T253 WeakPolarHBondContact CB-OG1 3.34Å; N249-Y255 WeakPolarHBondContact OD1-CD2 3.32Å; N249-Y256 WeakPolarHBondContact O-CD2 3.49Å
250	R	95.3	Very high	96.6	Very high	188 Å²	188	59.2 Å²	59.2	71%	0.709	29%	0.29	S	S	*	.			trans	-74.6	152.7	175.3	-57.1	-172.5	179.5	-173.2	0.3	112.5	E252 T253 Y256	R250-E252 VanDerWaalsContact CB-OE2 3.23Å; R250-E252 WeakPolarHBondContact CB-OE2 3.44Å; R250-E252 PolarHBondContact O-N 3.46Å; R250-T253 HydrophobicContact CB-CG2 4.31Å; R250-T253 WeakPolarHBondContact O-CB 3.49Å; R250-T253 WeakPolarHBondContact O-CG2 3.23Å; R250-T253 PolarHBondContact O-N 2.86Å; R250-T253 PolarHBondContact O-OG1 2.95Å; R250-Y256 VanDerWaalsContact O-CB 3.25Å; R250-Y256 WeakPolarHBondContact O-CB 3.29Å
251	P	95.1	Very high	96.5	Very high	65 Å²	65	64.1 Å²	64.1	42%	0.422	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.7	-175.6	-26.4	36.1	0	0	0	115.8	T253 Y256 K257	P251-T253 VanDerWaalsContact C-N 3.31Å; P251-Y256 HydrophobicContact CB-CD1 4.27Å; P251-Y256 HydrophobicContact CB-CE1 4.12Å; P251-Y256 HydrophobicContact CB-CE2 4.41Å; P251-Y256 HydrophobicContact CG-CE2 4.12Å; P251-K257 VanDerWaalsContact O-CE 3.3Å; P251-K257 WeakPolarHBondContact O-CE 3.32Å
252	E	94.1	Very high	96.5	Very high	127 Å²	127	64.2 Å²	64.2	59%	0.593	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-23.5	-177.1	-55.4	66.3	-132.3	0	0	111.9	R250 K257	R250-E252 VanDerWaalsContact CB-OE2 3.23Å; R250-E252 WeakPolarHBondContact CB-OE2 3.44Å; R250-E252 PolarHBondContact O-N 3.46Å; E252-K257 WeakPolarHBondContact O-CE 3.27Å; E252-K257 PolarHBondContact O-NZ 3.31Å
253	T	96.1	Very high	96.4	Very high	42 Å²	42	65.6 Å²	65.6	26%	0.258	32%	0.317	S	S	.	.	S	Bend	trans	-69.1	154.8	-172.9	65.3	0	0	0	0	113.4	N249 R250 P251 Y255 Y256 K257	N249-T253 HydrophobicContact CB-CG2 4.47Å; N249-T253 WeakPolarHBondContact CB-OG1 3.34Å; R250-T253 HydrophobicContact CB-CG2 4.31Å; R250-T253 WeakPolarHBondContact O-CB 3.49Å; R250-T253 WeakPolarHBondContact O-CG2 3.23Å; R250-T253 PolarHBondContact O-N 2.86Å; R250-T253 PolarHBondContact O-OG1 2.95Å; P251-T253 VanDerWaalsContact C-N 3.31Å; T253-Y255 VanDerWaalsContact C-N 3.26Å; T253-Y255 PolarHBondContact O-N 3.43Å; T253-Y256 WeakPolarHBondContact OG1-CB 3.41Å; T253-Y256 PolarHBondContact OG1-N 3.02Å; T253-Y256 VanDerWaalsContact OG1-N 3.12Å; T253-K257 WeakPolarHBondContact O-CD 3.43Å; T253-K257 WeakPolarHBondContact O-CG 3.32Å; T253-K257 PolarHBondContact O-N 3.36Å
254	V	95.9	Very high	96.3	Very high	93 Å²	93	69.8 Å²	69.8	56%	0.564	34%	0.335	S	S	*	.	H	α-helix	trans	-60.9	-36.1	171.3	-64.2	0	0	0	0	111.9	F193 K257 A258	F193-V254 HydrophobicContact CZ-CG2 4.41Å; V254-K257 PolarHBondContact O-N 3.26Å; V254-A258 VanDerWaalsContact O-CB 3.22Å; V254-A258 WeakPolarHBondContact O-CB 3.46Å; V254-A258 PolarHBondContact O-N 3.27Å
255	Y	95.8	Very high	96.1	Very high	109 Å²	109	70.8 Å²	70.8	43%	0.427	34%	0.342	S	S	.	.	H	α-helix	trans	-67.5	-46	-178.1	-50	-59.3	0	0	0	112.4	F193 N249 T253 A258 A259	F193-Y255 HydrophobicContact CD1-CD1 4.03Å; F193-Y255 AromaticContact CD1-CE1 3.79Å; F193-Y255 HydrophobicContact CD1-CE1 3.79Å; F193-Y255 HydrophobicContact CD2-CD1 4.23Å; F193-Y255 HydrophobicContact CE1-CD1 4.16Å; F193-Y255 AromaticContact CE1-CE1 3.68Å; F193-Y255 HydrophobicContact CE1-CE1 3.68Å; F193-Y255 HydrophobicContact CE2-CD1 4.35Å; F193-Y255 HydrophobicContact CG-CD1 4.07Å; F193-Y255 HydrophobicContact CG-CE1 4.32Å; F193-Y255 HydrophobicContact CZ-CD1 4.32Å; F193-Y255 HydrophobicContact CZ-CE1 4.1Å; N249-Y255 WeakPolarHBondContact OD1-CD2 3.32Å; T253-Y255 VanDerWaalsContact C-N 3.26Å; T253-Y255 PolarHBondContact O-N 3.43Å; Y255-A258 PolarHBondContact O-N 3.21Å; Y255-A259 WeakPolarHBondContact O-CB 3.5Å; Y255-A259 PolarHBondContact O-N 3.38Å
256	Y	97.2	Very high	96	Very high	55 Å²	55	70.3 Å²	70.3	22%	0.216	34%	0.338	C	S	.	.	H	α-helix	trans	-62.2	-45.7	175.4	-174.1	-76.3	0	0	0	111.6	T246 N249 R250 P251 T253 A258 A259 K260	T246-Y256 HydrophobicContact CG2-CD1 4.48Å; T246-Y256 HydrophobicContact CG2-CD2 3.85Å; T246-Y256 HydrophobicContact CG2-CE2 3.94Å; T246-Y256 HydrophobicContact CG2-CG 4.13Å; T246-Y256 WeakPolarHBondContact O-CE2 3.28Å; N249-Y256 WeakPolarHBondContact O-CD2 3.49Å; R250-Y256 VanDerWaalsContact O-CB 3.25Å; R250-Y256 WeakPolarHBondContact O-CB 3.29Å; P251-Y256 HydrophobicContact CB-CD1 4.27Å; P251-Y256 HydrophobicContact CB-CE1 4.12Å; P251-Y256 HydrophobicContact CB-CE2 4.41Å; P251-Y256 HydrophobicContact CG-CE2 4.12Å; T253-Y256 WeakPolarHBondContact OG1-CB 3.41Å; T253-Y256 PolarHBondContact OG1-N 3.02Å; T253-Y256 VanDerWaalsContact OG1-N 3.12Å; Y256-A258 VanDerWaalsContact C-N 3.34Å; Y256-A258 PolarHBondContact O-N 3.09Å; Y256-A259 PolarHBondContact O-N 3.31Å; Y256-K260 HydrophobicContact CD1-CG 3.93Å; Y256-K260 HydrophobicContact CE1-CD 4.31Å; Y256-K260 HydrophobicContact CE1-CG 3.56Å; Y256-K260 PolarHBondContact O-N 3.47Å; Y256-K260 VanDerWaalsContact OH-CE 3.23Å; Y256-K260 WeakPolarHBondContact OH-CE 3.43Å
257	K	96.6	Very high	95.8	Very high	124 Å²	124	72.8 Å²	72.8	54%	0.539	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-38.4	179.2	-70.6	167.3	179.3	165.4	0	111.6	P251 E252 T253 V254 K261	P251-K257 VanDerWaalsContact O-CE 3.3Å; P251-K257 WeakPolarHBondContact O-CE 3.32Å; E252-K257 WeakPolarHBondContact O-CE 3.27Å; E252-K257 PolarHBondContact O-NZ 3.31Å; T253-K257 WeakPolarHBondContact O-CD 3.43Å; T253-K257 WeakPolarHBondContact O-CG 3.32Å; T253-K257 PolarHBondContact O-N 3.36Å; V254-K257 PolarHBondContact O-N 3.26Å; K257-K261 VanDerWaalsContact O-CB 3.25Å; K257-K261 WeakPolarHBondContact O-CB 3.42Å; K257-K261 PolarHBondContact O-N 2.95Å
258	A	96	Very high	95.6	Very high	24 Å²	24	74.6 Å²	74.6	20%	0.198	35%	0.347	C	S	.	.	H	α-helix	trans	-63.7	-48	171.5	0	0	0	0	0	111.3	F193 F194 V254 Y255 Y256 K261 L262	F193-A258 HydrophobicContact CD2-CB 3.92Å; F193-A258 HydrophobicContact CE2-CB 4.22Å; F194-A258 HydrophobicContact CE2-CB 4.27Å; V254-A258 VanDerWaalsContact O-CB 3.22Å; V254-A258 WeakPolarHBondContact O-CB 3.46Å; V254-A258 PolarHBondContact O-N 3.27Å; Y255-A258 PolarHBondContact O-N 3.21Å; Y256-A258 VanDerWaalsContact C-N 3.34Å; Y256-A258 PolarHBondContact O-N 3.09Å; A258-K261 PolarHBondContact O-N 2.71Å; A258-L262 VanDerWaalsContact O-CB 3.23Å; A258-L262 WeakPolarHBondContact O-CB 3.42Å; A258-L262 PolarHBondContact O-N 3.4Å
259	A	97.1	Very high	95.2	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.1	-50.7	179.4	0	0	0	0	0	112.6	F194 A245 T246 Y255 Y256 K261 L262 L263	F194-A259 HydrophobicContact CE1-CB 4.25Å; F194-A259 HydrophobicContact CZ-CB 3.8Å; A245-A259 HydrophobicContact CB-CB 3.81Å; T246-A259 HydrophobicContact CG2-CB 3.68Å; Y255-A259 WeakPolarHBondContact O-CB 3.5Å; Y255-A259 PolarHBondContact O-N 3.38Å; Y256-A259 PolarHBondContact O-N 3.31Å; A259-K261 VanDerWaalsContact C-N 3.35Å; A259-K261 PolarHBondContact O-N 2.86Å; A259-L262 PolarHBondContact O-N 2.72Å; A259-L263 VanDerWaalsContact O-CB 3.25Å; A259-L263 WeakPolarHBondContact O-CB 3.36Å; A259-L263 PolarHBondContact O-N 3.25Å
260	K	96.9	Very high	94.8	Very high	83 Å²	83	73.4 Å²	73.4	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-40.5	177.3	-69	-60.3	-172.7	-159.2	0	112.4	T246 Y256 H264	T246-K260 HydrophobicContact CG2-CD 3.86Å; T246-K260 HydrophobicContact CG2-CG 3.98Å; Y256-K260 HydrophobicContact CD1-CG 3.93Å; Y256-K260 HydrophobicContact CE1-CD 4.31Å; Y256-K260 HydrophobicContact CE1-CG 3.56Å; Y256-K260 PolarHBondContact O-N 3.47Å; Y256-K260 VanDerWaalsContact OH-CE 3.23Å; Y256-K260 WeakPolarHBondContact OH-CE 3.43Å; K260-H264 PolarHBondContact O-N 3.08Å; K260-H264 VanDerWaalsContact O-N 3.1Å
261	K	96.7	Very high	94.4	Very high	155 Å²	155	66 Å²	66	67%	0.674	32%	0.32	S	S	*	.	H	α-helix	trans	-67.5	-41.5	177.8	-177.4	-179.8	178.5	-177.5	0	112.1	K257 A258 A259 T265	K257-K261 VanDerWaalsContact O-CB 3.25Å; K257-K261 WeakPolarHBondContact O-CB 3.42Å; K257-K261 PolarHBondContact O-N 2.95Å; A258-K261 PolarHBondContact O-N 2.71Å; A259-K261 VanDerWaalsContact C-N 3.35Å; A259-K261 PolarHBondContact O-N 2.86Å; K261-T265 WeakPolarHBondContact O-CB 3.46Å; K261-T265 PolarHBondContact O-N 2.95Å; K261-T265 VanDerWaalsContact O-N 3.09Å; K261-T265 PolarHBondContact O-OG1 2.72Å
262	L	96.5	Very high	93.7	Very high	6 Å²	6	68.8 Å²	68.8	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-50.5	176.7	179.8	58.3	0	0	0	110.2	K188 F194 F216 F238 M241 A258 A259 H264 T265 G266	K188-L262 HydrophobicContact CB-CD1 3.69Å; F194-L262 HydrophobicContact CD1-CD2 4.41Å; F194-L262 HydrophobicContact CD2-CD2 3.44Å; F194-L262 VanDerWaalsContact CD2-CD2 3.44Å; F194-L262 HydrophobicContact CE2-CD2 3.64Å; F194-L262 HydrophobicContact CG-CD2 3.87Å; F194-L262 HydrophobicContact CZ-CD2 4.22Å; F216-L262 HydrophobicContact CE2-CD2 4.38Å; F216-L262 HydrophobicContact CZ-CD1 4.42Å; F216-L262 HydrophobicContact CZ-CD2 4.03Å; F238-L262 HydrophobicContact CE2-CD1 4.27Å; F238-L262 HydrophobicContact CE2-CD2 4.38Å; F238-L262 HydrophobicContact CE2-CG 3.95Å; F238-L262 HydrophobicContact CZ-CD1 4.31Å; F238-L262 HydrophobicContact CZ-CG 3.97Å; M241-L262 HydrophobicContact CE-CD2 3.79Å; A258-L262 VanDerWaalsContact O-CB 3.23Å; A258-L262 WeakPolarHBondContact O-CB 3.42Å; A258-L262 PolarHBondContact O-N 3.4Å; A259-L262 PolarHBondContact O-N 2.72Å; L262-H264 PolarHBondContact O-N 3.45Å; L262-T265 PolarHBondContact O-N 3.13Å; L262-T265 VanDerWaalsContact O-N 3.16Å; L262-G266 PolarHBondContact O-N 3.17Å
263	L	96.3	Very high	93	Very high	28 Å²	28	68.4 Å²	68.4	15%	0.147	33%	0.327	C	S	.	.	H	α-helix	trans	-53	-54.9	177.3	-177.9	62.7	0	0	0	112.2	F238 K239 C242 A259 T265 G266 F267	F238-L263 HydrophobicContact CE1-CD1 4.24Å; K239-L263 HydrophobicContact CB-CD1 4.42Å; K239-L263 HydrophobicContact CG-CD1 4.26Å; C242-L263 HydrophobicContact CB-CB 3.84Å; C242-L263 HydrophobicContact CB-CD1 3.9Å; C242-L263 HydrophobicContact CB-CD2 4.34Å; C242-L263 HydrophobicContact CB-CG 4.24Å; A259-L263 VanDerWaalsContact O-CB 3.25Å; A259-L263 WeakPolarHBondContact O-CB 3.36Å; A259-L263 PolarHBondContact O-N 3.25Å; L263-T265 VanDerWaalsContact C-N 3.31Å; L263-T265 PolarHBondContact O-N 3.04Å; L263-G266 PolarHBondContact O-N 3.29Å; L263-F267 HydrophobicContact CD1-CD2 3.67Å; L263-F267 HydrophobicContact CD1-CE2 3.5Å; L263-F267 VanDerWaalsContact CD1-CE2 3.5Å; L263-F267 HydrophobicContact CD1-CZ 4.47Å; L263-F267 HydrophobicContact CG-CD2 4.42Å; L263-F267 WeakPolarHBondContact O-CD2 3.39Å; L263-F267 PolarHBondContact O-N 3.39Å
264	H	95.4	Very high	92.3	Very high	127 Å²	127	73.5 Å²	73.5	59%	0.588	34%	0.342	S	S	*	.	H	α-helix	trans	-59.1	-42.7	178.3	178.1	87.7	0	0	0	111.7	K260 L262 K268	K260-H264 PolarHBondContact O-N 3.08Å; K260-H264 VanDerWaalsContact O-N 3.1Å; L262-H264 PolarHBondContact O-N 3.45Å; H264-K268 VanDerWaalsContact O-CB 3.31Å; H264-K268 WeakPolarHBondContact O-CB 3.48Å; H264-K268 PolarHBondContact O-N 3.33Å; H264-K268 VanDerWaalsContact O-N 3.1Å
265	T	94.6	Very high	91.5	Very high	37 Å²	37	70.1 Å²	70.1	23%	0.227	32%	0.321	C	S	.	.	H	α-helix	trans	-65.8	-44.5	179	-55.4	0	0	0	0	111.3	K188 K261 L262 L263 K268 M269	K188-T265 HydrophobicContact CD-CG2 3.94Å; K188-T265 HydrophobicContact CG-CG2 3.85Å; K261-T265 WeakPolarHBondContact O-CB 3.46Å; K261-T265 PolarHBondContact O-N 2.95Å; K261-T265 VanDerWaalsContact O-N 3.09Å; K261-T265 PolarHBondContact O-OG1 2.72Å; L262-T265 PolarHBondContact O-N 3.13Å; L262-T265 VanDerWaalsContact O-N 3.16Å; L263-T265 VanDerWaalsContact C-N 3.31Å; L263-T265 PolarHBondContact O-N 3.04Å; T265-K268 CarbonylContact O-C 3.49Å; T265-K268 PolarHBondContact O-N 3.1Å; T265-M269 HydrophobicContact CG2-SD 4.1Å; T265-M269 VanDerWaalsContact O-CG 3.29Å; T265-M269 WeakPolarHBondContact O-CG 3.41Å; T265-M269 PolarHBondContact O-N 3.47Å
266	G	94.1	Very high	90.5	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-46	-179.4	0	0	0	0	0	112.8	L185 L262 L263 K268 M269 M270	L185-G266 VanDerWaalsContact CD2-CA 3.43Å; L262-G266 PolarHBondContact O-N 3.17Å; L263-G266 PolarHBondContact O-N 3.29Å; G266-K268 VanDerWaalsContact C-N 3.28Å; G266-K268 PolarHBondContact O-N 3.03Å; G266-M269 CarbonylContact O-C 3.56Å; G266-M269 PolarHBondContact O-N 2.94Å; G266-M270 WeakPolarHBondContact O-CE 3.27Å; G266-M270 PolarHBondContact O-N 2.88Å
267	F	92.9	Very high	89.7	Confident	74 Å²	74	69.9 Å²	69.9	33%	0.325	34%	0.337	S	S	.	.	H	α-helix	trans	-59.8	-39.4	173.8	-89.7	-114.2	0	0	0	111.8	K235 F238 K239 L263 M269 M270 S271	K235-F267 VanDerWaalsContact CE-CE1 3.48Å; K235-F267 HydrophobicContact CG-CE1 4.38Å; K235-F267 HydrophobicContact CG-CE2 4.3Å; K235-F267 HydrophobicContact CG-CZ 3.98Å; F238-F267 HydrophobicContact CD1-CD2 4.17Å; F238-F267 HydrophobicContact CD1-CE2 4.07Å; F238-F267 HydrophobicContact CE1-CD2 4.07Å; F238-F267 HydrophobicContact CE1-CE2 4.37Å; K239-F267 HydrophobicContact CB-CE2 4.06Å; K239-F267 HydrophobicContact CB-CZ 4.08Å; K239-F267 HydrophobicContact CD-CZ 4.1Å; K239-F267 HydrophobicContact CG-CE2 4.44Å; K239-F267 HydrophobicContact CG-CZ 4.27Å; L263-F267 HydrophobicContact CD1-CD2 3.67Å; L263-F267 HydrophobicContact CD1-CE2 3.5Å; L263-F267 VanDerWaalsContact CD1-CE2 3.5Å; L263-F267 HydrophobicContact CD1-CZ 4.47Å; L263-F267 HydrophobicContact CG-CD2 4.42Å; L263-F267 WeakPolarHBondContact O-CD2 3.39Å; L263-F267 PolarHBondContact O-N 3.39Å; F267-M269 VanDerWaalsContact C-N 3.29Å; F267-M269 PolarHBondContact O-N 2.87Å; F267-M270 CarbonylContact O-C 3.55Å; F267-M270 PolarHBondContact O-N 2.76Å; F267-S271 PolarHBondContact O-N 2.87Å
268	K	92.1	Very high	88.6	Confident	137 Å²	137	65.1 Å²	65.1	60%	0.596	32%	0.317	S	S	*	.	H	α-helix	trans	-70.5	-20.7	174.5	-171.3	165.3	-173.5	164.8	0	114	H264 T265 G266 R274	H264-K268 VanDerWaalsContact O-CB 3.31Å; H264-K268 WeakPolarHBondContact O-CB 3.48Å; H264-K268 PolarHBondContact O-N 3.33Å; H264-K268 VanDerWaalsContact O-N 3.1Å; T265-K268 CarbonylContact O-C 3.49Å; T265-K268 PolarHBondContact O-N 3.1Å; G266-K268 VanDerWaalsContact C-N 3.28Å; G266-K268 PolarHBondContact O-N 3.03Å; K268-R274 VanDerWaalsContact O-CG 3.32Å; K268-R274 WeakPolarHBondContact O-CG 3.41Å
269	M	88.5	Confident	87.2	Confident	55 Å²	55	67.6 Å²	67.6	27%	0.271	32%	0.323	S	S	.	.	H	α-helix	trans	-87.6	-19.9	173.1	-70.3	-174	72.6	0	0	112.8	F181 Q184 T265 G266 F267 R274	F181-M269 WeakPolarHBondContact CE1-O 3.45Å; Q184-M269 HydrophobicContact CB-CE 3.62Å; Q184-M269 HydrophobicContact CG-CE 4.01Å; T265-M269 HydrophobicContact CG2-SD 4.1Å; T265-M269 VanDerWaalsContact O-CG 3.29Å; T265-M269 WeakPolarHBondContact O-CG 3.41Å; T265-M269 PolarHBondContact O-N 3.47Å; G266-M269 CarbonylContact O-C 3.56Å; G266-M269 PolarHBondContact O-N 2.94Å; F267-M269 VanDerWaalsContact C-N 3.29Å; F267-M269 PolarHBondContact O-N 2.87Å; M269-R274 WeakPolarHBondContact O-CB 3.43Å
270	M	87.2	Confident	85.8	Confident	13 Å²	13	78.2 Å²	78.2	6%	0.064	36%	0.363	C	S	.	.	S	Bend	trans	-110.1	34.2	176.5	-60.2	-179.3	-75.1	0	0	112.2	F181 L185 F234 K235 F238 G266 F267	F181-M270 HydrophobicContact CD1-CG 3.89Å; F181-M270 HydrophobicContact CE1-CG 3.99Å; F181-M270 HydrophobicContact CG-CG 4.2Å; F181-M270 HydrophobicContact CG-SD 4.49Å; F181-M270 HydrophobicContact CZ-CG 4.36Å; L185-M270 HydrophobicContact CD1-CE 4.41Å; F234-M270 HydrophobicContact CD1-SD 3.93Å; F234-M270 HydrophobicContact CE1-SD 3.69Å; K235-M270 HydrophobicContact CG-CE 4.46Å; F238-M270 HydrophobicContact CB-CE 4.47Å; F238-M270 HydrophobicContact CD1-CE 3.57Å; F238-M270 HydrophobicContact CE1-CE 4.05Å; F238-M270 HydrophobicContact CG-CE 4.09Å; G266-M270 WeakPolarHBondContact O-CE 3.27Å; G266-M270 PolarHBondContact O-N 2.88Å; F267-M270 CarbonylContact O-C 3.55Å; F267-M270 PolarHBondContact O-N 2.76Å
271	S	87.3	Confident	84.4	Confident	31 Å²	31	78.3 Å²	78.3	22%	0.217	38%	0.375	C	S	.	.	S	Bend	trans	-80.8	159	170.5	79.2	0	0	0	0	111.4	F267 D273 R274 L275	F267-S271 PolarHBondContact O-N 2.87Å; S271-D273 VanDerWaalsContact C-N 3.34Å; S271-D273 PolarHBondContact O-N 2.79Å; S271-D273 PolarHBondContact OG-OD2 2.94Å; S271-R274 PolarHBondContact O-N 2.91Å; S271-R274 VanDerWaalsContact O-N 3.09Å; S271-R274 PolarHBondContact OG-N 3.17Å; S271-L275 PolarHBondContact O-N 2.9Å
272	K	80.1	Confident	83	Confident	125 Å²	125	72.4 Å²	72.4	54%	0.543	35%	0.35	S	S	.	.	H	α-helix	trans	-56.1	-48.1	179.8	-160.4	155.4	-175.3	154.1	0	110.5	R274 L275 L276 D299	K272-R274 PolarHBondContact O-N 2.8Å; K272-L275 PolarHBondContact O-N 3.33Å; K272-L276 HydrophobicContact CG-CD1 4.44Å; K272-L276 VanDerWaalsContact O-CG 3.28Å; K272-L276 WeakPolarHBondContact O-CG 3.38Å; K272-L276 PolarHBondContact O-N 2.93Å; K272-D299 IonicContact NZ-OD2 3.58Å; K272-D299 PolarHBondContact NZ-OD2 2.91Å
273	D	80	Confident	81.2	Confident	118 Å²	118	76.3 Å²	76.3	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-59.8	-39.1	174.2	2	-75.6	0	0	0	113.9	S271 A277	S271-D273 VanDerWaalsContact C-N 3.34Å; S271-D273 PolarHBondContact O-N 2.79Å; S271-D273 PolarHBondContact OG-OD2 2.94Å; D273-A277 WeakPolarHBondContact O-CB 3.45Å; D273-A277 PolarHBondContact O-N 3.27Å
274	R	81.6	Confident	79.7	Confident	150 Å²	150	77.2 Å²	77.2	57%	0.566	38%	0.381	S	S	*	.	H	α-helix	trans	-71	-35.7	176.3	-76.7	-54.9	-170.3	-174.6	-4.3	112.8	K268 M269 S271 K272 L278	K268-R274 VanDerWaalsContact O-CG 3.32Å; K268-R274 WeakPolarHBondContact O-CG 3.41Å; M269-R274 WeakPolarHBondContact O-CB 3.43Å; S271-R274 PolarHBondContact O-N 2.91Å; S271-R274 VanDerWaalsContact O-N 3.09Å; S271-R274 PolarHBondContact OG-N 3.17Å; K272-R274 PolarHBondContact O-N 2.8Å; R274-L278 WeakPolarHBondContact O-CB 3.48Å; R274-L278 PolarHBondContact O-N 3.03Å
275	L	78.6	Confident	77.9	Confident	22 Å²	22	71.8 Å²	71.8	12%	0.115	36%	0.356	C	S	.	.	H	α-helix	trans	-69	-41.5	173.5	-171.9	69.6	0	0	0	111.5	L177 F181 S271 K272 A277 L278 K279 L297	L177-L275 HydrophobicContact CD1-CD1 3.95Å; L177-L275 HydrophobicContact CD2-CD1 4.01Å; F181-L275 HydrophobicContact CE2-CD1 4.05Å; F181-L275 HydrophobicContact CZ-CD1 3.81Å; S271-L275 PolarHBondContact O-N 2.9Å; K272-L275 PolarHBondContact O-N 3.33Å; L275-A277 VanDerWaalsContact C-N 3.35Å; L275-A277 PolarHBondContact O-N 3.3Å; L275-L278 CarbonylContact O-C 3.41Å; L275-L278 WeakPolarHBondContact O-CA 3.39Å; L275-L278 WeakPolarHBondContact O-CB 3.49Å; L275-L278 PolarHBondContact O-N 2.95Å; L275-K279 PolarHBondContact O-N 2.9Å; L275-L297 HydrophobicContact CD2-CD1 3.98Å; L275-L297 HydrophobicContact CD2-CD2 3.45Å; L275-L297 VanDerWaalsContact CD2-CD2 3.45Å; L275-L297 HydrophobicContact CD2-CG 3.69Å
276	L	75.8	Confident	76.1	Confident	109 Å²	109	76.2 Å²	76.2	57%	0.571	37%	0.374	S	S	*	.	H	α-helix	trans	-61.4	-41.1	174.7	-70.3	169.7	0	0	0	112.1	K272 L278 K279 R280	K272-L276 HydrophobicContact CG-CD1 4.44Å; K272-L276 VanDerWaalsContact O-CG 3.28Å; K272-L276 WeakPolarHBondContact O-CG 3.38Å; K272-L276 PolarHBondContact O-N 2.93Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 3.09Å; L276-K279 PolarHBondContact O-N 3.24Å; L276-R280 PolarHBondContact O-N 3.46Å
277	A	78.4	Confident	74.3	Confident	50 Å²	50	83.4 Å²	83.4	41%	0.413	41%	0.412	S	S	.	.	H	α-helix	trans	-65.3	-33.6	172.4	0	0	0	0	0	112.7	D273 L275 R280 S281	D273-A277 WeakPolarHBondContact O-CB 3.45Å; D273-A277 PolarHBondContact O-N 3.27Å; L275-A277 VanDerWaalsContact C-N 3.35Å; L275-A277 PolarHBondContact O-N 3.3Å; A277-R280 PolarHBondContact O-N 3.29Å; A277-S281 PolarHBondContact O-N 2.83Å; A277-S281 PolarHBondContact O-OG 2.8Å
278	L	74.9	Confident	72.4	Confident	23 Å²	23	81 Å²	81	12%	0.12	40%	0.402	C	S	.	.	H	α-helix	trans	-73.4	-40.1	177.5	-168.2	61.7	0	0	0	111.9	L177 F181 R274 L275 L276 R280 S281 M282 M285	L177-L278 HydrophobicContact CD1-CD2 3.65Å; F181-L278 HydrophobicContact CE1-CD2 3.96Å; F181-L278 HydrophobicContact CZ-CD2 3.79Å; R274-L278 WeakPolarHBondContact O-CB 3.48Å; R274-L278 PolarHBondContact O-N 3.03Å; L275-L278 CarbonylContact O-C 3.41Å; L275-L278 WeakPolarHBondContact O-CA 3.39Å; L275-L278 WeakPolarHBondContact O-CB 3.49Å; L275-L278 PolarHBondContact O-N 2.95Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 3.09Å; L278-R280 VanDerWaalsContact C-N 3.26Å; L278-R280 PolarHBondContact O-N 3.37Å; L278-S281 WeakPolarHBondContact CA-OG 3.42Å; L278-S281 PolarHBondContact O-N 3.19Å; L278-S281 PolarHBondContact O-OG 3.29Å; L278-M282 HydrophobicContact CD1-CE 4.09Å; L278-M282 HydrophobicContact CD1-CG 3.59Å; L278-M282 HydrophobicContact CD1-SD 4.09Å; L278-M282 HydrophobicContact CD2-CE 4.31Å; L278-M282 HydrophobicContact CG-CE 4.2Å; L278-M282 HydrophobicContact CG-CG 3.93Å; L278-M282 WeakPolarHBondContact O-CG 3.23Å; L278-M282 PolarHBondContact O-N 3.48Å; L278-M285 HydrophobicContact CB-CE 4.33Å; L278-M285 HydrophobicContact CD2-CE 4.36Å; L278-M285 HydrophobicContact CG-CE 3.84Å
279	K	67.1	Low	70.5	Confident	76 Å²	76	77.9 Å²	77.9	33%	0.33	39%	0.392	S	S	.	.	H	α-helix	trans	-53.5	-43.7	169.6	179.8	-177.9	173.7	-174.5	0	111.3	L275 L276 S281 M285	L275-K279 PolarHBondContact O-N 2.9Å; L276-K279 PolarHBondContact O-N 3.24Å; K279-S281 PolarHBondContact O-N 2.85Å; K279-M285 HydrophobicContact CG-CB 4.41Å
280	R	67.4	Low	68.7	Low	223 Å²	223	83.4 Å²	83.4	84%	0.842	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.3	179.5	-155.6	171.6	-171.6	143.1	2.7	114.4	L276 A277 L278	L276-R280 PolarHBondContact O-N 3.46Å; A277-R280 PolarHBondContact O-N 3.29Å; L278-R280 VanDerWaalsContact C-N 3.26Å; L278-R280 PolarHBondContact O-N 3.37Å
281	S	67.3	Low	67	Low	85 Å²	85	87.9 Å²	87.9	59%	0.594	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	-3.3	-172.8	51.8	0	0	0	0	115.7	A277 L278 K279	A277-S281 PolarHBondContact O-N 2.83Å; A277-S281 PolarHBondContact O-OG 2.8Å; L278-S281 WeakPolarHBondContact CA-OG 3.42Å; L278-S281 PolarHBondContact O-N 3.19Å; L278-S281 PolarHBondContact O-OG 3.29Å; K279-S281 PolarHBondContact O-N 2.85Å
282	M	66.3	Low	65.5	Low	32 Å²	32	91 Å²	91	16%	0.158	45%	0.454	C	S	.	.			trans	-113.6	117.9	177	-64.6	-107	-91	0	0	109.9	H180 L278 F284 M285	H180-M282 HydrophobicContact CB-CE 3.91Å; L278-M282 HydrophobicContact CD1-CE 4.09Å; L278-M282 HydrophobicContact CD1-CG 3.59Å; L278-M282 HydrophobicContact CD1-SD 4.09Å; L278-M282 HydrophobicContact CD2-CE 4.31Å; L278-M282 HydrophobicContact CG-CE 4.2Å; L278-M282 HydrophobicContact CG-CG 3.93Å; L278-M282 WeakPolarHBondContact O-CG 3.23Å; L278-M282 PolarHBondContact O-N 3.48Å; M282-F284 VanDerWaalsContact C-N 3.33Å; M282-F284 HydrophobicContact CB-CD1 4.38Å; M282-F284 HydrophobicContact CB-CE1 4.14Å; M282-F284 HydrophobicContact CE-CE1 3.48Å; M282-F284 VanDerWaalsContact CE-CE1 3.48Å; M282-F284 HydrophobicContact CE-CZ 3.46Å; M282-F284 VanDerWaalsContact CE-CZ 3.46Å; M282-F284 PolarHBondContact O-N 3.03Å; M282-F284 HydrophobicContact SD-CE1 3.89Å; M282-F284 HydrophobicContact SD-CZ 4.44Å; M282-M285 HydrophobicContact CB-CE 3.77Å; M282-M285 HydrophobicContact CE-CE 4.28Å; M282-M285 HydrophobicContact CG-CE 3.99Å; M282-M285 PolarHBondContact O-N 3.21Å; M282-M285 VanDerWaalsContact O-N 3.1Å
283	S	58.5	Low	64.4	Low	88 Å²	88	86.8 Å²	86.8	62%	0.615	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-57.8	-40.7	-173.9	49.6	0	0	0	0	113.3	M285 Q286	S283-M285 PolarHBondContact O-N 3.42Å; S283-M285 VanDerWaalsContact O-N 3.11Å; S283-Q286 WeakPolarHBondContact O-CB 3.31Å; S283-Q286 PolarHBondContact O-N 3.13Å
284	F	64.9	Low	63.2	Low	47 Å²	47	82.8 Å²	82.8	21%	0.206	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-68.6	-7.8	-179.5	73.5	-98.7	0	0	0	114.9	P173 Q176 M282	P173-F284 HydrophobicContact CB-CD2 4.12Å; P173-F284 HydrophobicContact CB-CE2 4.45Å; P173-F284 WeakPolarHBondContact O-CE2 3.29Å; Q176-F284 HydrophobicContact CB-CD2 4.42Å; Q176-F284 HydrophobicContact CB-CE1 4.11Å; Q176-F284 HydrophobicContact CB-CE2 3.83Å; Q176-F284 HydrophobicContact CB-CZ 3.63Å; M282-F284 VanDerWaalsContact C-N 3.33Å; M282-F284 HydrophobicContact CB-CD1 4.38Å; M282-F284 HydrophobicContact CB-CE1 4.14Å; M282-F284 HydrophobicContact CE-CE1 3.48Å; M282-F284 VanDerWaalsContact CE-CE1 3.48Å; M282-F284 HydrophobicContact CE-CZ 3.46Å; M282-F284 VanDerWaalsContact CE-CZ 3.46Å; M282-F284 PolarHBondContact O-N 3.03Å; M282-F284 HydrophobicContact SD-CE1 3.89Å; M282-F284 HydrophobicContact SD-CZ 4.44Å
285	M	59.1	Low	62	Low	13 Å²	13	78.7 Å²	78.7	6%	0.064	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-101.7	2.5	172.8	-72.5	-164.7	-73.9	0	0	113.2	L177 L278 K279 M282 S283	L177-M285 HydrophobicContact CD1-CE 3.9Å; L177-M285 HydrophobicContact CD1-SD 4.06Å; L177-M285 HydrophobicContact CD2-SD 4.29Å; L278-M285 HydrophobicContact CB-CE 4.33Å; L278-M285 HydrophobicContact CD2-CE 4.36Å; L278-M285 HydrophobicContact CG-CE 3.84Å; K279-M285 HydrophobicContact CG-CB 4.41Å; M282-M285 HydrophobicContact CB-CE 3.77Å; M282-M285 HydrophobicContact CE-CE 4.28Å; M282-M285 HydrophobicContact CG-CE 3.99Å; M282-M285 PolarHBondContact O-N 3.21Å; M282-M285 VanDerWaalsContact O-N 3.1Å; S283-M285 PolarHBondContact O-N 3.42Å; S283-M285 VanDerWaalsContact O-N 3.11Å
286	Q	57.1	Low	60.9	Low	129 Å²	129	78.7 Å²	78.7	60%	0.603	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-30.3	177.2	-63.7	-177.3	-17.9	0	0	111.7	S283	S283-Q286 WeakPolarHBondContact O-CB 3.31Å; S283-Q286 PolarHBondContact O-N 3.13Å
287	D	55	Low	60	Low	152 Å²	152	75.9 Å²	75.9	81%	0.813	40%	0.403	S	S	*	.	S	Bend	trans	-93.9	1.2	-178.5	-50.1	-53.4	0	0	0	113.9
288	M	54.4	Low	58.5	Low	22 Å²	22	74.2 Å²	74.2	11%	0.108	39%	0.391	C	S	.	.			trans	-79.5	133	176.7	-68	-154.9	74.2	0	0	111.2	P173 Q292 Q293 I296	P173-M288 HydrophobicContact CB-CE 4.14Å; P173-M288 HydrophobicContact CB-CG 4.41Å; P173-M288 HydrophobicContact CB-SD 3.46Å; P173-M288 WeakPolarHBondContact CB-SD 3.33Å; P173-M288 HydrophobicContact CG-SD 4.21Å; M288-Q292 HydrophobicContact CE-CB 3.51Å; M288-Q292 HydrophobicContact CE-CG 4.4Å; M288-Q293 HydrophobicContact CB-CG 4.32Å; M288-Q293 PolarHBondContact O-NE2 3.28Å; M288-I296 HydrophobicContact CE-CD1 3.59Å; M288-I296 HydrophobicContact SD-CD1 3.99Å
289	D	52	Low	56.8	Low	73 Å²	73	77.7 Å²	77.7	39%	0.39	41%	0.409	S	S	.	.			trans	-69.6	171.3	171.8	65	44.9	0	0	0	112.7	T291 Q292 Q293	D289-T291 PolarHBondContact OD1-N 3.16Å; D289-T291 VanDerWaalsContact OD1-N 3.1Å; D289-Q292 WeakPolarHBondContact OD1-CB 3.5Å; D289-Q292 VanDerWaalsContact OD1-CG 3.3Å; D289-Q292 WeakPolarHBondContact OD1-CG 3.43Å; D289-Q292 PolarHBondContact OD1-N 3.46Å; D289-Q292 PolarHBondContact OD2-NE2 2.79Å; D289-Q293 WeakPolarHBondContact O-CG 3.26Å; D289-Q293 PolarHBondContact O-N 3.13Å; D289-Q293 PolarHBondContact O-NE2 2.86Å
290	F	48.9	Very low	55.6	Low	171 Å²	171	81.5 Å²	81.5	75%	0.75	43%	0.429	S	S	*	.	H	α-helix	trans	-69.9	-33.4	-179.5	-173.4	-102.5	0	0	0	112.4	Q293 A294	F290-Q293 WeakPolarHBondContact O-CB 3.43Å; F290-Q293 PolarHBondContact O-N 3.16Å; F290-A294 PolarHBondContact O-N 3.31Å
291	T	51.9	Low	54.2	Low	107 Å²	107	74.9 Å²	74.9	66%	0.656	41%	0.41	S	S	*	.	H	α-helix	trans	-67.3	-47.9	-176.9	-44.1	0	0	0	0	111.8	D289 Q293 A294 A295	D289-T291 PolarHBondContact OD1-N 3.16Å; D289-T291 VanDerWaalsContact OD1-N 3.1Å; T291-Q293 VanDerWaalsContact C-N 3.26Å; T291-Q293 PolarHBondContact O-N 3.39Å; T291-A294 PolarHBondContact O-N 2.86Å; T291-A295 PolarHBondContact O-N 3.1Å
292	Q	56.7	Low	52.6	Low	96 Å²	96	77.4 Å²	77.4	45%	0.449	42%	0.416	S	S	.	.	H	α-helix	trans	-67	-27.9	174	-64.9	176	56.7	0	0	111.8	M288 D289 I296	M288-Q292 HydrophobicContact CE-CB 3.51Å; M288-Q292 HydrophobicContact CE-CG 4.4Å; D289-Q292 WeakPolarHBondContact OD1-CB 3.5Å; D289-Q292 VanDerWaalsContact OD1-CG 3.3Å; D289-Q292 WeakPolarHBondContact OD1-CG 3.43Å; D289-Q292 PolarHBondContact OD1-N 3.46Å; D289-Q292 PolarHBondContact OD2-NE2 2.79Å; Q292-I296 WeakPolarHBondContact O-CB 3.34Å; Q292-I296 WeakPolarHBondContact O-CG1 3.34Å; Q292-I296 PolarHBondContact O-N 2.81Å
293	Q	56.3	Low	51.2	Low	37 Å²	37	81.5 Å²	81.5	17%	0.173	45%	0.445	C	S	.	.	H	α-helix	trans	-68.6	-42.8	172.5	-73.1	162.8	37.7	0	0	112	M288 D289 F290 T291 I296 L297	M288-Q293 HydrophobicContact CB-CG 4.32Å; M288-Q293 PolarHBondContact O-NE2 3.28Å; D289-Q293 WeakPolarHBondContact O-CG 3.26Å; D289-Q293 PolarHBondContact O-N 3.13Å; D289-Q293 PolarHBondContact O-NE2 2.86Å; F290-Q293 WeakPolarHBondContact O-CB 3.43Å; F290-Q293 PolarHBondContact O-N 3.16Å; T291-Q293 VanDerWaalsContact C-N 3.26Å; T291-Q293 PolarHBondContact O-N 3.39Å; Q293-I296 PolarHBondContact O-N 3.22Å; Q293-L297 VanDerWaalsContact O-CB 3.31Å; Q293-L297 WeakPolarHBondContact O-CB 3.36Å; Q293-L297 PolarHBondContact O-N 2.95Å
294	A	54.6	Low	50.3	Low	34 Å²	34	82.3 Å²	82.3	28%	0.281	46%	0.457	S	S	.	.	H	α-helix	trans	-62.3	-47.8	174	0	0	0	0	0	111.3	F290 T291 I296 L297 G298	F290-A294 PolarHBondContact O-N 3.31Å; T291-A294 PolarHBondContact O-N 2.86Å; A294-I296 VanDerWaalsContact C-N 3.31Å; A294-I296 PolarHBondContact O-N 3.38Å; A294-L297 PolarHBondContact O-N 3.09Å; A294-G298 PolarHBondContact O-N 3.23Å
295	A	56	Low	48.8	Very low	64 Å²	64	87 Å²	87	53%	0.529	48%	0.484	S	S	.	.	H	α-helix	trans	-61.1	-34.7	176.6	0	0	0	0	0	113.5	T291	T291-A295 PolarHBondContact O-N 3.1Å
296	I	56.4	Low	47.4	Very low	21 Å²	21	93.2 Å²	93.2	11%	0.108	52%	0.517	C	S	.	.	H	α-helix	trans	-71.6	-34.9	172	-75.4	175.4	0	0	0	111.5	R174 L177 V231 M288 Q292 Q293 A294	R174-I296 HydrophobicContact CB-CD1 3.85Å; R174-I296 HydrophobicContact CB-CG1 4.03Å; R174-I296 HydrophobicContact CG-CG1 4.33Å; R174-I296 HydrophobicContact CG-CG2 4.48Å; L177-I296 HydrophobicContact CD2-CG2 3.99Å; V231-I296 WeakPolarHBondContact CB-O 3.37Å; V231-I296 HydrophobicContact CG2-CG2 3.65Å; V231-I296 VanDerWaalsContact CG2-O 3.26Å; V231-I296 WeakPolarHBondContact CG2-O 3.3Å; V231-I296 PolarHBondContact N-O 3.47Å; M288-I296 HydrophobicContact CE-CD1 3.59Å; M288-I296 HydrophobicContact SD-CD1 3.99Å; Q292-I296 WeakPolarHBondContact O-CB 3.34Å; Q292-I296 WeakPolarHBondContact O-CG1 3.34Å; Q292-I296 PolarHBondContact O-N 2.81Å; Q293-I296 PolarHBondContact O-N 3.22Å; A294-I296 VanDerWaalsContact C-N 3.31Å; A294-I296 PolarHBondContact O-N 3.38Å
297	L	56.3	Low	46.2	Very low	51 Å²	51	92.3 Å²	92.3	27%	0.267	52%	0.522	S	S	.	.	H	α-helix	trans	-76.9	-29.6	-176.6	-100	165.1	0	0	0	114.3	T232 L275 Q293 A294	T232-L297 WeakPolarHBondContact CG2-O 3.47Å; L275-L297 HydrophobicContact CD2-CD1 3.98Å; L275-L297 HydrophobicContact CD2-CD2 3.45Å; L275-L297 VanDerWaalsContact CD2-CD2 3.45Å; L275-L297 HydrophobicContact CD2-CG 3.69Å; Q293-L297 VanDerWaalsContact O-CB 3.31Å; Q293-L297 WeakPolarHBondContact O-CB 3.36Å; Q293-L297 PolarHBondContact O-N 2.95Å; A294-L297 PolarHBondContact O-N 3.09Å
298	G	47.4	Very low	44.9	Very low	15 Å²	15	93.1 Å²	93.1	16%	0.155	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	40.6	-175	0	0	0	0	0	113	A294 E300	A294-G298 PolarHBondContact O-N 3.23Å; G298-E300 VanDerWaalsContact C-N 3.27Å; G298-E300 PolarHBondContact O-N 3.19Å
299	D	38.9	Very low	43.9	Very low	95 Å²	95	97.6 Å²	97.6	51%	0.508	56%	0.556	S	S	.	*			trans	-77.4	86.2	157.4	-71.1	-23.6	0	0	0	105.6	K272 D301	K272-D299 IonicContact NZ-OD2 3.58Å; K272-D299 PolarHBondContact NZ-OD2 2.91Å; D299-D301 PolarHBondContact O-N 3.13Å
300	E	41.3	Very low	42.7	Very low	157 Å²	157	102.8 Å²	102.8	73%	0.734	58%	0.578	S	S	*	*			trans	-78.6	49.1	-168.7	-71.2	-83.6	129.1	0	0	114	G298	G298-E300 VanDerWaalsContact C-N 3.27Å; G298-E300 PolarHBondContact O-N 3.19Å
301	D	39.1	Very low	41.7	Very low	83 Å²	83	99.5 Å²	99.5	44%	0.444	58%	0.583	S	S	.	*			trans	-127.1	78.5	-178.9	-76.8	-69.1	0	0	0	111.6	D299 F334	D299-D301 PolarHBondContact O-N 3.13Å; D301-F334 HydrophobicContact CB-CE1 4.15Å; D301-F334 HydrophobicContact CB-CZ 4.45Å; D301-F334 WeakPolarHBondContact OD2-CE2 3.28Å; D301-F334 WeakPolarHBondContact OD2-CZ 3.5Å
302	L	32.6	Very low	40.3	Very low	139 Å²	139	100.4 Å²	100.4	73%	0.728	59%	0.588	S	S	*	*			trans	-163.9	116.3	156.2	-116.5	163.1	0	0	0	110.9
303	P	37.6	Very low	39.3	Very low	118 Å²	118	100.8 Å²	100.8	77%	0.766	60%	0.599	S	S	*	*			trans	-72.5	151.2	177.7	29.2	-35.9	0	0	0	112.9	D305	P303-D305 PolarHBondContact O-N 3.45Å
304	A	40.8	Very low	37.8	Very low	105 Å²	105	106.4 Å²	106.4	87%	0.868	63%	0.629	S	S	*	*			trans	-86.4	99.5	-177.8	0	0	0	0	0	113.4
305	D	31.6	Very low	36.5	Very low	144 Å²	144	112.6 Å²	112.6	77%	0.77	65%	0.652	S	S	*	*			trans	-170.1	132.4	161.2	-121.1	-16.2	0	0	0	105.8	P303	P303-D305 PolarHBondContact O-N 3.45Å
306	L	29.8	Very low	35	Very low	145 Å²	145	115.2 Å²	115.2	76%	0.759	66%	0.661	S	S	*	*			cis	-156.6	-168.9	25.8	-80.2	154.5	0	0	0	108.2
307	P	33.6	Very low	33.5	Very low	109 Å²	109	122 Å²	122	71%	0.708	69%	0.693	S	S	*	*				-125.7	176.8	-57.2	37.7	-23.4	0	0	0	112.5
308	L	26.6	Very low	32.1	Very low	170 Å²	170	124.1 Å²	124.1	89%	0.89	71%	0.712	S	S	*	*			trans	-132.1	159.1	160.6	-87.8	176.5	0	0	0	110.4
309	P	33.1	Very low	30.9	Very low	115 Å²	115	128.4 Å²	128.4	75%	0.747	74%	0.735	S	S	*	*			trans	-84.2	134.3	-144.8	29.7	-36.8	0	0	0	117
310	E	26.6	Very low	30.3	Very low	183 Å²	183	135.3 Å²	135.3	86%	0.855	75%	0.754	S	S	*	*			trans	27.8	99.5	134.1	-167.1	166	-143.7	0	0	119.3
311	A	27.9	Very low	29.4	Very low	102 Å²	102	137.7 Å²	137.7	84%	0.843	76%	0.762	S	S	*	*			trans	-148.6	108.4	144.8	0	0	0	0	0	110
312	T	23.8	Very low	29.1	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	78%	0.776	S	S	*	*			trans	-92.3	169.1	172.3	43.6	0	0	0	0	109.6
313	P	34.5	Very low	28.6	Very low	104 Å²	104	142.7 Å²	142.7	68%	0.675	79%	0.785	S	S	*	*			cis	-152.5	176.8	30.4	45.5	-24.8	0	0	0	120.4
314	L	26	Very low	28.1	Very low	154 Å²	154	146.6 Å²	146.6	81%	0.806	79%	0.79	S	S	*	*			trans	73	144.1	155.2	-73.2	160.9	0	0	0	117.6
315	Q	26.3	Very low	28.1	Very low	164 Å²	164	146.9 Å²	146.9	77%	0.766	78%	0.784	S	S	*	*			cis	-143	155.4	11.5	-71.2	-162.5	-57.9	0	0	114.6
316	V	25.4	Very low	28.2	Very low	119 Å²	119	145.4 Å²	145.4	72%	0.721	78%	0.782	S	S	*	*				39.2	142.8	129.3	-179	0	0	0	0	120.7
317	E	25.3	Very low	28.1	Very low	165 Å²	165	144.1 Å²	144.1	77%	0.771	78%	0.78	S	S	*	*			cis	-177.4	160.4	-19.6	179.8	173.7	175.5	0	0	109.1
318	S	26.1	Very low	27.8	Very low	95 Å²	95	147.3 Å²	147.3	66%	0.664	78%	0.783	S	S	*	*			trans	127.6	90.8	141.8	-160.3	0	0	0	0	120.1
319	T	22.4	Very low	27.8	Very low	104 Å²	104	146 Å²	146	64%	0.638	78%	0.776	S	S	*	*				44.8	134	127.9	76.9	0	0	0	0	125.2
320	R	25.8	Very low	27.6	Very low	241 Å²	241	147.3 Å²	147.3	91%	0.909	78%	0.776	S	S	*	*			trans	123.4	148.6	138.1	-58.8	-169.3	-169.3	-152.3	-3	117.6
321	K	23.5	Very low	27.6	Very low	207 Å²	207	146.5 Å²	146.5	90%	0.9	78%	0.777	S	S	*	*			trans	-132.7	-175.9	-168.8	-72.7	-171.2	-179.3	-177.2	0	109.2
322	P	32.7	Very low	27.6	Very low	115 Å²	115	151.2 Å²	151.2	75%	0.747	77%	0.774	S	S	*	*			cis	-131.2	179	-43.8	34	-17.4	0	0	0	113
323	K	22.3	Very low	28	Very low	211 Å²	211	152.9 Å²	152.9	92%	0.917	78%	0.778	S	S	*	*			trans	-166	158.3	148	-106.6	154.3	-174.3	178.2	0	112
324	K	26.7	Very low	27.9	Very low	200 Å²	200	154 Å²	154	87%	0.87	77%	0.772	S	S	*	*			trans	-158.5	168	-178.4	-94.6	-166.3	178	-172.9	0	108.6
325	P	40.5	Very low	28.3	Very low	112 Å²	112	154.3 Å²	154.3	73%	0.727	77%	0.77	S	S	*	*			cis	-121.3	-159.8	-38.1	39.6	-21.8	0	0	0	109.1
326	P	33.5	Very low	28.8	Very low	112 Å²	112	150.5 Å²	150.5	73%	0.727	76%	0.759	S	S	*	*				-151.6	154.2	72.1	39.4	-18.5	0	0	0	118.6
327	V	27.3	Very low	29.2	Very low	118 Å²	118	150.7 Å²	150.7	72%	0.715	75%	0.752	S	S	*	*			trans	75	114.3	136.5	166	0	0	0	0	121.3
328	K	27.6	Very low	29.5	Very low	177 Å²	177	146.6 Å²	146.6	77%	0.77	75%	0.754	S	S	*	*			trans	72.1	144.6	146.3	-69.6	-177.8	-176.4	-173.7	0	120.3
329	D	26.2	Very low	29.9	Very low	141 Å²	141	148.8 Å²	148.8	75%	0.754	76%	0.758	S	S	*	*			cis	-133.5	152.5	-5.3	-90.4	-46.7	0	0	0	110.5
330	I	29.1	Very low	30.5	Very low	144 Å²	144	148 Å²	148	74%	0.738	76%	0.763	S	S	*	*			trans	-137.8	123.4	175.9	36.5	168.8	0	0	0	110.1	Y332	I330-Y332 HydrophobicContact CB-CD2 4.38Å; I330-Y332 HydrophobicContact CD1-CD2 4.25Å; I330-Y332 HydrophobicContact CD1-CE2 4.08Å
331	N	26	Very low	30.8	Very low	165 Å²	165	143.3 Å²	143.3	88%	0.882	77%	0.765	S	S	*	*			trans	-100.3	102.6	176.3	-175.2	43	0	0	0	109.4
332	Y	29.2	Very low	31.6	Very low	201 Å²	201	138.2 Å²	138.2	79%	0.788	76%	0.756	S	S	*	*			trans	-95.1	131.6	177.3	-96.7	-87.5	0	0	0	111.4	I330	I330-Y332 HydrophobicContact CB-CD2 4.38Å; I330-Y332 HydrophobicContact CD1-CD2 4.25Å; I330-Y332 HydrophobicContact CD1-CE2 4.08Å
333	L	32.3	Very low	32.1	Very low	162 Å²	162	140.8 Å²	140.8	85%	0.848	76%	0.762	S	S	*	*			trans	-138	105.1	161.1	172.2	71	0	0	0	107.2
334	F	32.3	Very low	32.8	Very low	128 Å²	128	137.6 Å²	137.6	56%	0.561	76%	0.76	S	S	*	*			trans	-162.5	167.1	138.8	-157.2	-117.8	0	0	0	111.5	D301	D301-F334 HydrophobicContact CB-CE1 4.15Å; D301-F334 HydrophobicContact CB-CZ 4.45Å; D301-F334 WeakPolarHBondContact OD2-CE2 3.28Å; D301-F334 WeakPolarHBondContact OD2-CZ 3.5Å
335	E	34.2	Very low	34	Very low	160 Å²	160	135.6 Å²	135.6	75%	0.748	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-94.7	172.9	176.5	-60	-158.9	127.8	0	0	111.3
336	P	37	Very low	34.3	Very low	83 Å²	83	135.6 Å²	135.6	54%	0.539	76%	0.762	S	S	.	*	P	Polyproline II helix	trans	-94.2	134.4	175.7	28.5	-18.9	0	0	0	112.7	R366	P336-R366 VanDerWaalsContact CG-NH2 3.28Å
337	E	33.4	Very low	35.3	Very low	123 Å²	123	135.5 Å²	135.5	58%	0.575	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.4	161.9	167.4	-77.2	-165.6	93.2	0	0	113.3
338	G	32.4	Very low	36.7	Very low	79 Å²	79	133.5 Å²	133.5	81%	0.814	76%	0.756	S	S	*	*			trans	-146.9	66.4	175.1	0	0	0	0	0	113.4
339	N	33.8	Very low	38.1	Very low	141 Å²	141	132.6 Å²	132.6	75%	0.754	75%	0.754	S	S	*	*			trans	-97.5	144.3	163.8	-79.3	-47.9	0	0	0	109.2
340	A	34.5	Very low	39.5	Very low	89 Å²	89	133.7 Å²	133.7	74%	0.736	75%	0.754	S	S	*	*			cis	-162.2	170.3	-12.3	0	0	0	0	0	107.9
341	C	32	Very low	41.2	Very low	141 Å²	141	133.1 Å²	133.1	95%	0.953	75%	0.749	S	S	*	*			trans	-152.6	138.6	156.2	-138.9	0	0	0	0	111.6
342	S	40.5	Very low	43.4	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	73%	0.732	S	S	*	*			trans	-121.6	143.9	-176.1	54.6	0	0	0	0	111.9
343	L	44.2	Very low	45.6	Very low	169 Å²	169	125.1 Å²	125.1	89%	0.885	72%	0.722	S	S	*	*			trans	51.9	80.7	154.3	-68.8	165.8	0	0	0	118.1
344	T	36.8	Very low	47.7	Very low	143 Å²	143	119.9 Å²	119.9	88%	0.877	70%	0.702	S	S	*	*				-147.7	136.5	128.2	45.7	0	0	0	0	110
345	D	50.5	Low	50.1	Low	158 Å²	158	119.3 Å²	119.3	85%	0.845	70%	0.704	S	S	*	*			trans	-69.4	158.3	169.1	-75.9	-59.5	0	0	0	112.1
346	S	47.6	Very low	52.5	Low	112 Å²	112	116.1 Å²	116.1	78%	0.783	70%	0.695	S	S	*	*	S	Bend	trans	76.2	60.2	162.5	-53.2	0	0	0	0	120.1
347	T	55.2	Low	54.6	Low	111 Å²	111	118.7 Å²	118.7	68%	0.681	70%	0.7	S	S	*	*			trans	-167.4	38.5	139.1	43.1	0	0	0	0	112.3	E349	T347-E349 PolarHBondContact O-N 3.02Å
348	A	56.9	Low	57	Low	76 Å²	76	118.9 Å²	118.9	63%	0.628	70%	0.701	S	S	*	*	H	α-helix	trans	-73.5	-19.3	-158.9	0	0	0	0	0	117.4	V352	A348-V352 VanDerWaalsContact O-CG2 3.24Å; A348-V352 WeakPolarHBondContact O-CG2 3.35Å; A348-V352 PolarHBondContact O-N 3.46Å
349	E	55.5	Low	59.1	Low	158 Å²	158	118.1 Å²	118.1	74%	0.738	68%	0.683	S	S	*	*	H	α-helix	trans	-77.4	-53.2	-165	-164.8	164.1	-174.4	0	0	113.9	T347 H351 V352 L353	T347-E349 PolarHBondContact O-N 3.02Å; E349-H351 VanDerWaalsContact C-N 3.33Å; E349-H351 PolarHBondContact O-N 3.3Å; E349-V352 PolarHBondContact O-N 3Å; E349-L353 PolarHBondContact O-N 3.33Å; E349-L353 VanDerWaalsContact O-N 3.08Å
350	E	55.8	Low	61.4	Low	163 Å²	163	114 Å²	114	76%	0.762	67%	0.669	S	S	*	*	H	α-helix	trans	-64.5	-35.8	179.3	-66	-171.5	158.3	0	0	112.5	V352 L353 A354	E350-V352 VanDerWaalsContact C-N 3.35Å; E350-V352 PolarHBondContact O-N 3.25Å; E350-L353 PolarHBondContact O-N 3.45Å; E350-A354 WeakPolarHBondContact O-CB 3.28Å; E350-A354 PolarHBondContact O-N 2.75Å
351	H	64.9	Low	63.7	Low	133 Å²	133	112.9 Å²	112.9	62%	0.616	65%	0.65	S	S	*	*	H	α-helix	trans	-68.1	-32.1	176.7	-73.7	-60.1	0	0	0	113	E349 L355	E349-H351 VanDerWaalsContact C-N 3.33Å; E349-H351 PolarHBondContact O-N 3.3Å; H351-L355 VanDerWaalsContact O-CB 3.29Å; H351-L355 WeakPolarHBondContact O-CB 3.49Å; H351-L355 PolarHBondContact O-N 3.41Å; H351-L355 VanDerWaalsContact O-N 3.08Å
352	V	72.3	Confident	66.2	Low	87 Å²	87	109.6 Å²	109.6	53%	0.527	62%	0.621	S	S	.	*	H	α-helix	trans	-71.1	-42	172.6	166.8	0	0	0	0	110.8	A348 E349 E350 L355 V356	A348-V352 VanDerWaalsContact O-CG2 3.24Å; A348-V352 WeakPolarHBondContact O-CG2 3.35Å; A348-V352 PolarHBondContact O-N 3.46Å; E349-V352 PolarHBondContact O-N 3Å; E350-V352 VanDerWaalsContact C-N 3.35Å; E350-V352 PolarHBondContact O-N 3.25Å; V352-L355 PolarHBondContact O-N 3.39Å; V352-V356 HydrophobicContact CG1-CG2 4.44Å; V352-V356 WeakPolarHBondContact O-CB 3.19Å; V352-V356 VanDerWaalsContact O-CG2 3.3Å; V352-V356 WeakPolarHBondContact O-CG2 3.42Å; V352-V356 PolarHBondContact O-N 2.87Å
353	L	75.4	Confident	67.9	Low	111 Å²	111	106.9 Å²	106.9	58%	0.581	60%	0.604	S	S	*	*	H	α-helix	trans	-60	-49.3	175.1	-71.6	170	0	0	0	111.7	E349 E350 L355 V356 E357	E349-L353 PolarHBondContact O-N 3.33Å; E349-L353 VanDerWaalsContact O-N 3.08Å; E350-L353 PolarHBondContact O-N 3.45Å; L353-L355 VanDerWaalsContact C-N 3.32Å; L353-L355 PolarHBondContact O-N 2.98Å; L353-V356 PolarHBondContact O-N 3.07Å; L353-E357 WeakPolarHBondContact O-CB 3.46Å; L353-E357 PolarHBondContact O-N 2.85Å
354	A	76.3	Confident	69.3	Low	52 Å²	52	104.6 Å²	104.6	43%	0.43	58%	0.584	S	S	.	*	H	α-helix	trans	-62	-36.3	177.8	0	0	0	0	0	112.9	E350 H358	E350-A354 WeakPolarHBondContact O-CB 3.28Å; E350-A354 PolarHBondContact O-N 2.75Å; A354-H358 VanDerWaalsContact O-CB 3.25Å; A354-H358 WeakPolarHBondContact O-CB 3.36Å; A354-H358 PolarHBondContact O-N 2.97Å
355	L	84	Confident	71.1	Confident	115 Å²	115	101.2 Å²	101.2	60%	0.602	56%	0.561	S	S	*	*	H	α-helix	trans	-68.8	-39.9	175.4	-179.6	61.9	0	0	0	112.1	H351 V352 L353 S359	H351-L355 VanDerWaalsContact O-CB 3.29Å; H351-L355 WeakPolarHBondContact O-CB 3.49Å; H351-L355 PolarHBondContact O-N 3.41Å; H351-L355 VanDerWaalsContact O-N 3.08Å; V352-L355 PolarHBondContact O-N 3.39Å; L353-L355 VanDerWaalsContact C-N 3.32Å; L353-L355 PolarHBondContact O-N 2.98Å; L355-S359 VanDerWaalsContact O-CB 3.27Å; L355-S359 WeakPolarHBondContact O-CB 3.24Å; L355-S359 PolarHBondContact O-N 2.91Å; L355-S359 PolarHBondContact O-OG 3.07Å
356	V	82.9	Confident	72.3	Confident	93 Å²	93	97.8 Å²	97.8	56%	0.564	54%	0.536	S	S	*	.	H	α-helix	trans	-66.9	-44.1	175.6	169	0	0	0	0	111	V352 L353 S359 A360	V352-V356 HydrophobicContact CG1-CG2 4.44Å; V352-V356 WeakPolarHBondContact O-CB 3.19Å; V352-V356 VanDerWaalsContact O-CG2 3.3Å; V352-V356 WeakPolarHBondContact O-CG2 3.42Å; V352-V356 PolarHBondContact O-N 2.87Å; L353-V356 PolarHBondContact O-N 3.07Å; V356-S359 PolarHBondContact O-N 3.36Å; V356-A360 WeakPolarHBondContact O-CB 3.18Å; V356-A360 PolarHBondContact O-N 3.35Å
357	E	82.6	Confident	73	Confident	138 Å²	138	97.9 Å²	97.9	65%	0.645	53%	0.526	S	S	*	.	H	α-helix	trans	-63	-49.2	177.4	-173.1	168.8	-145.9	0	0	111.4	L353 S359 A360 D361	L353-E357 WeakPolarHBondContact O-CB 3.46Å; L353-E357 PolarHBondContact O-N 2.85Å; E357-S359 VanDerWaalsContact C-N 3.29Å; E357-S359 PolarHBondContact O-N 2.88Å; E357-A360 PolarHBondContact O-N 3.13Å; E357-D361 WeakPolarHBondContact O-CB 3.48Å; E357-D361 PolarHBondContact O-N 3.22Å
358	H	82.3	Confident	73.5	Confident	127 Å²	127	97 Å²	97	59%	0.588	52%	0.518	S	S	*	.	H	α-helix	trans	-58.8	-39.4	174.2	-175.7	-72.5	0	0	0	112.2	A354 E362	A354-H358 VanDerWaalsContact O-CB 3.25Å; A354-H358 WeakPolarHBondContact O-CB 3.36Å; A354-H358 PolarHBondContact O-N 2.97Å; H358-E362 WeakPolarHBondContact O-CB 3.46Å; H358-E362 PolarHBondContact O-N 3.05Å
359	S	76.4	Confident	73.9	Confident	62 Å²	62	101.4 Å²	101.4	43%	0.434	52%	0.518	S	S	.	.	H	α-helix	trans	-67.9	-37.3	177.5	-59.9	0	0	0	0	112.5	L355 V356 E357 A363	L355-S359 VanDerWaalsContact O-CB 3.27Å; L355-S359 WeakPolarHBondContact O-CB 3.24Å; L355-S359 PolarHBondContact O-N 2.91Å; L355-S359 PolarHBondContact O-OG 3.07Å; V356-S359 PolarHBondContact O-N 3.36Å; E357-S359 VanDerWaalsContact C-N 3.29Å; E357-S359 PolarHBondContact O-N 2.88Å; S359-A363 WeakPolarHBondContact O-CB 3.42Å; S359-A363 PolarHBondContact O-N 3.13Å
360	A	83.7	Confident	73.9	Confident	56 Å²	56	103.3 Å²	103.3	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-70	-42.1	176.7	0	0	0	0	0	111.8	V356 E357 A363 R364	V356-A360 WeakPolarHBondContact O-CB 3.18Å; V356-A360 PolarHBondContact O-N 3.35Å; E357-A360 PolarHBondContact O-N 3.13Å; A360-A363 PolarHBondContact O-N 3.25Å; A360-R364 WeakPolarHBondContact O-CB 3.35Å; A360-R364 PolarHBondContact O-N 2.59Å
361	D	82.4	Confident	73.8	Confident	65 Å²	65	101.7 Å²	101.7	35%	0.348	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-42.5	175	-91.2	21.1	0	0	0	111.8	E357 A363 R364 D365	E357-D361 WeakPolarHBondContact O-CB 3.48Å; E357-D361 PolarHBondContact O-N 3.22Å; D361-A363 VanDerWaalsContact C-N 3.34Å; D361-A363 PolarHBondContact O-N 2.74Å; D361-R364 PolarHBondContact O-N 2.81Å; D361-R364 IonicContact OD1-CZ 3.47Å; D361-R364 IonicContact OD1-NH1 3.67Å; D361-R364 PolarHBondContact OD1-NH1 3.25Å; D361-R364 IonicContact OD1-NH2 3.9Å; D361-R364 PolarHBondContact OD1-NH2 2.85Å; D361-R364 VanDerWaalsContact OD1-NH2 3.09Å; D361-R364 IonicContact OD2-CZ 3.69Å; D361-R364 IonicContact OD2-NH1 2.62Å; D361-R364 IonicContact OD2-NH2 2.73Å; D361-R364 PolarHBondContact OD2-NH2 3.47Å; D361-D365 WeakPolarHBondContact O-CB 3.49Å; D361-D365 PolarHBondContact O-N 3.34Å
362	E	85.2	Confident	73.1	Confident	71 Å²	71	100.2 Å²	100.2	33%	0.332	52%	0.516	S	S	.	.	H	α-helix	trans	-65.9	-37.8	175.5	-147.9	-148.7	141.2	0	0	111.9	H358 D365 R366	H358-E362 WeakPolarHBondContact O-CB 3.46Å; H358-E362 PolarHBondContact O-N 3.05Å; E362-D365 PolarHBondContact O-N 3.15Å; E362-R366 WeakPolarHBondContact O-CB 3.35Å; E362-R366 WeakPolarHBondContact O-CG 3.36Å; E362-R366 PolarHBondContact O-N 2.92Å; E362-R366 IonicContact OE1-CZ 3.02Å; E362-R366 IonicContact OE1-NE 3.9Å; E362-R366 PolarHBondContact OE1-NE 2.85Å; E362-R366 IonicContact OE1-NH2 3.71Å; E362-R366 PolarHBondContact OE1-NH2 3.32Å; E362-R366 IonicContact OE2-CZ 3.51Å; E362-R366 IonicContact OE2-NE 3.7Å; E362-R366 IonicContact OE2-NH2 2.67Å; E362-R366 PolarHBondContact OE2-NH2 2.93Å
363	A	74.8	Confident	72.1	Confident	44 Å²	44	102.7 Å²	102.7	36%	0.364	53%	0.526	S	S	.	.	H	α-helix	trans	-63.3	-43.9	174.3	0	0	0	0	0	112.2	S359 A360 D361 R366 I367	S359-A363 WeakPolarHBondContact O-CB 3.42Å; S359-A363 PolarHBondContact O-N 3.13Å; A360-A363 PolarHBondContact O-N 3.25Å; D361-A363 VanDerWaalsContact C-N 3.34Å; D361-A363 PolarHBondContact O-N 2.74Å; A363-R366 PolarHBondContact O-N 3.34Å; A363-I367 WeakPolarHBondContact O-CG1 3.36Å; A363-I367 PolarHBondContact O-N 3.47Å
364	R	74.9	Confident	71	Confident	121 Å²	121	101.3 Å²	101.3	46%	0.457	53%	0.526	S	S	.	.	H	α-helix	trans	-58.7	-47.1	173.6	-177.7	-175	66.8	-141.2	-1.4	111.2	A360 D361 R366 I367 N368	A360-R364 WeakPolarHBondContact O-CB 3.35Å; A360-R364 PolarHBondContact O-N 2.59Å; D361-R364 PolarHBondContact O-N 2.81Å; D361-R364 IonicContact OD1-CZ 3.47Å; D361-R364 IonicContact OD1-NH1 3.67Å; D361-R364 PolarHBondContact OD1-NH1 3.25Å; D361-R364 IonicContact OD1-NH2 3.9Å; D361-R364 PolarHBondContact OD1-NH2 2.85Å; D361-R364 VanDerWaalsContact OD1-NH2 3.09Å; D361-R364 IonicContact OD2-CZ 3.69Å; D361-R364 IonicContact OD2-NH1 2.62Å; D361-R364 IonicContact OD2-NH2 2.73Å; D361-R364 PolarHBondContact OD2-NH2 3.47Å; R364-R366 VanDerWaalsContact C-N 3.35Å; R364-R366 PolarHBondContact O-N 3.46Å; R364-I367 PolarHBondContact O-N 3.02Å; R364-N368 PolarHBondContact O-N 3.33Å
365	D	74.8	Confident	70	Confident	73 Å²	73	103.7 Å²	103.7	39%	0.39	53%	0.527	S	S	.	.	H	α-helix	trans	-71.7	-27.8	-179.1	-80.1	15	0	0	0	112.8	D361 E362 R369	D361-D365 WeakPolarHBondContact O-CB 3.49Å; D361-D365 PolarHBondContact O-N 3.34Å; E362-D365 PolarHBondContact O-N 3.15Å; D365-R369 WeakPolarHBondContact O-CB 3.25Å; D365-R369 VanDerWaalsContact O-CG 3.3Å; D365-R369 WeakPolarHBondContact O-CG 3.22Å; D365-R369 PolarHBondContact O-N 3.39Å; D365-R369 VanDerWaalsContact O-N 3.15Å; D365-R369 PolarHBondContact O-NE 2.65Å
366	R	73.8	Confident	68.8	Low	85 Å²	85	105.1 Å²	105.1	32%	0.321	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-48.4	167.8	-73.5	168.2	-172.1	-171.6	13.5	110.2	P336 E362 A363 R364 N368 R369 Y370	P336-R366 VanDerWaalsContact CG-NH2 3.28Å; E362-R366 WeakPolarHBondContact O-CB 3.35Å; E362-R366 WeakPolarHBondContact O-CG 3.36Å; E362-R366 PolarHBondContact O-N 2.92Å; E362-R366 IonicContact OE1-CZ 3.02Å; E362-R366 IonicContact OE1-NE 3.9Å; E362-R366 PolarHBondContact OE1-NE 2.85Å; E362-R366 IonicContact OE1-NH2 3.71Å; E362-R366 PolarHBondContact OE1-NH2 3.32Å; E362-R366 IonicContact OE2-CZ 3.51Å; E362-R366 IonicContact OE2-NE 3.7Å; E362-R366 IonicContact OE2-NH2 2.67Å; E362-R366 PolarHBondContact OE2-NH2 2.93Å; A363-R366 PolarHBondContact O-N 3.34Å; R364-R366 VanDerWaalsContact C-N 3.35Å; R364-R366 PolarHBondContact O-N 3.46Å; R366-N368 PolarHBondContact O-N 2.81Å; R366-R369 PolarHBondContact O-N 3.09Å; R366-Y370 HydrophobicContact CB-CE2 4.39Å; R366-Y370 WeakPolarHBondContact O-CD2 3.25Å; R366-Y370 PolarHBondContact O-N 3.4Å; R366-Y370 VanDerWaalsContact O-N 3.09Å
367	I	62.4	Low	68	Low	114 Å²	114	102.1 Å²	102.1	59%	0.585	52%	0.52	S	S	*	.	H	α-helix	trans	-59.4	-48.9	178.3	-68.5	164.5	0	0	0	111.3	A363 R364 R369 Y370 M371	A363-I367 WeakPolarHBondContact O-CG1 3.36Å; A363-I367 PolarHBondContact O-N 3.47Å; R364-I367 PolarHBondContact O-N 3.02Å; I367-R369 PolarHBondContact O-N 2.84Å; I367-Y370 PolarHBondContact O-N 2.86Å; I367-M371 PolarHBondContact O-N 2.92Å
368	N	65.6	Low	67.5	Low	94 Å²	94	99.7 Å²	99.7	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-60.2	-32.6	177.6	-73.8	-18.9	0	0	0	112.9	R364 R366	R364-N368 PolarHBondContact O-N 3.33Å; R366-N368 PolarHBondContact O-N 2.81Å
369	R	67.1	Low	66.9	Low	167 Å²	167	99 Å²	99	63%	0.63	51%	0.505	S	S	*	.	H	α-helix	trans	-72.8	-30.6	174.3	-82.6	175.7	-85.1	173.1	-9.4	113.4	D365 R366 I367	D365-R369 WeakPolarHBondContact O-CB 3.25Å; D365-R369 VanDerWaalsContact O-CG 3.3Å; D365-R369 WeakPolarHBondContact O-CG 3.22Å; D365-R369 PolarHBondContact O-N 3.39Å; D365-R369 VanDerWaalsContact O-N 3.15Å; D365-R369 PolarHBondContact O-NE 2.65Å; R366-R369 PolarHBondContact O-N 3.09Å; I367-R369 PolarHBondContact O-N 2.84Å
370	Y	55.4	Low	66.7	Low	198 Å²	198	101.6 Å²	101.6	78%	0.776	51%	0.506	S	S	*	.	H	α-helix	trans	-87.4	-33.7	-178.5	-71.9	-58.5	0	0	0	114.1	R366 I367	R366-Y370 HydrophobicContact CB-CE2 4.39Å; R366-Y370 WeakPolarHBondContact O-CD2 3.25Å; R366-Y370 PolarHBondContact O-N 3.4Å; R366-Y370 VanDerWaalsContact O-N 3.09Å; I367-Y370 PolarHBondContact O-N 2.86Å
371	M	52.9	Low	66	Low	130 Å²	130	106 Å²	106	64%	0.64	51%	0.514	S	S	*	.			trans	-140.5	84.1	176.6	-69	-163.6	175.6	0	0	112.5	I367 N373 S374	I367-M371 PolarHBondContact O-N 2.92Å; M371-N373 PolarHBondContact O-N 3.18Å; M371-S374 PolarHBondContact O-N 3.29Å
372	P	49.3	Very low	65.5	Low	102 Å²	102	105.2 Å²	105.2	66%	0.662	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	4.7	-172.8	29.4	-37.3	0	0	0	115.6
373	N	52.2	Low	64.7	Low	138 Å²	138	107 Å²	107	74%	0.738	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146	37.8	178	-80.1	-51.3	0	0	0	111.3	M371 K375	M371-N373 PolarHBondContact O-N 3.18Å; N373-K375 PolarHBondContact O-N 3.36Å
374	S	51.5	Low	64.5	Low	83 Å²	83	111.6 Å²	111.6	58%	0.58	56%	0.555	S	S	*	*			trans	-72	90.4	-179.2	-172.4	0	0	0	0	111.7	M371 M376	M371-S374 PolarHBondContact O-N 3.29Å; S374-M376 PolarHBondContact O-N 2.83Å
375	K	55.5	Low	64	Low	101 Å²	101	107.8 Å²	107.8	44%	0.439	55%	0.554	S	S	.	*			trans	-56.9	97.9	171.9	-85.9	-179.9	163.8	-169.8	0	110.7	N373 Y389 V391 E403	N373-K375 PolarHBondContact O-N 3.36Å; K375-Y389 PolarHBondContact O-OH 2.99Å; K375-V391 HydrophobicContact CB-CG1 3.9Å; K375-V391 HydrophobicContact CD-CG1 3.73Å; K375-V391 HydrophobicContact CG-CG1 3.76Å; K375-E403 IonicContact NZ-OE1 3.74Å; K375-E403 IonicContact NZ-OE2 3.19Å; K375-E403 PolarHBondContact NZ-OE2 3.24Å
376	M	59.5	Low	63.8	Low	146 Å²	146	107 Å²	107	72%	0.719	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-62.3	140.4	169	-167.2	81.9	78.8	0	0	108.4	S374 V392	S374-M376 PolarHBondContact O-N 2.83Å; M376-V392 PolarHBondContact O-N 2.88Å
377	G	66.7	Low	63.8	Low	29 Å²	29	105.2 Å²	105.2	30%	0.299	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-162.1	153.7	178.6	0	0	0	0	0	112.3	T390	G377-T390 CarbonylContact C-O 3.54Å; G377-T390 WeakPolarHBondContact CA-O 3.4Å
378	Y	70.4	Confident	64.4	Low	88 Å²	88	100.9 Å²	100.9	35%	0.345	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	149.2	-175.2	64	-79.3	0	0	0	111.4	R380 T390 V392 E402	Y378-R380 HydrophobicContact CE2-CB 4.47Å; Y378-R380 PolarHBondContact OH-NH2 2.64Å; Y378-T390 HydrophobicContact CE1-CG2 3.72Å; Y378-T390 PolarHBondContact N-O 3.48Å; Y378-T390 PolarHBondContact O-N 3.38Å; Y378-V392 HydrophobicContact CD1-CG2 3.64Å; Y378-V392 HydrophobicContact CE1-CG2 3.55Å; Y378-E402 PolarHBondContact OH-OE1 3.41Å; Y378-E402 VanDerWaalsContact OH-OE1 3.06Å
379	L	70.3	Confident	64.6	Low	112 Å²	112	100.1 Å²	100.1	59%	0.586	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	117.7	175	-82.6	154.5	0	0	0	109.7	L387 L388 Y389 V407	L379-L387 HydrophobicContact CD2-CB 4.35Å; L379-L388 CarbonylContact C-O 3.53Å; L379-L388 WeakPolarHBondContact CA-O 3.35Å; L379-Y389 HydrophobicContact CG-CD2 4.41Å; L379-V407 HydrophobicContact CD2-CG2 4.44Å
380	R	71.4	Confident	64.7	Low	117 Å²	117	92.3 Å²	92.3	44%	0.442	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145	170.5	-166	-175.5	-64.6	-162	5	108.7	Y378 L387 L388 E402	Y378-R380 HydrophobicContact CE2-CB 4.47Å; Y378-R380 PolarHBondContact OH-NH2 2.64Å; R380-L387 WeakPolarHBondContact O-CA 3.03Å; R380-L388 PolarHBondContact N-O 2.8Å; R380-L388 PolarHBondContact O-N 3.25Å; R380-E402 IonicContact NH2-OE2 3.95Å
381	K	69.4	Low	65.5	Low	149 Å²	149	83.4 Å²	83.4	65%	0.648	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	123	168.7	-172.9	-175.5	172.9	-175.2	0	108.7	G385 S386 L387	K381-G385 WeakPolarHBondContact CE-O 3.4Å; K381-S386 WeakPolarHBondContact CA-O 3.42Å; K381-L387 HydrophobicContact CB-CD2 3.93Å; K381-L387 HydrophobicContact CG-CD2 4.28Å
382	D	73.5	Confident	65.9	Low	47 Å²	47	80.1 Å²	80.1	25%	0.251	44%	0.443	S	S	.	.			trans	-78.8	164.5	176.9	-78.4	-3.7	0	0	0	111.5	D384 G385 S386 L388	D382-D384 PolarHBondContact O-N 2.85Å; D382-G385 PolarHBondContact O-N 3.4Å; D382-S386 PolarHBondContact N-O 2.86Å; D382-L388 HydrophobicContact CB-CD1 4.48Å; D382-L388 WeakPolarHBondContact OD2-CD1 3.38Å; D382-L388 WeakPolarHBondContact OD2-CD2 3.29Å
383	A	67.8	Low	66.1	Low	110 Å²	110	79.4 Å²	79.4	91%	0.909	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.6	177.8	0	0	0	0	0	112.5	G385	A383-G385 PolarHBondContact O-N 3.48Å
384	D	71	Confident	66.1	Low	139 Å²	139	81.5 Å²	81.5	74%	0.743	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	6.1	176.9	-54.5	-25.7	0	0	0	113.7	D382 S386	D382-D384 PolarHBondContact O-N 2.85Å; D384-S386 PolarHBondContact O-N 2.84Å
385	G	63.8	Low	66	Low	41 Å²	41	83.9 Å²	83.9	42%	0.423	45%	0.445	S	S	.	.	S	Bend	trans	82.2	-13.1	178.4	0	0	0	0	0	115.4	K381 D382 A383	K381-G385 WeakPolarHBondContact CE-O 3.4Å; D382-G385 PolarHBondContact O-N 3.4Å; A383-G385 PolarHBondContact O-N 3.48Å
386	S	70	Confident	65.5	Low	57 Å²	57	84.6 Å²	84.6	40%	0.399	45%	0.454	S	S	.	.			trans	-66.8	151.7	177.8	-66.9	0	0	0	0	112.6	K381 D382 D384	K381-S386 WeakPolarHBondContact CA-O 3.42Å; D382-S386 PolarHBondContact N-O 2.86Å; D384-S386 PolarHBondContact O-N 2.84Å
387	L	73.6	Confident	65	Low	48 Å²	48	83.3 Å²	83.3	25%	0.251	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130	174.3	-72.7	165.2	0	0	0	110.5	L379 R380 K381 V407 L409	L379-L387 HydrophobicContact CD2-CB 4.35Å; R380-L387 WeakPolarHBondContact O-CA 3.03Å; K381-L387 HydrophobicContact CB-CD2 3.93Å; K381-L387 HydrophobicContact CG-CD2 4.28Å; L387-V407 PolarHBondContact O-N 2.68Å; L387-L409 HydrophobicContact CD1-CD1 3.43Å; L387-L409 VanDerWaalsContact CD1-CD1 3.43Å; L387-L409 HydrophobicContact CD1-CG 3.96Å
388	L	75.4	Confident	64.2	Low	22 Å²	22	89.1 Å²	89.1	12%	0.115	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.3	172.9	-85.3	67	0	0	0	109.5	L379 R380 D382 H405 K406	L379-L388 CarbonylContact C-O 3.53Å; L379-L388 WeakPolarHBondContact CA-O 3.35Å; R380-L388 PolarHBondContact N-O 2.8Å; R380-L388 PolarHBondContact O-N 3.25Å; D382-L388 HydrophobicContact CB-CD1 4.48Å; D382-L388 WeakPolarHBondContact OD2-CD1 3.38Å; D382-L388 WeakPolarHBondContact OD2-CD2 3.29Å; L388-H405 CarbonylContact C-O 3.35Å; L388-H405 VanDerWaalsContact CA-O 3.32Å; L388-H405 WeakPolarHBondContact CA-O 3.47Å; L388-K406 HydrophobicContact CD1-CD 4.28Å; L388-K406 HydrophobicContact CD1-CG 3.86Å; L388-K406 HydrophobicContact CG-CG 3.96Å
389	Y	70.3	Confident	63.1	Low	78 Å²	78	88.5 Å²	88.5	31%	0.306	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	118.3	169.5	175.7	-110.5	0	0	0	108.6	K375 L379 V391 H405	K375-Y389 PolarHBondContact O-OH 2.99Å; L379-Y389 HydrophobicContact CG-CD2 4.41Å; Y389-V391 HydrophobicContact CD1-CG2 4.21Å; Y389-V391 HydrophobicContact CE1-CG2 3.61Å; Y389-H405 PolarHBondContact N-O 3.4Å; Y389-H405 PolarHBondContact O-N 3.27Å
390	T	69.8	Low	62.1	Low	3 Å²	3	92.8 Å²	92.8	2%	0.018	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.1	178.8	-56.5	0	0	0	0	109.4	G377 Y378 E402 T404	G377-T390 CarbonylContact C-O 3.54Å; G377-T390 WeakPolarHBondContact CA-O 3.4Å; Y378-T390 HydrophobicContact CE1-CG2 3.72Å; Y378-T390 PolarHBondContact N-O 3.48Å; Y378-T390 PolarHBondContact O-N 3.38Å; T390-E402 HydrophobicContact CG2-CB 4.08Å; T390-E402 VanDerWaalsContact CG2-CD 3.42Å; T390-E402 HydrophobicContact CG2-CG 4.06Å; T390-E402 WeakPolarHBondContact CG2-OE1 3.45Å; T390-T404 HydrophobicContact CG2-CG2 3.89Å
391	V	71.3	Confident	61.3	Low	12 Å²	12	96 Å²	96	7%	0.073	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.3	176	171.7	0	0	0	0	110.6	K375 Y389 N393 E403	K375-V391 HydrophobicContact CB-CG1 3.9Å; K375-V391 HydrophobicContact CD-CG1 3.73Å; K375-V391 HydrophobicContact CG-CG1 3.76Å; Y389-V391 HydrophobicContact CD1-CG2 4.21Å; Y389-V391 HydrophobicContact CE1-CG2 3.61Å; V391-N393 HydrophobicContact CG1-CB 4.28Å; V391-E403 HydrophobicContact CB-CB 4.49Å; V391-E403 PolarHBondContact N-O 3.18Å; V391-E403 VanDerWaalsContact N-O 3.15Å
392	V	61.5	Low	60.7	Low	60 Å²	60	94 Å²	94	36%	0.364	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	92	172.9	-177.4	0	0	0	0	108.4	M376 Y378	M376-V392 PolarHBondContact O-N 2.88Å; Y378-V392 HydrophobicContact CD1-CG2 3.64Å; Y378-V392 HydrophobicContact CE1-CG2 3.55Å
393	N	52.8	Low	59.9	Low	88 Å²	88	96.2 Å²	96.2	47%	0.471	53%	0.532	S	S	.	.			trans	-97.1	100.5	178.2	-174	52	0	0	0	111.5	V391 L395	V391-N393 HydrophobicContact CG1-CB 4.28Å; N393-L395 PolarHBondContact O-N 3.33Å
394	Q	53.5	Low	59.7	Low	181 Å²	181	94.6 Å²	94.6	85%	0.846	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	81.3	171.6	-70.6	-173.6	-8.5	0	0	110.8
395	L	49.3	Very low	59.5	Low	133 Å²	133	92.8 Å²	92.8	70%	0.696	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.8	-6.1	174.2	-105.4	139.6	0	0	0	115.3	N393	N393-L395 PolarHBondContact O-N 3.33Å
396	D	44.4	Very low	59.6	Low	116 Å²	116	98.3 Å²	98.3	62%	0.62	51%	0.51	S	S	*	.			trans	-145.1	129	171.9	-130.4	-30.7	0	0	0	108.8
397	P	49.6	Very low	59.4	Low	120 Å²	120	98.4 Å²	98.4	78%	0.779	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-13.1	-176.8	32.4	-35.2	0	0	0	114.5
398	D	49.2	Very low	59	Low	151 Å²	151	101.3 Å²	101.3	81%	0.807	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	16.2	-173.2	-72.3	-35	0	0	0	114
399	A	47.1	Very low	58.4	Low	75 Å²	75	104.6 Å²	104.6	62%	0.62	54%	0.542	S	S	*	.			trans	-100	94.7	-178.9	0	0	0	0	0	112.5	E401	A399-E401 VanDerWaalsContact C-N 3.33Å; A399-E401 PolarHBondContact O-N 2.71Å
400	E	49.2	Very low	58	Low	201 Å²	201	104.5 Å²	104.5	94%	0.939	55%	0.553	S	S	*	*			trans	-75.2	1.8	-171.4	-68.6	-164.3	128.2	0	0	117.1
401	E	54.1	Low	57.4	Low	186 Å²	186	108.8 Å²	108.8	87%	0.869	58%	0.583	S	S	*	*			trans	-114.9	114.5	-176	-65.2	-167.6	143.9	0	0	113.8	A399 E403	A399-E401 VanDerWaalsContact C-N 3.33Å; A399-E401 PolarHBondContact O-N 2.71Å; E401-E403 PolarHBondContact O-N 3.1Å
402	E	57.7	Low	56.6	Low	106 Å²	106	114.4 Å²	114.4	50%	0.495	61%	0.611	S	S	.	*			trans	-65.9	110.9	170.1	-84.4	-167.2	132.7	0	0	110.7	Y378 R380 T390 T404	Y378-E402 PolarHBondContact OH-OE1 3.41Å; Y378-E402 VanDerWaalsContact OH-OE1 3.06Å; R380-E402 IonicContact NH2-OE2 3.95Å; T390-E402 HydrophobicContact CG2-CB 4.08Å; T390-E402 VanDerWaalsContact CG2-CD 3.42Å; T390-E402 HydrophobicContact CG2-CG 4.06Å; T390-E402 WeakPolarHBondContact CG2-OE1 3.45Å; E402-T404 HydrophobicContact CB-CG2 4.36Å; E402-T404 PolarHBondContact O-N 2.96Å; E402-T404 PolarHBondContact O-OG1 2.88Å
403	E	56.9	Low	56.3	Low	93 Å²	93	115.9 Å²	115.9	44%	0.435	62%	0.624	S	S	.	*			trans	-66.8	102.2	176.1	-172.3	-174.4	-156.9	0	0	110.8	K375 V391 E401 H405	K375-E403 IonicContact NZ-OE1 3.74Å; K375-E403 IonicContact NZ-OE2 3.19Å; K375-E403 PolarHBondContact NZ-OE2 3.24Å; V391-E403 HydrophobicContact CB-CB 4.49Å; V391-E403 PolarHBondContact N-O 3.18Å; V391-E403 VanDerWaalsContact N-O 3.15Å; E401-E403 PolarHBondContact O-N 3.1Å; E403-H405 IonicContact OE1-CE1 3.54Å
404	T	63.1	Low	55.8	Low	76 Å²	76	118.8 Å²	118.8	47%	0.466	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.2	136.4	-172.2	43.6	0	0	0	0	112.7	T390 E402	T390-T404 HydrophobicContact CG2-CG2 3.89Å; E402-T404 HydrophobicContact CB-CG2 4.36Å; E402-T404 PolarHBondContact O-N 2.96Å; E402-T404 PolarHBondContact O-OG1 2.88Å
405	H	67.9	Low	55.6	Low	102 Å²	102	120 Å²	120	47%	0.472	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.6	135.9	-176.8	-75.4	66.4	0	0	0	111	L388 Y389 E403	L388-H405 CarbonylContact C-O 3.35Å; L388-H405 VanDerWaalsContact CA-O 3.32Å; L388-H405 WeakPolarHBondContact CA-O 3.47Å; Y389-H405 PolarHBondContact N-O 3.4Å; Y389-H405 PolarHBondContact O-N 3.27Å; E403-H405 IonicContact OE1-CE1 3.54Å
406	K	65.8	Low	55.4	Low	156 Å²	156	121.8 Å²	121.8	68%	0.678	65%	0.652	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.3	139.5	175.4	-63.2	-163.7	173.5	-163.4	0	111.3	L388	L388-K406 HydrophobicContact CD1-CD 4.28Å; L388-K406 HydrophobicContact CD1-CG 3.86Å; L388-K406 HydrophobicContact CG-CG 3.96Å
407	V	65.1	Low	55.5	Low	60 Å²	60	124.2 Å²	124.2	36%	0.364	66%	0.664	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.6	125.9	-173.9	-176.2	0	0	0	0	110.8	L379 L387 L409	L379-V407 HydrophobicContact CD2-CG2 4.44Å; L387-V407 PolarHBondContact O-N 2.68Å; V407-L409 HydrophobicContact CG1-CD2 4.43Å
408	D	65.6	Low	55.3	Low	109 Å²	109	124.7 Å²	124.7	58%	0.583	67%	0.667	S	S	*	*			trans	-108.7	115.1	178.2	-177.6	10.2	0	0	0	112.4	S410 S411	D408-S410 WeakPolarHBondContact OD1-CB 3.46Å; D408-S410 PolarHBondContact OD1-N 2.95Å; D408-S410 PolarHBondContact OD1-OG 3.17Å; D408-S410 PolarHBondContact OD2-OG 3.16Å; D408-S411 PolarHBondContact O-OG 3.14Å
409	L	62.3	Low	54.7	Low	90 Å²	90	121 Å²	121	47%	0.471	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-83.5	-8.4	179	-60.7	-176.5	0	0	0	114.1	L387 V407 S411 L412	L387-L409 HydrophobicContact CD1-CD1 3.43Å; L387-L409 VanDerWaalsContact CD1-CD1 3.43Å; L387-L409 HydrophobicContact CD1-CG 3.96Å; V407-L409 HydrophobicContact CG1-CD2 4.43Å; L409-S411 PolarHBondContact O-N 3.17Å; L409-S411 VanDerWaalsContact O-N 3.12Å; L409-L412 HydrophobicContact CD2-CD1 4.22Å; L409-L412 PolarHBondContact O-N 3.07Å
410	S	61.1	Low	54.5	Low	77 Å²	77	124.9 Å²	124.9	54%	0.538	67%	0.674	S	S	.	*	G	3₁₀ helix	trans	-59.3	-25.6	-179.6	75.7	0	0	0	0	113	D408 L412 S413	D408-S410 WeakPolarHBondContact OD1-CB 3.46Å; D408-S410 PolarHBondContact OD1-N 2.95Å; D408-S410 PolarHBondContact OD1-OG 3.17Å; D408-S410 PolarHBondContact OD2-OG 3.16Å; S410-L412 VanDerWaalsContact C-N 3.29Å; S410-L412 PolarHBondContact O-N 3.28Å; S410-S413 PolarHBondContact O-OG 3.28Å; S410-S413 VanDerWaalsContact O-OG 3.11Å
411	S	57.8	Low	54	Low	93 Å²	93	121.6 Å²	121.6	65%	0.65	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-66.7	-21.1	174.3	61.1	0	0	0	0	114.7	D408 L409	D408-S411 PolarHBondContact O-OG 3.14Å; L409-S411 PolarHBondContact O-N 3.17Å; L409-S411 VanDerWaalsContact O-N 3.12Å
412	L	55.4	Low	53.3	Low	129 Å²	129	118.6 Å²	118.6	68%	0.675	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-17.2	-175.1	-64.9	173.3	0	0	0	113.5	L409 S410 N414	L409-L412 HydrophobicContact CD2-CD1 4.22Å; L409-L412 PolarHBondContact O-N 3.07Å; S410-L412 VanDerWaalsContact C-N 3.29Å; S410-L412 PolarHBondContact O-N 3.28Å; L412-N414 PolarHBondContact O-N 2.79Å
413	S	54.4	Low	52.4	Low	91 Å²	91	120.7 Å²	120.7	64%	0.636	68%	0.676	S	S	*	*			trans	-78.9	77.4	-177.6	52.6	0	0	0	0	113	S410	S410-S413 PolarHBondContact O-OG 3.28Å; S410-S413 VanDerWaalsContact O-OG 3.11Å
414	N	42.2	Very low	51.4	Low	150 Å²	150	120 Å²	120	80%	0.802	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-67.3	141	169.6	-86.7	-64.3	0	0	0	111.9	L412 L416	L412-N414 PolarHBondContact O-N 2.79Å; N414-L416 PolarHBondContact O-N 3.13Å
415	K	49.3	Very low	50.1	Low	206 Å²	206	125.3 Å²	125.3	90%	0.896	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-62.5	124	-161	-62.2	169.2	-178.2	174.4	0	113.7
416	L	45.9	Very low	48.7	Very low	170 Å²	170	130.4 Å²	130.4	89%	0.89	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-85	141.7	165.1	-65.6	173.5	0	0	0	110.5	N414	N414-L416 PolarHBondContact O-N 3.13Å
417	L	45	Very low	47.2	Very low	168 Å²	168	131.8 Å²	131.8	88%	0.88	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-101.5	138	172.7	-82.2	166.6	0	0	0	110.5
418	P	45.6	Very low	45.7	Very low	130 Å²	130	134.1 Å²	134.1	84%	0.844	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-80.7	131.6	-178.3	30.3	-31.8	0	0	0	112.3
419	G	37.3	Very low	44.7	Very low	72 Å²	72	140 Å²	140	74%	0.742	77%	0.765	S	S	*	*			trans	-117.8	136.1	173.3	0	0	0	0	0	111.4
420	L	41.9	Very low	44	Very low	157 Å²	157	143.7 Å²	143.7	82%	0.822	77%	0.773	S	S	*	*			trans	-83.3	135.5	-169.8	-174.2	69.6	0	0	0	113	T422	L420-T422 HydrophobicContact CG-CG2 4.39Å
421	T	39	Very low	42.8	Very low	132 Å²	132	146.5 Å²	146.5	81%	0.81	78%	0.777	S	S	*	*			trans	-117.9	111.3	171.2	54.1	0	0	0	0	111.8
422	T	40.8	Very low	41.5	Very low	123 Å²	123	151.5 Å²	151.5	76%	0.755	79%	0.787	S	S	*	*			trans	-132.9	91.1	172.3	45.4	0	0	0	0	110.6	L420	L420-T422 HydrophobicContact CG-CG2 4.39Å
423	L	38.4	Very low	40.7	Very low	151 Å²	151	148.8 Å²	148.8	79%	0.791	78%	0.775	S	S	*	*			trans	-91.4	107.2	174.7	-164.1	77.8	0	0	0	109.7	F425	L423-F425 HydrophobicContact CD2-CE2 4.39Å
424	G	35.1	Very low	39.5	Very low	78 Å²	78	149.3 Å²	149.3	80%	0.804	78%	0.775	S	S	*	*			trans	-80.3	118.5	-179.5	0	0	0	0	0	112.7
425	F	36	Very low	39.5	Very low	187 Å²	187	150.6 Å²	150.6	82%	0.82	77%	0.774	S	S	*	*			trans	-81.3	148.6	171.5	-75.5	-97.5	0	0	0	111.7	L423	L423-F425 HydrophobicContact CD2-CE2 4.39Å
426	K	38.3	Very low	38.7	Very low	210 Å²	210	148.9 Å²	148.9	91%	0.913	77%	0.774	S	S	*	*			trans	-120.5	135	162.1	-88.5	-170.4	172.4	-176.1	0	109.2
427	E	33.9	Very low	38.3	Very low	185 Å²	185	146 Å²	146	86%	0.864	77%	0.768	S	S	*	*			trans	-97.6	133.8	-171.6	-171.8	177.7	-137.4	0	0	110.4
428	D	34.8	Very low	37.6	Very low	109 Å²	109	142.9 Å²	142.9	58%	0.583	76%	0.76	S	S	*	*			trans	-109.2	135.4	171.9	-172.1	16.5	0	0	0	110.6	R430	D428-R430 VanDerWaalsContact C-N 3.28Å; D428-R430 VanDerWaalsContact CG-NH2 3.28Å; D428-R430 PolarHBondContact O-N 3.03Å; D428-R430 IonicContact OD1-CZ 2.76Å; D428-R430 IonicContact OD1-NE 3.92Å; D428-R430 IonicContact OD1-NH2 2.8Å; D428-R430 PolarHBondContact OD1-NH2 3.19Å; D428-R430 IonicContact OD2-CZ 2.88Å; D428-R430 IonicContact OD2-NE 3.79Å; D428-R430 IonicContact OD2-NH2 2.87Å; D428-R430 PolarHBondContact OD2-NH2 2.98Å
429	R	44.9	Very low	37.5	Very low	233 Å²	233	140 Å²	140	88%	0.879	75%	0.747	S	S	*	*			trans	-88.7	40.1	-160.6	-84.3	-177.2	158.5	-163.7	-5	114.4
430	R	46.7	Very low	37.7	Very low	167 Å²	167	146.2 Å²	146.2	63%	0.63	75%	0.75	S	S	*	*			trans	-140.2	130.7	178.4	-67	167.9	-74.5	-135.3	-2.3	108.3	D428	D428-R430 VanDerWaalsContact C-N 3.28Å; D428-R430 VanDerWaalsContact CG-NH2 3.28Å; D428-R430 PolarHBondContact O-N 3.03Å; D428-R430 IonicContact OD1-CZ 2.76Å; D428-R430 IonicContact OD1-NE 3.92Å; D428-R430 IonicContact OD1-NH2 2.8Å; D428-R430 PolarHBondContact OD1-NH2 3.19Å; D428-R430 IonicContact OD2-CZ 2.88Å; D428-R430 IonicContact OD2-NE 3.79Å; D428-R430 IonicContact OD2-NH2 2.87Å; D428-R430 PolarHBondContact OD2-NH2 2.98Å
431	H	36.7	Very low	37.4	Very low	136 Å²	136	146.5 Å²	146.5	63%	0.63	75%	0.752	S	S	*	*			cis	-137.1	162.7	28.9	-57.5	76.7	0	0	0	111.8	S44	S44-H431 WeakPolarHBondContact O-CB 3.49Å
432	K	29.4	Very low	37.6	Very low	198 Å²	198	146.4 Å²	146.4	86%	0.861	75%	0.745	S	S	*	*			trans	-118.5	121.9	166.9	-154.1	179.3	-171.6	-177	0	108.1
433	V	39.6	Very low	37.8	Very low	71 Å²	71	148.6 Å²	148.6	43%	0.43	75%	0.747	S	S	.	*			trans	-69.3	141.3	-167.5	-176.5	0	0	0	0	112.2	F435	V433-F435 HydrophobicContact CG1-CD2 4.48Å; V433-F435 HydrophobicContact CG1-CE2 4.37Å
434	T	29	Very low	38	Very low	102 Å²	102	146.6 Å²	146.6	63%	0.626	75%	0.745	S	S	*	*			trans	-130.1	140.4	150.7	-56.3	0	0	0	0	108.9
435	F	42.7	Very low	38.3	Very low	178 Å²	178	149.4 Å²	149.4	78%	0.781	74%	0.741	S	S	*	*			trans	-87.7	157.1	-174.7	-57.7	-101.4	0	0	0	112.2	V433	V433-F435 HydrophobicContact CG1-CD2 4.48Å; V433-F435 HydrophobicContact CG1-CE2 4.37Å
436	L	30.6	Very low	38.9	Very low	170 Å²	170	147.2 Å²	147.2	89%	0.89	73%	0.733	S	S	*	*			trans	-145.6	152.5	146.5	-104.9	-178	0	0	0	111.6
437	S	38.6	Very low	39.4	Very low	110 Å²	110	144.8 Å²	144.8	77%	0.769	72%	0.723	S	S	*	*			trans	-117.9	140.5	-174.2	176.2	0	0	0	0	111.6
438	S	30.1	Very low	39.7	Very low	102 Å²	102	142 Å²	142	71%	0.713	71%	0.714	S	S	*	*			trans	-172.6	108.6	152.2	-164.1	0	0	0	0	106.6
439	A	43.9	Very low	40.2	Very low	70 Å²	70	140.1 Å²	140.1	58%	0.579	71%	0.709	S	S	*	*				70.2	146	70.4	0	0	0	0	0	114.2
440	Y	40.7	Very low	40.6	Very low	202 Å²	202	133.3 Å²	133.3	79%	0.792	69%	0.693	S	S	*	*			trans	72.3	55.8	174.8	-48.2	-72.8	0	0	0	118.6
441	N	36.3	Very low	41.3	Very low	162 Å²	162	126.6 Å²	126.6	87%	0.866	67%	0.669	S	S	*	*			trans	-154.1	74.8	141.3	-116.4	-62.4	0	0	0	110.9
442	I	43.8	Very low	42.3	Very low	130 Å²	130	125.2 Å²	125.2	67%	0.667	67%	0.672	S	S	*	*			trans	-97.7	151.4	-175.9	-67.5	169.2	0	0	0	109.7	S444	I442-S444 PolarHBondContact O-N 3.31Å
443	Q	44	Very low	43.9	Very low	170 Å²	170	121.6 Å²	121.6	79%	0.794	66%	0.662	S	S	*	*	S	Bend	trans	71.7	-20.2	169	-80.1	161.4	-23.9	0	0	121	L445	Q443-L445 PolarHBondContact O-N 3.05Å
444	S	43.5	Very low	45.1	Very low	108 Å²	108	119.9 Å²	119.9	76%	0.755	65%	0.65	S	S	*	*	S	Bend	trans	-89.6	3.4	-170.4	-152.2	0	0	0	0	117.4	I442	I442-S444 PolarHBondContact O-N 3.31Å
445	L	41.4	Very low	47.3	Very low	137 Å²	137	119.8 Å²	119.8	72%	0.717	64%	0.643	S	S	*	*	S	Bend	trans	-149.4	7.3	-174.1	-113	158.1	0	0	0	116.1	Q443 K447 N448	Q443-L445 PolarHBondContact O-N 3.05Å; L445-K447 VanDerWaalsContact C-N 3.26Å; L445-K447 PolarHBondContact O-N 3.46Å; L445-K447 VanDerWaalsContact O-N 3.07Å; L445-N448 WeakPolarHBondContact CD2-ND2 3.29Å
446	Q	48	Very low	48.5	Very low	141 Å²	141	113.6 Å²	113.6	66%	0.659	62%	0.621	S	S	*	*			trans	-82.1	27.3	-169.8	-67.3	179.7	-95.7	0	0	115.5
447	K	49.2	Very low	50.5	Low	159 Å²	159	110.5 Å²	110.5	69%	0.691	61%	0.606	S	S	*	*			trans	-140.3	59.9	172.6	-72	-157.5	174.1	-164.2	0	112.9	L445	L445-K447 VanDerWaalsContact C-N 3.26Å; L445-K447 PolarHBondContact O-N 3.46Å; L445-K447 VanDerWaalsContact O-N 3.07Å
448	N	39.2	Very low	52.4	Low	128 Å²	128	105.8 Å²	105.8	68%	0.684	57%	0.572	S	S	*	*			trans	-95.8	75.5	156.1	-71.1	-70	0	0	0	108.4	L445 V450	L445-N448 WeakPolarHBondContact CD2-ND2 3.29Å; N448-V450 PolarHBondContact O-N 3.01Å; N448-V450 VanDerWaalsContact O-N 3.08Å
449	S	46	Very low	54.6	Low	69 Å²	69	102.2 Å²	102.2	48%	0.483	55%	0.545	S	S	.	.			trans	-68.2	105.4	177	-98.5	0	0	0	0	110.6	F451	S449-F451 WeakPolarHBondContact CB-O 3.45Å; S449-F451 PolarHBondContact O-N 3.03Å; S449-F451 PolarHBondContact OG-O 3.21Å
450	V	54.3	Low	56.3	Low	89 Å²	89	103.2 Å²	103.2	54%	0.539	54%	0.541	S	S	.	.	S	Bend	trans	-60.9	-29.5	154.7	177.1	0	0	0	0	109.7	N448 P452	N448-V450 PolarHBondContact O-N 3.01Å; N448-V450 VanDerWaalsContact O-N 3.08Å; V450-P452 VanDerWaalsContact O-CD 3.29Å; V450-P452 WeakPolarHBondContact O-CD 3.34Å
451	F	60.8	Low	58.2	Low	26 Å²	26	95 Å²	95	11%	0.114	51%	0.51	C	S	.	.			trans	-102	95.8	177.7	-45.4	-67.2	0	0	0	110.3	S449 D453 L454 V472 L476	S449-F451 WeakPolarHBondContact CB-O 3.45Å; S449-F451 PolarHBondContact O-N 3.03Å; S449-F451 PolarHBondContact OG-O 3.21Å; F451-D453 PolarHBondContact O-N 3.43Å; F451-L454 HydrophobicContact CB-CB 3.99Å; F451-L454 HydrophobicContact CB-CD1 4.23Å; F451-L454 HydrophobicContact CB-CG 4.49Å; F451-L454 PolarHBondContact O-N 3.25Å; F451-V472 HydrophobicContact CZ-CG1 4.36Å; F451-L476 HydrophobicContact CD1-CD1 3.96Å; F451-L476 HydrophobicContact CE1-CD1 3.47Å; F451-L476 VanDerWaalsContact CE1-CD1 3.47Å; F451-L476 HydrophobicContact CZ-CD1 4.21Å
452	P	58	Low	60.4	Low	107 Å²	107	88 Å²	88	70%	0.695	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.4	-177.9	25.9	-34.6	0	0	0	112.8	V450	V450-P452 VanDerWaalsContact O-CD 3.29Å; V450-P452 WeakPolarHBondContact O-CD 3.34Å
453	D	61.6	Low	62.1	Low	123 Å²	123	86.1 Å²	86.1	66%	0.658	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	8.2	-174.4	-56.1	-49.8	0	0	0	114.3	F451 R516	F451-D453 PolarHBondContact O-N 3.43Å; D453-R516 PolarHBondContact O-NH2 3.37Å
454	L	66.2	Low	64	Low	34 Å²	34	83.2 Å²	83.2	18%	0.178	46%	0.456	C	S	.	.			trans	-114.5	138.3	-179.5	-91.2	76.7	0	0	0	113	F451 E458 L462	F451-L454 HydrophobicContact CB-CB 3.99Å; F451-L454 HydrophobicContact CB-CD1 4.23Å; F451-L454 HydrophobicContact CB-CG 4.49Å; F451-L454 PolarHBondContact O-N 3.25Å; L454-E458 WeakPolarHBondContact CA-OE2 3.31Å; L454-E458 HydrophobicContact CD2-CB 4.29Å; L454-E458 HydrophobicContact CG-CB 4.28Å; L454-L462 HydrophobicContact CD2-CD1 3.42Å; L454-L462 VanDerWaalsContact CD2-CD1 3.42Å
455	Q	74.1	Confident	65.9	Low	101 Å²	101	79 Å²	79	47%	0.472	43%	0.428	S	S	.	.			trans	-82.4	159	169.8	-58	-54.7	-39.5	0	0	111.4	D457 E458 T459	Q455-D457 VanDerWaalsContact C-N 3.29Å; Q455-D457 PolarHBondContact O-N 2.99Å; Q455-E458 HydrophobicContact CB-CG 4.14Å; Q455-E458 PolarHBondContact N-OE2 2.88Å; Q455-E458 WeakPolarHBondContact O-CA 3.3Å; Q455-E458 WeakPolarHBondContact O-CB 3.38Å; Q455-E458 PolarHBondContact O-N 3.33Å; Q455-T459 PolarHBondContact O-N 3.15Å; Q455-T459 PolarHBondContact O-OG1 2.82Å; Q455-T459 VanDerWaalsContact O-OG1 3.1Å
456	S	67.9	Low	67.9	Low	47 Å²	47	74.3 Å²	74.3	33%	0.329	40%	0.401	S	S	.	.	H	α-helix	trans	-52.4	-49	178.7	-158.7	0	0	0	0	111.6	E458 T459 D460	S456-E458 PolarHBondContact O-N 3.33Å; S456-E458 VanDerWaalsContact O-N 3.13Å; S456-T459 WeakPolarHBondContact O-CB 3.28Å; S456-T459 PolarHBondContact O-N 3.23Å; S456-T459 VanDerWaalsContact O-N 3.13Å; S456-D460 PolarHBondContact O-N 3.39Å
457	D	73.2	Confident	69.6	Low	106 Å²	106	69.6 Å²	69.6	57%	0.567	39%	0.39	S	S	*	.	H	α-helix	trans	-60.1	-20.7	177.9	-54.3	40.3	0	0	0	114.1	Q455 M461	Q455-D457 VanDerWaalsContact C-N 3.29Å; Q455-D457 PolarHBondContact O-N 2.99Å; D457-M461 WeakPolarHBondContact O-CE 3.29Å; D457-M461 VanDerWaalsContact O-CG 3.28Å; D457-M461 WeakPolarHBondContact O-CG 3.45Å
458	E	79.3	Confident	71	Confident	11 Å²	11	64.4 Å²	64.4	5%	0.051	37%	0.37	C	S	.	.	H	α-helix	trans	-90.8	-39	177.6	-60	175.5	137.9	0	0	110.5	L454 Q455 S456 M461 L462 I512 R516	L454-E458 WeakPolarHBondContact CA-OE2 3.31Å; L454-E458 HydrophobicContact CD2-CB 4.29Å; L454-E458 HydrophobicContact CG-CB 4.28Å; Q455-E458 HydrophobicContact CB-CG 4.14Å; Q455-E458 PolarHBondContact N-OE2 2.88Å; Q455-E458 WeakPolarHBondContact O-CA 3.3Å; Q455-E458 WeakPolarHBondContact O-CB 3.38Å; Q455-E458 PolarHBondContact O-N 3.33Å; S456-E458 PolarHBondContact O-N 3.33Å; S456-E458 VanDerWaalsContact O-N 3.13Å; E458-M461 HydrophobicContact CB-CE 4.39Å; E458-M461 HydrophobicContact CG-CE 4.2Å; E458-M461 PolarHBondContact O-N 3.47Å; E458-L462 PolarHBondContact O-N 2.88Å; E458-L462 VanDerWaalsContact O-N 3.07Å; E458-I512 HydrophobicContact CB-CG1 4.31Å; E458-I512 HydrophobicContact CG-CG1 4.39Å; E458-I512 HydrophobicContact CG-CG2 4.46Å; E458-R516 VanDerWaalsContact CD-NH2 3.35Å; E458-R516 WeakPolarHBondContact OE1-CG 3.2Å; E458-R516 IonicContact OE1-CZ 3.47Å; E458-R516 IonicContact OE1-NE 2.66Å; E458-R516 PolarHBondContact OE1-NE 2.6Å; E458-R516 IonicContact OE1-NH2 2.74Å; E458-R516 PolarHBondContact OE1-NH2 2.79Å; E458-R516 IonicContact OE2-CZ 3.5Å; E458-R516 IonicContact OE2-NE 3.64Å; E458-R516 IonicContact OE2-NH2 3.54Å; E458-R516 PolarHBondContact OE2-NH2 3.48Å
459	T	76.4	Confident	72.9	Confident	26 Å²	26	62.8 Å²	62.8	16%	0.16	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-44.2	171	-41.9	0	0	0	0	111	Q455 S456 M461 L462 Y463	Q455-T459 PolarHBondContact O-N 3.15Å; Q455-T459 PolarHBondContact O-OG1 2.82Å; Q455-T459 VanDerWaalsContact O-OG1 3.1Å; S456-T459 WeakPolarHBondContact O-CB 3.28Å; S456-T459 PolarHBondContact O-N 3.23Å; S456-T459 VanDerWaalsContact O-N 3.13Å; T459-M461 VanDerWaalsContact C-N 3.3Å; T459-M461 PolarHBondContact O-N 3.02Å; T459-L462 WeakPolarHBondContact O-CB 3.4Å; T459-L462 PolarHBondContact O-N 3.44Å; T459-Y463 HydrophobicContact CG2-CD2 3.9Å; T459-Y463 HydrophobicContact CG2-CE2 3.64Å; T459-Y463 VanDerWaalsContact O-CD2 3.28Å; T459-Y463 WeakPolarHBondContact O-CD2 3.3Å; T459-Y463 PolarHBondContact O-N 3.38Å
460	D	79.4	Confident	74.5	Confident	92 Å²	92	63.9 Å²	63.9	49%	0.492	36%	0.362	S	S	.	.	H	α-helix	trans	-64.3	-32.5	178.3	-68.2	-25.5	0	0	0	112.4	S456 S464	S456-D460 PolarHBondContact O-N 3.39Å; D460-S464 PolarHBondContact O-N 3.2Å; D460-S464 VanDerWaalsContact O-N 3.1Å; D460-S464 PolarHBondContact O-OG 2.88Å
461	M	80.4	Confident	75.8	Confident	29 Å²	29	60.5 Å²	60.5	14%	0.143	35%	0.346	C	S	.	.	H	α-helix	trans	-69.6	-36.2	171.5	-73	-174.7	-54.8	0	0	112.1	D457 E458 T459 S464 A465 Q511 I512 K515	D457-M461 WeakPolarHBondContact O-CE 3.29Å; D457-M461 VanDerWaalsContact O-CG 3.28Å; D457-M461 WeakPolarHBondContact O-CG 3.45Å; E458-M461 HydrophobicContact CB-CE 4.39Å; E458-M461 HydrophobicContact CG-CE 4.2Å; E458-M461 PolarHBondContact O-N 3.47Å; T459-M461 VanDerWaalsContact C-N 3.3Å; T459-M461 PolarHBondContact O-N 3.02Å; M461-S464 WeakPolarHBondContact O-CB 3.43Å; M461-S464 PolarHBondContact O-N 2.67Å; M461-A465 PolarHBondContact O-N 3.09Å; M461-A465 VanDerWaalsContact O-N 3.16Å; M461-Q511 HydrophobicContact SD-CB 4.44Å; M461-I512 HydrophobicContact CE-CD1 4.44Å; M461-I512 HydrophobicContact CE-CG1 3.49Å; M461-I512 VanDerWaalsContact CE-CG1 3.49Å; M461-K515 HydrophobicContact CE-CD 3.85Å; M461-K515 HydrophobicContact SD-CD 4.42Å; M461-K515 PolarHBondContact SD-NZ 2.85Å
462	L	81.4	Confident	76.9	Confident	15 Å²	15	59.5 Å²	59.5	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-70	-41.4	174.2	-74.8	171.1	0	0	0	112.4	L454 E458 T459 S464 A465 Y466 V472 I512	L454-L462 HydrophobicContact CD2-CD1 3.42Å; L454-L462 VanDerWaalsContact CD2-CD1 3.42Å; E458-L462 PolarHBondContact O-N 2.88Å; E458-L462 VanDerWaalsContact O-N 3.07Å; T459-L462 WeakPolarHBondContact O-CB 3.4Å; T459-L462 PolarHBondContact O-N 3.44Å; L462-S464 PolarHBondContact O-N 3.05Å; L462-A465 PolarHBondContact O-N 3.07Å; L462-A465 VanDerWaalsContact O-N 3.11Å; L462-Y466 HydrophobicContact CD2-CD2 3.87Å; L462-Y466 HydrophobicContact CD2-CE2 3.88Å; L462-Y466 PolarHBondContact O-N 3.12Å; L462-V472 HydrophobicContact CB-CG1 4.14Å; L462-V472 HydrophobicContact CB-CG2 3.91Å; L462-V472 HydrophobicContact CD1-CG1 4.03Å; L462-I512 HydrophobicContact CD2-CD1 4.32Å; L462-I512 HydrophobicContact CG-CD1 4.13Å
463	Y	80.8	Confident	77.9	Confident	91 Å²	91	58.3 Å²	58.3	36%	0.357	33%	0.327	S	S	.	.	H	α-helix	trans	-56.3	-34.8	169.9	-85.7	-75.4	0	0	0	111.5	T459 G467 E469	T459-Y463 HydrophobicContact CG2-CD2 3.9Å; T459-Y463 HydrophobicContact CG2-CE2 3.64Å; T459-Y463 VanDerWaalsContact O-CD2 3.28Å; T459-Y463 WeakPolarHBondContact O-CD2 3.3Å; T459-Y463 PolarHBondContact O-N 3.38Å; Y463-G467 CarbonylContact C-O 3.57Å; Y463-G467 VanDerWaalsContact CA-O 3.28Å; Y463-G467 WeakPolarHBondContact CA-O 3.46Å; Y463-G467 WeakPolarHBondContact CD1-O 3.06Å; Y463-G467 CarbonylContact O-C 3.45Å; Y463-G467 WeakPolarHBondContact O-CA 3.37Å; Y463-G467 PolarHBondContact O-N 3.26Å; Y463-G467 VanDerWaalsContact O-N 3.14Å; Y463-E469 HydrophobicContact CE1-CB 4.19Å; Y463-E469 WeakPolarHBondContact OH-CB 3.44Å
464	S	82.6	Confident	78.9	Confident	108 Å²	108	56.4 Å²	56.4	76%	0.755	32%	0.322	S	S	*	.	H	α-helix	trans	-72.6	-29.9	177.7	-57.5	0	0	0	0	113.8	D460 M461 L462	D460-S464 PolarHBondContact O-N 3.2Å; D460-S464 VanDerWaalsContact O-N 3.1Å; D460-S464 PolarHBondContact O-OG 2.88Å; M461-S464 WeakPolarHBondContact O-CB 3.43Å; M461-S464 PolarHBondContact O-N 2.67Å; L462-S464 PolarHBondContact O-N 3.05Å
465	A	82.9	Confident	79.8	Confident	19 Å²	19	55.1 Å²	55.1	16%	0.157	32%	0.316	C	S	.	.	H	α-helix	trans	-95.2	-30.6	-176.8	0	0	0	0	0	114.1	M461 L462 T501 A508	M461-A465 PolarHBondContact O-N 3.09Å; M461-A465 VanDerWaalsContact O-N 3.16Å; L462-A465 PolarHBondContact O-N 3.07Å; L462-A465 VanDerWaalsContact O-N 3.11Å; A465-T501 WeakPolarHBondContact O-CG2 3.3Å; A465-A508 HydrophobicContact CB-CB 4.09Å
466	Y	85.1	Confident	80.2	Confident	40 Å²	40	52.7 Å²	52.7	16%	0.157	31%	0.306	C	S	.	.	H	α-helix	trans	-115.1	-4.3	-174.5	-74.1	-65.5	0	0	0	114.9	L462 A475 L497 T501 H505	L462-Y466 HydrophobicContact CD2-CD2 3.87Å; L462-Y466 HydrophobicContact CD2-CE2 3.88Å; L462-Y466 PolarHBondContact O-N 3.12Å; Y466-A475 HydrophobicContact CD1-CB 3.87Å; Y466-A475 HydrophobicContact CD2-CB 4.31Å; Y466-A475 HydrophobicContact CE1-CB 3.42Å; Y466-A475 VanDerWaalsContact CE1-CB 3.42Å; Y466-A475 HydrophobicContact CE2-CB 3.87Å; Y466-A475 HydrophobicContact CG-CB 4.28Å; Y466-L497 HydrophobicContact CE1-CD2 4.12Å; Y466-T501 HydrophobicContact CD1-CG2 3.84Å; Y466-T501 HydrophobicContact CE1-CG2 3.68Å; Y466-H505 AromaticContact CZ-ND1 3.87Å; Y466-H505 PolarHBondContact OH-CE1 2.94Å; Y466-H505 VanDerWaalsContact OH-CG 3.25Å; Y466-H505 PolarHBondContact OH-ND1 3.11Å
467	G	82.6	Confident	81.1	Confident	42 Å²	42	53.9 Å²	53.9	43%	0.433	32%	0.315	S	S	.	.			trans	83.7	-121.8	-174.9	0	0	0	0	0	111.4	Y463	Y463-G467 CarbonylContact C-O 3.57Å; Y463-G467 VanDerWaalsContact CA-O 3.28Å; Y463-G467 WeakPolarHBondContact CA-O 3.46Å; Y463-G467 WeakPolarHBondContact CD1-O 3.06Å; Y463-G467 CarbonylContact O-C 3.45Å; Y463-G467 WeakPolarHBondContact O-CA 3.37Å; Y463-G467 PolarHBondContact O-N 3.26Å; Y463-G467 VanDerWaalsContact O-N 3.14Å
468	D	78.7	Confident	81.7	Confident	50 Å²	50	51.8 Å²	51.8	27%	0.267	31%	0.305	S	S	.	.	S	Bend	trans	-83.3	177.4	-172.1	80.4	-52.9	0	0	0	113.7	L41 T470 G471 V472	L41-D468 HydrophobicContact CD1-CB 4.27Å; D468-T470 VanDerWaalsContact CG-OG1 3.25Å; D468-T470 PolarHBondContact O-N 2.77Å; D468-T470 PolarHBondContact OD1-OG1 2.67Å; D468-T470 VanDerWaalsContact OD1-OG1 3.09Å; D468-T470 VanDerWaalsContact OD2-CB 3.29Å; D468-T470 WeakPolarHBondContact OD2-CB 3.38Å; D468-T470 WeakPolarHBondContact OD2-CG2 3.47Å; D468-T470 PolarHBondContact OD2-N 3.3Å; D468-T470 PolarHBondContact OD2-OG1 3.12Å; D468-G471 PolarHBondContact O-N 3.4Å; D468-G471 VanDerWaalsContact O-N 3.12Å; D468-G471 PolarHBondContact OD1-N 3.16Å; D468-V472 PolarHBondContact O-N 3.05Å; D468-V472 VanDerWaalsContact O-N 3.15Å
469	E	78.7	Confident	81.9	Confident	94 Å²	94	54.1 Å²	54.1	44%	0.439	32%	0.316	S	S	.	.	H	α-helix	trans	-58.6	-31.1	178.9	-162	171.9	-154.8	0	0	112.1	Y463 Q473	Y463-E469 HydrophobicContact CE1-CB 4.19Å; Y463-E469 WeakPolarHBondContact OH-CB 3.44Å; E469-Q473 WeakPolarHBondContact O-CB 3.35Å; E469-Q473 PolarHBondContact O-N 3.1Å
470	T	79.9	Confident	82.3	Confident	91 Å²	91	57.4 Å²	57.4	56%	0.558	33%	0.333	S	S	*	.	H	α-helix	trans	-74	-38.4	176.9	74.8	0	0	0	0	112.4	D468 Q473 C474	D468-T470 VanDerWaalsContact CG-OG1 3.25Å; D468-T470 PolarHBondContact O-N 2.77Å; D468-T470 PolarHBondContact OD1-OG1 2.67Å; D468-T470 VanDerWaalsContact OD1-OG1 3.09Å; D468-T470 VanDerWaalsContact OD2-CB 3.29Å; D468-T470 WeakPolarHBondContact OD2-CB 3.38Å; D468-T470 WeakPolarHBondContact OD2-CG2 3.47Å; D468-T470 PolarHBondContact OD2-N 3.3Å; D468-T470 PolarHBondContact OD2-OG1 3.12Å; T470-Q473 PolarHBondContact O-N 3.09Å; T470-C474 WeakPolarHBondContact O-CB 3.37Å; T470-C474 PolarHBondContact O-N 3.02Å; T470-C474 PolarHBondContact O-SG 3.19Å
471	G	82.9	Confident	82.5	Confident	19 Å²	19	61.4 Å²	61.4	20%	0.196	35%	0.346	C	S	.	.	H	α-helix	trans	-56.5	-48.3	170.3	0	0	0	0	0	112.8	D468 C474 A475	D468-G471 PolarHBondContact O-N 3.4Å; D468-G471 VanDerWaalsContact O-N 3.12Å; D468-G471 PolarHBondContact OD1-N 3.16Å; G471-C474 PolarHBondContact O-N 3.28Å; G471-A475 PolarHBondContact O-N 3.49Å
472	V	83.3	Confident	82.7	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.03	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-47.3	176.1	179.5	0	0	0	0	111.3	F451 L462 D468 C474 A475 L476	F451-V472 HydrophobicContact CZ-CG1 4.36Å; L462-V472 HydrophobicContact CB-CG1 4.14Å; L462-V472 HydrophobicContact CB-CG2 3.91Å; L462-V472 HydrophobicContact CD1-CG1 4.03Å; D468-V472 PolarHBondContact O-N 3.05Å; D468-V472 VanDerWaalsContact O-N 3.15Å; V472-C474 VanDerWaalsContact C-N 3.33Å; V472-C474 PolarHBondContact O-N 3.01Å; V472-A475 PolarHBondContact O-N 2.93Å; V472-L476 HydrophobicContact CG1-CD1 4.09Å; V472-L476 WeakPolarHBondContact O-CG 3.35Å; V472-L476 PolarHBondContact O-N 3.18Å
473	Q	79	Confident	82.7	Confident	82 Å²	82	63.6 Å²	63.6	38%	0.383	36%	0.362	S	S	.	.	H	α-helix	trans	-67.4	-32.5	-178.6	-174	58.4	87.3	0	0	112.8	E469 T470 S477	E469-Q473 WeakPolarHBondContact O-CB 3.35Å; E469-Q473 PolarHBondContact O-N 3.1Å; T470-Q473 PolarHBondContact O-N 3.09Å; Q473-S477 WeakPolarHBondContact O-CB 3.25Å; Q473-S477 PolarHBondContact O-N 2.9Å
474	C	81.9	Confident	82.4	Confident	82 Å²	82	63.3 Å²	63.3	55%	0.554	39%	0.387	S	S	*	.	H	α-helix	trans	-65.7	-47.5	172.2	-76.6	0	0	0	0	111.6	T470 G471 V472 L476 S477 V478	T470-C474 WeakPolarHBondContact O-CB 3.37Å; T470-C474 PolarHBondContact O-N 3.02Å; T470-C474 PolarHBondContact O-SG 3.19Å; G471-C474 PolarHBondContact O-N 3.28Å; V472-C474 VanDerWaalsContact C-N 3.33Å; V472-C474 PolarHBondContact O-N 3.01Å; C474-L476 PolarHBondContact O-N 3.22Å; C474-S477 PolarHBondContact O-N 3.15Å; C474-V478 WeakPolarHBondContact O-CG2 3.25Å; C474-V478 PolarHBondContact O-N 2.71Å
475	A	85.6	Confident	82	Confident	8 Å²	8	60.7 Å²	60.7	7%	0.066	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-44.6	177.8	0	0	0	0	0	112.1	Y466 G471 V472 V478 Q479 L497	Y466-A475 HydrophobicContact CD1-CB 3.87Å; Y466-A475 HydrophobicContact CD2-CB 4.31Å; Y466-A475 HydrophobicContact CE1-CB 3.42Å; Y466-A475 VanDerWaalsContact CE1-CB 3.42Å; Y466-A475 HydrophobicContact CE2-CB 3.87Å; Y466-A475 HydrophobicContact CG-CB 4.28Å; G471-A475 PolarHBondContact O-N 3.49Å; V472-A475 PolarHBondContact O-N 2.93Å; A475-V478 PolarHBondContact O-N 3.12Å; A475-Q479 PolarHBondContact O-N 3.35Å; A475-L497 HydrophobicContact CB-CD2 4Å
476	L	82.4	Confident	81.8	Confident	49 Å²	49	62 Å²	62	26%	0.257	38%	0.383	S	S	.	.	H	α-helix	trans	-60.7	-43.9	173.6	-70.2	172.2	0	0	0	111.8	F451 V472 C474 V478 Q479 D480	F451-L476 HydrophobicContact CD1-CD1 3.96Å; F451-L476 HydrophobicContact CE1-CD1 3.47Å; F451-L476 VanDerWaalsContact CE1-CD1 3.47Å; F451-L476 HydrophobicContact CZ-CD1 4.21Å; V472-L476 HydrophobicContact CG1-CD1 4.09Å; V472-L476 WeakPolarHBondContact O-CG 3.35Å; V472-L476 PolarHBondContact O-N 3.18Å; C474-L476 PolarHBondContact O-N 3.22Å; L476-V478 VanDerWaalsContact C-N 3.27Å; L476-V478 PolarHBondContact O-N 3.25Å; L476-Q479 PolarHBondContact O-N 3.37Å; L476-Q479 VanDerWaalsContact O-N 3.13Å; L476-D480 WeakPolarHBondContact O-CB 3.45Å; L476-D480 PolarHBondContact O-N 3Å
477	S	87.3	Confident	81.6	Confident	72 Å²	72	63.8 Å²	63.8	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-32.5	177.8	-172.5	0	0	0	0	113.4	Q473 C474 F481	Q473-S477 WeakPolarHBondContact O-CB 3.25Å; Q473-S477 PolarHBondContact O-N 2.9Å; C474-S477 PolarHBondContact O-N 3.15Å; S477-F481 WeakPolarHBondContact O-CB 3.36Å; S477-F481 PolarHBondContact O-N 2.8Å; S477-F481 VanDerWaalsContact O-N 3.14Å
478	V	85.8	Confident	81.6	Confident	62 Å²	62	65.5 Å²	65.5	38%	0.376	40%	0.404	S	S	.	.	H	α-helix	trans	-75.2	-37.7	175.4	178.7	0	0	0	0	111	C474 A475 L476 V493	C474-V478 WeakPolarHBondContact O-CG2 3.25Å; C474-V478 PolarHBondContact O-N 2.71Å; A475-V478 PolarHBondContact O-N 3.12Å; L476-V478 VanDerWaalsContact C-N 3.27Å; L476-V478 PolarHBondContact O-N 3.25Å; V478-V493 HydrophobicContact CG1-CG1 3.8Å; V478-V493 HydrophobicContact CG1-CG2 4.17Å
479	Q	83	Confident	81.9	Confident	60 Å²	60	65.7 Å²	65.7	28%	0.28	41%	0.407	S	S	.	.	H	α-helix	trans	-68.9	-40	175.3	-169.3	168.8	91.1	0	0	112.1	A475 L476 V482 T483 D494	A475-Q479 PolarHBondContact O-N 3.35Å; L476-Q479 PolarHBondContact O-N 3.37Å; L476-Q479 VanDerWaalsContact O-N 3.13Å; Q479-V482 CarbonylContact O-C 3.59Å; Q479-V482 VanDerWaalsContact O-CG2 3.29Å; Q479-V482 WeakPolarHBondContact O-CG2 3.23Å; Q479-V482 PolarHBondContact O-N 3.42Å; Q479-T483 PolarHBondContact O-N 2.87Å; Q479-T483 VanDerWaalsContact O-N 3.17Å; Q479-D494 PolarHBondContact NE2-OD1 3Å
480	D	84.1	Confident	82.2	Confident	95 Å²	95	65.1 Å²	65.1	51%	0.508	40%	0.403	S	S	.	.	H	α-helix	trans	-62.7	-41.7	174.5	-78.4	-19.9	0	0	0	111.9	L476 V482 T483	L476-D480 WeakPolarHBondContact O-CB 3.45Å; L476-D480 PolarHBondContact O-N 3Å; D480-V482 PolarHBondContact O-N 3.47Å; D480-V482 VanDerWaalsContact O-N 3.16Å; D480-T483 WeakPolarHBondContact O-CB 3.41Å; D480-T483 PolarHBondContact O-N 2.82Å; D480-T483 PolarHBondContact O-OG1 2.84Å
481	F	85.1	Confident	82.5	Confident	176 Å²	176	68.2 Å²	68.2	77%	0.772	40%	0.404	S	S	*	.	H	α-helix	trans	-58.9	-25.3	174.8	-179.8	-101.9	0	0	0	113.3	S477	S477-F481 WeakPolarHBondContact O-CB 3.36Å; S477-F481 PolarHBondContact O-N 2.8Å; S477-F481 VanDerWaalsContact O-N 3.14Å
482	V	84.8	Confident	82.7	Confident	9 Å²	9	75.8 Å²	75.8	6%	0.055	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	16.4	173.6	-56.7	0	0	0	0	113.6	Q479 D480 C485 T489 K490 V493	Q479-V482 CarbonylContact O-C 3.59Å; Q479-V482 VanDerWaalsContact O-CG2 3.29Å; Q479-V482 WeakPolarHBondContact O-CG2 3.23Å; Q479-V482 PolarHBondContact O-N 3.42Å; D480-V482 PolarHBondContact O-N 3.47Å; D480-V482 VanDerWaalsContact O-N 3.16Å; V482-C485 HydrophobicContact CB-CB 4.18Å; V482-C485 WeakPolarHBondContact O-CB 3.3Å; V482-C485 PolarHBondContact O-N 3.09Å; V482-T489 HydrophobicContact CB-CG2 4.25Å; V482-T489 HydrophobicContact CG1-CG2 3.88Å; V482-K490 HydrophobicContact CG2-CG 4.2Å; V482-K490 WeakPolarHBondContact O-CE 3.38Å; V482-V493 HydrophobicContact CB-CG2 4.37Å; V482-V493 HydrophobicContact CG1-CG2 3.75Å; V482-V493 HydrophobicContact CG2-CB 4.04Å; V482-V493 HydrophobicContact CG2-CG1 4.25Å; V482-V493 HydrophobicContact CG2-CG2 3.76Å
483	T	80.3	Confident	83	Confident	81 Å²	81	76.3 Å²	76.3	50%	0.497	43%	0.43	S	S	.	.	S	Bend	trans	-66.9	150.4	161.4	61.8	0	0	0	0	110	Q479 D480 C485	Q479-T483 PolarHBondContact O-N 2.87Å; Q479-T483 VanDerWaalsContact O-N 3.17Å; D480-T483 WeakPolarHBondContact O-CB 3.41Å; D480-T483 PolarHBondContact O-N 2.82Å; D480-T483 PolarHBondContact O-OG1 2.84Å; T483-C485 PolarHBondContact O-N 3.25Å
484	G	75.4	Confident	83.5	Confident	85 Å²	85	73.6 Å²	73.6	88%	0.876	42%	0.418	S	S	*	.	S	Bend	trans	70.9	-32.8	-167.3	0	0	0	0	0	114.8
485	C	73.4	Confident	83.8	Confident	54 Å²	54	73.1 Å²	73.1	37%	0.365	41%	0.41	S	S	.	.	S	Bend	trans	-62.6	147.8	173.3	-58.7	0	0	0	0	111.8	V482 T483 T489 K490	V482-C485 HydrophobicContact CB-CB 4.18Å; V482-C485 WeakPolarHBondContact O-CB 3.3Å; V482-C485 PolarHBondContact O-N 3.09Å; T483-C485 PolarHBondContact O-N 3.25Å; C485-T489 HydrophobicContact CB-CG2 4.08Å; C485-K490 WeakPolarHBondContact O-CE 3.48Å
486	G	79.8	Confident	84	Confident	46 Å²	46	77 Å²	77	47%	0.474	43%	0.429	S	S	.	.			trans	-59.8	159.7	-176.3	0	0	0	0	0	113.6	V488 T489 K490	G486-V488 PolarHBondContact O-N 3.17Å; G486-T489 PolarHBondContact O-N 3.09Å; G486-K490 PolarHBondContact O-N 3.02Å
487	S	80.6	Confident	84.3	Confident	78 Å²	78	75.3 Å²	75.3	55%	0.545	42%	0.42	S	S	.	.	H	α-helix	trans	-59.6	-19.9	-173.6	61.7	0	0	0	0	114.6	R491	S487-R491 WeakPolarHBondContact O-CG 3.49Å; S487-R491 PolarHBondContact O-N 2.91Å
488	V	82.1	Confident	84.4	Confident	78 Å²	78	73.2 Å²	73.2	47%	0.473	40%	0.404	S	S	.	.	H	α-helix	trans	-70.2	-48.1	172.7	-176.9	0	0	0	0	111.5	G486 K490 R491 W492	G486-V488 PolarHBondContact O-N 3.17Å; V488-K490 VanDerWaalsContact C-N 3.28Å; V488-K490 PolarHBondContact O-N 3.35Å; V488-R491 WeakPolarHBondContact O-CB 3.32Å; V488-R491 PolarHBondContact O-N 2.87Å; V488-W492 HydrophobicContact CG1-CZ2 4.16Å; V488-W492 PolarHBondContact O-N 3.08Å
489	T	84.8	Confident	84.5	Confident	54 Å²	54	78.2 Å²	78.2	33%	0.331	42%	0.42	S	S	.	.	H	α-helix	trans	-63.4	-36.5	-179.9	-44.8	0	0	0	0	111.6	V482 C485 G486 W492 V493	V482-T489 HydrophobicContact CB-CG2 4.25Å; V482-T489 HydrophobicContact CG1-CG2 3.88Å; C485-T489 HydrophobicContact CB-CG2 4.08Å; G486-T489 PolarHBondContact O-N 3.09Å; T489-W492 PolarHBondContact O-N 3.14Å; T489-V493 PolarHBondContact O-N 2.73Å; T489-V493 VanDerWaalsContact O-N 3.12Å
490	K	85.2	Confident	84.5	Confident	82 Å²	82	82.4 Å²	82.4	36%	0.357	44%	0.441	S	S	.	.	H	α-helix	trans	-63.6	-44.4	174.2	-64.9	-170.6	176.1	-173.1	0	112.1	V482 C485 G486 V488 W492 V493 D494	V482-K490 HydrophobicContact CG2-CG 4.2Å; V482-K490 WeakPolarHBondContact O-CE 3.38Å; C485-K490 WeakPolarHBondContact O-CE 3.48Å; G486-K490 PolarHBondContact O-N 3.02Å; V488-K490 VanDerWaalsContact C-N 3.28Å; V488-K490 PolarHBondContact O-N 3.35Å; K490-W492 VanDerWaalsContact C-N 3.33Å; K490-W492 PolarHBondContact O-N 3.06Å; K490-V493 PolarHBondContact O-N 2.74Å; K490-D494 PolarHBondContact O-N 3.04Å
491	R	85.9	Confident	84.4	Confident	156 Å²	156	78.9 Å²	78.9	59%	0.589	42%	0.424	S	S	*	.	H	α-helix	trans	-58	-44.3	172.4	-69.6	174.8	-150.6	177.2	5.2	111.6	S487 V488 V493 D494 D495	S487-R491 WeakPolarHBondContact O-CG 3.49Å; S487-R491 PolarHBondContact O-N 2.91Å; V488-R491 WeakPolarHBondContact O-CB 3.32Å; V488-R491 PolarHBondContact O-N 2.87Å; R491-V493 VanDerWaalsContact C-N 3.27Å; R491-V493 PolarHBondContact O-N 3.12Å; R491-D494 CarbonylContact O-C 3.53Å; R491-D494 PolarHBondContact O-N 3.18Å; R491-D494 VanDerWaalsContact O-N 3.14Å; R491-D495 VanDerWaalsContact O-CB 3.31Å; R491-D495 WeakPolarHBondContact O-CB 3.49Å; R491-D495 PolarHBondContact O-N 2.96Å
492	W	87.7	Confident	84.3	Confident	178 Å²	178	73.7 Å²	73.7	67%	0.674	42%	0.419	S	S	*	.	H	α-helix	trans	-62.5	-32.2	178.7	-66.8	-0.8	0	0	0	113.6	V488 T489 K490 L496	V488-W492 HydrophobicContact CG1-CZ2 4.16Å; V488-W492 PolarHBondContact O-N 3.08Å; T489-W492 PolarHBondContact O-N 3.14Å; K490-W492 VanDerWaalsContact C-N 3.33Å; K490-W492 PolarHBondContact O-N 3.06Å; W492-L496 VanDerWaalsContact O-CB 3.3Å; W492-L496 WeakPolarHBondContact O-CB 3.08Å; W492-L496 PolarHBondContact O-N 3.06Å; W492-L496 VanDerWaalsContact O-N 3.12Å
493	V	89.3	Confident	84.2	Confident	15 Å²	15	74 Å²	74	9%	0.091	43%	0.425	C	S	.	.	H	α-helix	trans	-73	-43.9	171.7	163.8	0	0	0	0	111.3	V478 V482 T489 K490 R491 D495 L496 L497	V478-V493 HydrophobicContact CG1-CG1 3.8Å; V478-V493 HydrophobicContact CG1-CG2 4.17Å; V482-V493 HydrophobicContact CB-CG2 4.37Å; V482-V493 HydrophobicContact CG1-CG2 3.75Å; V482-V493 HydrophobicContact CG2-CB 4.04Å; V482-V493 HydrophobicContact CG2-CG1 4.25Å; V482-V493 HydrophobicContact CG2-CG2 3.76Å; T489-V493 PolarHBondContact O-N 2.73Å; T489-V493 VanDerWaalsContact O-N 3.12Å; K490-V493 PolarHBondContact O-N 2.74Å; R491-V493 VanDerWaalsContact C-N 3.27Å; R491-V493 PolarHBondContact O-N 3.12Å; V493-D495 PolarHBondContact O-N 3.3Å; V493-L496 PolarHBondContact O-N 2.89Å; V493-L497 HydrophobicContact CG1-CD1 3.79Å; V493-L497 HydrophobicContact CG1-CG 4.39Å; V493-L497 WeakPolarHBondContact O-CB 3.3Å; V493-L497 VanDerWaalsContact O-CG 3.3Å; V493-L497 WeakPolarHBondContact O-CG 3.48Å; V493-L497 PolarHBondContact O-N 3.43Å
494	D	88.4	Confident	84.4	Confident	25 Å²	25	73.8 Å²	73.8	13%	0.134	42%	0.421	C	S	.	.	H	α-helix	trans	-62.4	-42.5	175.7	-67.8	-33.5	0	0	0	111.4	Q479 K490 R491 L496 L497 D498 H505 L506	Q479-D494 PolarHBondContact NE2-OD1 3Å; K490-D494 PolarHBondContact O-N 3.04Å; R491-D494 CarbonylContact O-C 3.53Å; R491-D494 PolarHBondContact O-N 3.18Å; R491-D494 VanDerWaalsContact O-N 3.14Å; D494-L496 VanDerWaalsContact C-N 3.29Å; D494-L496 PolarHBondContact O-N 3.3Å; D494-L497 PolarHBondContact O-N 2.73Å; D494-D498 WeakPolarHBondContact O-CB 3.43Å; D494-D498 PolarHBondContact O-N 3.3Å; D494-H505 PolarHBondContact O-CD2 3.11Å; D494-H505 IonicContact OD1-CD2 3.53Å; D494-H505 IonicContact OD1-CE1 2.72Å; D494-H505 IonicContact OD1-NE2 3.18Å; D494-H505 PolarHBondContact OD1-NE2 2.62Å; D494-L506 HydrophobicContact CB-CD2 3.95Å
495	D	88.6	Confident	85	Confident	72 Å²	72	69.9 Å²	69.9	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-31.8	174.1	-66.3	-31.9	0	0	0	112.5	R491 V493 K499	R491-D495 VanDerWaalsContact O-CB 3.31Å; R491-D495 WeakPolarHBondContact O-CB 3.49Å; R491-D495 PolarHBondContact O-N 2.96Å; V493-D495 PolarHBondContact O-N 3.3Å; D495-K499 VanDerWaalsContact O-CD 3.28Å; D495-K499 WeakPolarHBondContact O-CD 3.34Å; D495-K499 WeakPolarHBondContact O-CG 3.4Å; D495-K499 PolarHBondContact O-N 3.14Å
496	L	89.8	Confident	85.7	Confident	90 Å²	90	70.7 Å²	70.7	47%	0.471	38%	0.38	S	S	.	.	H	α-helix	trans	-75.9	-45.6	176.5	174.6	62.2	0	0	0	110.8	W492 V493 D494 K499 M500	W492-L496 VanDerWaalsContact O-CB 3.3Å; W492-L496 WeakPolarHBondContact O-CB 3.08Å; W492-L496 PolarHBondContact O-N 3.06Å; W492-L496 VanDerWaalsContact O-N 3.12Å; V493-L496 PolarHBondContact O-N 2.89Å; D494-L496 VanDerWaalsContact C-N 3.29Å; D494-L496 PolarHBondContact O-N 3.3Å; L496-K499 PolarHBondContact O-N 3.19Å; L496-M500 WeakPolarHBondContact O-CG 3.3Å; L496-M500 PolarHBondContact O-N 3.12Å; L496-M500 VanDerWaalsContact O-N 3.1Å
497	L	88.8	Confident	85.9	Confident	13 Å²	13	73.5 Å²	73.5	7%	0.068	38%	0.379	C	S	.	.	H	α-helix	trans	-61.7	-44.2	175.7	-68.9	166.7	0	0	0	110.4	Y466 A475 V493 D494 K499 M500 T501 H505	Y466-L497 HydrophobicContact CE1-CD2 4.12Å; A475-L497 HydrophobicContact CB-CD2 4Å; V493-L497 HydrophobicContact CG1-CD1 3.79Å; V493-L497 HydrophobicContact CG1-CG 4.39Å; V493-L497 WeakPolarHBondContact O-CB 3.3Å; V493-L497 VanDerWaalsContact O-CG 3.3Å; V493-L497 WeakPolarHBondContact O-CG 3.48Å; V493-L497 PolarHBondContact O-N 3.43Å; D494-L497 PolarHBondContact O-N 2.73Å; L497-K499 VanDerWaalsContact C-N 3.32Å; L497-K499 PolarHBondContact O-N 2.9Å; L497-M500 CarbonylContact O-C 3.53Å; L497-M500 WeakPolarHBondContact O-CA 3.3Å; L497-M500 WeakPolarHBondContact O-CB 3.47Å; L497-M500 PolarHBondContact O-N 3.1Å; L497-T501 PolarHBondContact O-N 3.38Å; L497-T501 PolarHBondContact O-OG1 3.21Å; L497-H505 HydrophobicContact CB-CB 4.26Å; L497-H505 VanDerWaalsContact CB-CD2 3.48Å; L497-H505 WeakPolarHBondContact CB-CD2 3.47Å
498	D	89.9	Confident	86.1	Confident	29 Å²	29	70.1 Å²	70.1	16%	0.155	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-38.4	174	-106	15	0	0	0	112.6	D494 M500 T501 G502 G503 H505 L506	D494-D498 WeakPolarHBondContact O-CB 3.43Å; D494-D498 PolarHBondContact O-N 3.3Å; D498-M500 VanDerWaalsContact C-N 3.27Å; D498-M500 PolarHBondContact O-N 3.19Å; D498-T501 CarbonylContact O-C 3.59Å; D498-T501 PolarHBondContact O-N 3.5Å; D498-G502 CarbonylContact O-C 3.6Å; D498-G502 PolarHBondContact O-N 3.34Å; D498-G503 VanDerWaalsContact CG-CA 3.47Å; D498-G503 PolarHBondContact O-N 3.21Å; D498-G503 WeakPolarHBondContact OD1-CA 3.31Å; D498-H505 WeakPolarHBondContact OD1-CA 3.35Å; D498-H505 VanDerWaalsContact OD1-CB 3.32Å; D498-H505 WeakPolarHBondContact OD1-CB 3.49Å; D498-H505 PolarHBondContact OD1-N 3Å; D498-L506 PolarHBondContact OD1-N 3.04Å; D498-L506 WeakPolarHBondContact OD2-CB 3.23Å; D498-L506 WeakPolarHBondContact OD2-CD1 3.02Å; D498-L506 WeakPolarHBondContact OD2-CG 3.45Å
499	K	87.9	Confident	86.2	Confident	166 Å²	166	67.4 Å²	67.4	72%	0.722	34%	0.339	S	S	*	.	H	α-helix	trans	-66.2	-29	173.9	-76.1	163.6	-169.7	162.3	0	112.9	D495 L496 L497	D495-K499 VanDerWaalsContact O-CD 3.28Å; D495-K499 WeakPolarHBondContact O-CD 3.34Å; D495-K499 WeakPolarHBondContact O-CG 3.4Å; D495-K499 PolarHBondContact O-N 3.14Å; L496-K499 PolarHBondContact O-N 3.19Å; L497-K499 VanDerWaalsContact C-N 3.32Å; L497-K499 PolarHBondContact O-N 2.9Å
500	M	82.8	Confident	86.1	Confident	148 Å²	148	68.1 Å²	68.1	73%	0.729	35%	0.347	S	S	*	.	H	α-helix	trans	-81.4	-29.1	175	-65.6	179.6	70.4	0	0	112.5	L496 L497 D498	L496-M500 WeakPolarHBondContact O-CG 3.3Å; L496-M500 PolarHBondContact O-N 3.12Å; L496-M500 VanDerWaalsContact O-N 3.1Å; L497-M500 CarbonylContact O-C 3.53Å; L497-M500 WeakPolarHBondContact O-CA 3.3Å; L497-M500 WeakPolarHBondContact O-CB 3.47Å; L497-M500 PolarHBondContact O-N 3.1Å; D498-M500 VanDerWaalsContact C-N 3.27Å; D498-M500 PolarHBondContact O-N 3.19Å
501	T	82.5	Confident	86	Confident	22 Å²	22	68.7 Å²	68.7	14%	0.135	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	22.2	-177.9	71.3	0	0	0	0	114	A465 Y466 L497 D498 G503 D504 H505	A465-T501 WeakPolarHBondContact O-CG2 3.3Å; Y466-T501 HydrophobicContact CD1-CG2 3.84Å; Y466-T501 HydrophobicContact CE1-CG2 3.68Å; L497-T501 PolarHBondContact O-N 3.38Å; L497-T501 PolarHBondContact O-OG1 3.21Å; D498-T501 CarbonylContact O-C 3.59Å; D498-T501 PolarHBondContact O-N 3.5Å; T501-G503 PolarHBondContact O-N 3.32Å; T501-G503 VanDerWaalsContact O-N 3.11Å; T501-D504 WeakPolarHBondContact O-CB 3.37Å; T501-D504 PolarHBondContact O-N 2.85Å; T501-H505 PolarHBondContact OG1-N 2.95Å; T501-H505 VanDerWaalsContact OG1-N 3.09Å
502	G	83	Confident	85.8	Confident	66 Å²	66	62.1 Å²	62.1	68%	0.68	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	25.2	177.4	0	0	0	0	0	115.8	D498	D498-G502 CarbonylContact O-C 3.6Å; D498-G502 PolarHBondContact O-N 3.34Å
503	G	83.1	Confident	85.5	Confident	16 Å²	16	60.8 Å²	60.8	17%	0.165	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	5.7	-174.6	0	0	0	0	0	114.9	D498 T501 K507	D498-G503 VanDerWaalsContact CG-CA 3.47Å; D498-G503 PolarHBondContact O-N 3.21Å; D498-G503 WeakPolarHBondContact OD1-CA 3.31Å; T501-G503 PolarHBondContact O-N 3.32Å; T501-G503 VanDerWaalsContact O-N 3.11Å; G503-K507 WeakPolarHBondContact O-CD 3.44Å; G503-K507 WeakPolarHBondContact O-CE 3.39Å; G503-K507 VanDerWaalsContact O-CG 3.31Å; G503-K507 WeakPolarHBondContact O-CG 3.5Å; G503-K507 PolarHBondContact O-NZ 2.87Å
504	D	84.6	Confident	85	Confident	77 Å²	77	65.6 Å²	65.6	41%	0.412	34%	0.343	S	S	.	.	H	α-helix	trans	-82.2	-14.6	-176.6	-69.2	-25.8	0	0	0	114.7	T501 K507 A508	T501-D504 WeakPolarHBondContact O-CB 3.37Å; T501-D504 PolarHBondContact O-N 2.85Å; D504-K507 WeakPolarHBondContact OD1-CD 3.4Å; D504-K507 IonicContact OD1-NZ 3.89Å; D504-K507 PolarHBondContact OD1-NZ 3.41Å; D504-A508 VanDerWaalsContact O-CB 3.3Å; D504-A508 WeakPolarHBondContact O-CB 3.5Å; D504-A508 PolarHBondContact O-N 3.3Å
505	H	87.9	Confident	84.3	Confident	3 Å²	3	68.5 Å²	68.5	1%	0.014	36%	0.355	C	S	.	.	H	α-helix	trans	-67.5	-55.1	176.7	158.6	57	0	0	0	111.3	Y466 D494 L497 D498 T501 K507 A508 V509	Y466-H505 AromaticContact CZ-ND1 3.87Å; Y466-H505 PolarHBondContact OH-CE1 2.94Å; Y466-H505 VanDerWaalsContact OH-CG 3.25Å; Y466-H505 PolarHBondContact OH-ND1 3.11Å; D494-H505 PolarHBondContact O-CD2 3.11Å; D494-H505 IonicContact OD1-CD2 3.53Å; D494-H505 IonicContact OD1-CE1 2.72Å; D494-H505 IonicContact OD1-NE2 3.18Å; D494-H505 PolarHBondContact OD1-NE2 2.62Å; L497-H505 HydrophobicContact CB-CB 4.26Å; L497-H505 VanDerWaalsContact CB-CD2 3.48Å; L497-H505 WeakPolarHBondContact CB-CD2 3.47Å; D498-H505 WeakPolarHBondContact OD1-CA 3.35Å; D498-H505 VanDerWaalsContact OD1-CB 3.32Å; D498-H505 WeakPolarHBondContact OD1-CB 3.49Å; D498-H505 PolarHBondContact OD1-N 3Å; T501-H505 PolarHBondContact OG1-N 2.95Å; T501-H505 VanDerWaalsContact OG1-N 3.09Å; H505-K507 PolarHBondContact O-N 2.8Å; H505-A508 PolarHBondContact O-N 3.36Å; H505-A508 VanDerWaalsContact O-N 3.09Å; H505-V509 VanDerWaalsContact CE1-CG2 3.47Å; H505-V509 WeakPolarHBondContact CE1-CG2 3.28Å; H505-V509 WeakPolarHBondContact ND1-CG2 3.36Å; H505-V509 WeakPolarHBondContact O-CB 3.47Å; H505-V509 WeakPolarHBondContact O-CG2 3.34Å; H505-V509 PolarHBondContact O-N 3.34Å
506	L	86.3	Confident	83.5	Confident	71 Å²	71	69.3 Å²	69.3	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-33.2	176.8	-76.5	-174.6	0	0	0	111.8	D494 D498 S510	D494-L506 HydrophobicContact CB-CD2 3.95Å; D498-L506 PolarHBondContact OD1-N 3.04Å; D498-L506 WeakPolarHBondContact OD2-CB 3.23Å; D498-L506 WeakPolarHBondContact OD2-CD1 3.02Å; D498-L506 WeakPolarHBondContact OD2-CG 3.45Å; L506-S510 WeakPolarHBondContact O-CB 3.21Å; L506-S510 PolarHBondContact O-N 3.42Å
507	K	84.9	Confident	82.4	Confident	104 Å²	104	70.5 Å²	70.5	45%	0.452	36%	0.359	S	S	.	.	H	α-helix	trans	-65.6	-45.1	173.1	-64.2	171.7	-150.2	145.5	0	111.7	G503 D504 H505 Q511	G503-K507 WeakPolarHBondContact O-CD 3.44Å; G503-K507 WeakPolarHBondContact O-CE 3.39Å; G503-K507 VanDerWaalsContact O-CG 3.31Å; G503-K507 WeakPolarHBondContact O-CG 3.5Å; G503-K507 PolarHBondContact O-NZ 2.87Å; D504-K507 WeakPolarHBondContact OD1-CD 3.4Å; D504-K507 IonicContact OD1-NZ 3.89Å; D504-K507 PolarHBondContact OD1-NZ 3.41Å; H505-K507 PolarHBondContact O-N 2.8Å; K507-Q511 WeakPolarHBondContact O-CB 3.39Å; K507-Q511 VanDerWaalsContact O-CG 3.3Å; K507-Q511 WeakPolarHBondContact O-CG 3.31Å; K507-Q511 PolarHBondContact O-N 3.23Å; K507-Q511 PolarHBondContact O-NE2 2.92Å; K507-Q511 VanDerWaalsContact O-NE2 3.08Å
508	A	84.9	Confident	81.1	Confident	7 Å²	7	75.1 Å²	75.1	6%	0.058	38%	0.383	C	S	.	.	H	α-helix	trans	-67.2	-47.5	178.9	0	0	0	0	0	111.5	A465 D504 H505 S510 Q511 I512	A465-A508 HydrophobicContact CB-CB 4.09Å; D504-A508 VanDerWaalsContact O-CB 3.3Å; D504-A508 WeakPolarHBondContact O-CB 3.5Å; D504-A508 PolarHBondContact O-N 3.3Å; H505-A508 PolarHBondContact O-N 3.36Å; H505-A508 VanDerWaalsContact O-N 3.09Å; A508-S510 VanDerWaalsContact C-N 3.35Å; A508-S510 PolarHBondContact O-N 2.91Å; A508-Q511 PolarHBondContact O-N 2.6Å; A508-I512 VanDerWaalsContact O-CG1 3.31Å; A508-I512 WeakPolarHBondContact O-CG1 3.22Å; A508-I512 PolarHBondContact O-N 3.15Å
509	V	84.4	Confident	79.2	Confident	22 Å²	22	81.2 Å²	81.2	13%	0.133	41%	0.412	C	S	.	.	H	α-helix	trans	-62.1	-40.6	176.8	170.4	0	0	0	0	111.7	H505 I512 R513	H505-V509 VanDerWaalsContact CE1-CG2 3.47Å; H505-V509 WeakPolarHBondContact CE1-CG2 3.28Å; H505-V509 WeakPolarHBondContact ND1-CG2 3.36Å; H505-V509 WeakPolarHBondContact O-CB 3.47Å; H505-V509 WeakPolarHBondContact O-CG2 3.34Å; H505-V509 PolarHBondContact O-N 3.34Å; V509-I512 PolarHBondContact O-N 2.96Å; V509-R513 VanDerWaalsContact CG1-CZ 3.45Å; V509-R513 WeakPolarHBondContact O-CB 3.48Å; V509-R513 VanDerWaalsContact O-CG 3.29Å; V509-R513 WeakPolarHBondContact O-CG 3.47Å; V509-R513 PolarHBondContact O-N 3.47Å
510	S	83	Confident	77.5	Confident	69 Å²	69	80 Å²	80	48%	0.483	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-46	174.3	-171.9	0	0	0	0	111.4	L506 A508 I512 R513 Q514	L506-S510 WeakPolarHBondContact O-CB 3.21Å; L506-S510 PolarHBondContact O-N 3.42Å; A508-S510 VanDerWaalsContact C-N 3.35Å; A508-S510 PolarHBondContact O-N 2.91Å; S510-I512 PolarHBondContact O-N 2.79Å; S510-R513 PolarHBondContact O-N 3.22Å; S510-Q514 VanDerWaalsContact O-CB 3.3Å; S510-Q514 WeakPolarHBondContact O-CB 3.46Å; S510-Q514 PolarHBondContact O-N 3.01Å
511	Q	82.9	Confident	75.5	Confident	94 Å²	94	81.2 Å²	81.2	44%	0.439	41%	0.414	S	S	.	.	H	α-helix	trans	-63.7	-39.8	176.9	-76.6	173	80	0	0	113.2	M461 K507 A508 Q514 K515	M461-Q511 HydrophobicContact SD-CB 4.44Å; K507-Q511 WeakPolarHBondContact O-CB 3.39Å; K507-Q511 VanDerWaalsContact O-CG 3.3Å; K507-Q511 WeakPolarHBondContact O-CG 3.31Å; K507-Q511 PolarHBondContact O-N 3.23Å; K507-Q511 PolarHBondContact O-NE2 2.92Å; K507-Q511 VanDerWaalsContact O-NE2 3.08Å; A508-Q511 PolarHBondContact O-N 2.6Å; Q511-Q514 PolarHBondContact O-N 2.92Å; Q511-K515 WeakPolarHBondContact O-CB 3.03Å; Q511-K515 WeakPolarHBondContact O-CG 3.32Å; Q511-K515 PolarHBondContact O-N 3.06Å
512	I	82.1	Confident	73.4	Confident	18 Å²	18	85.8 Å²	85.8	9%	0.092	44%	0.444	C	S	.	.	H	α-helix	trans	-62	-49.5	174.4	-70.2	165.5	0	0	0	110.1	E458 M461 L462 A508 V509 S510 Q514 K515 R516	E458-I512 HydrophobicContact CB-CG1 4.31Å; E458-I512 HydrophobicContact CG-CG1 4.39Å; E458-I512 HydrophobicContact CG-CG2 4.46Å; M461-I512 HydrophobicContact CE-CD1 4.44Å; M461-I512 HydrophobicContact CE-CG1 3.49Å; M461-I512 VanDerWaalsContact CE-CG1 3.49Å; L462-I512 HydrophobicContact CD2-CD1 4.32Å; L462-I512 HydrophobicContact CG-CD1 4.13Å; A508-I512 VanDerWaalsContact O-CG1 3.31Å; A508-I512 WeakPolarHBondContact O-CG1 3.22Å; A508-I512 PolarHBondContact O-N 3.15Å; V509-I512 PolarHBondContact O-N 2.96Å; S510-I512 PolarHBondContact O-N 2.79Å; I512-Q514 VanDerWaalsContact C-N 3.31Å; I512-Q514 PolarHBondContact O-N 2.81Å; I512-K515 PolarHBondContact O-N 3.4Å; I512-R516 WeakPolarHBondContact O-CG 3.32Å; I512-R516 PolarHBondContact O-N 2.81Å
513	R	81.4	Confident	71	Confident	149 Å²	149	88.3 Å²	88.3	56%	0.562	44%	0.442	S	S	*	.	H	α-helix	trans	-60.7	-39.9	176.5	-70.6	174.1	-175.4	171.9	7.1	111.9	V509 S510 N517	V509-R513 VanDerWaalsContact CG1-CZ 3.45Å; V509-R513 WeakPolarHBondContact O-CB 3.48Å; V509-R513 VanDerWaalsContact O-CG 3.29Å; V509-R513 WeakPolarHBondContact O-CG 3.47Å; V509-R513 PolarHBondContact O-N 3.47Å; S510-R513 PolarHBondContact O-N 3.22Å; R513-N517 WeakPolarHBondContact O-CB 3.19Å; R513-N517 VanDerWaalsContact O-CG 3.3Å; R513-N517 PolarHBondContact O-N 3.24Å
514	Q	78.6	Confident	68.9	Low	116 Å²	116	96.1 Å²	96.1	54%	0.542	47%	0.474	S	S	.	.	H	α-helix	trans	-66.3	-46.2	177	-172.3	177.4	1.9	0	0	112	S510 Q511 I512 R516 N517 I518	S510-Q514 VanDerWaalsContact O-CB 3.3Å; S510-Q514 WeakPolarHBondContact O-CB 3.46Å; S510-Q514 PolarHBondContact O-N 3.01Å; Q511-Q514 PolarHBondContact O-N 2.92Å; I512-Q514 VanDerWaalsContact C-N 3.31Å; I512-Q514 PolarHBondContact O-N 2.81Å; Q514-R516 PolarHBondContact O-N 2.97Å; Q514-N517 PolarHBondContact O-N 3.45Å; Q514-I518 HydrophobicContact CG-CD1 3.97Å; Q514-I518 VanDerWaalsContact O-CG1 3.3Å; Q514-I518 WeakPolarHBondContact O-CG1 3.14Å; Q514-I518 PolarHBondContact O-N 2.91Å
515	K	72.4	Confident	66.8	Low	87 Å²	87	97.9 Å²	97.9	38%	0.378	49%	0.488	S	S	.	.	H	α-helix	trans	-59.4	-44	175.7	-76.2	-175.6	-177.8	-179.4	0	111.6	M461 Q511 I512 I518 M519	M461-K515 HydrophobicContact CE-CD 3.85Å; M461-K515 HydrophobicContact SD-CD 4.42Å; M461-K515 PolarHBondContact SD-NZ 2.85Å; Q511-K515 WeakPolarHBondContact O-CB 3.03Å; Q511-K515 WeakPolarHBondContact O-CG 3.32Å; Q511-K515 PolarHBondContact O-N 3.06Å; I512-K515 PolarHBondContact O-N 3.4Å; K515-I518 PolarHBondContact O-N 2.96Å; K515-M519 PolarHBondContact O-N 3.18Å
516	R	72.6	Confident	64.4	Low	88 Å²	88	106.1 Å²	106.1	33%	0.332	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-43.2	176.4	-69.7	175.9	-175.4	-155.6	-7.8	112.5	D453 E458 I512 Q514 I518 M519 L520	D453-R516 PolarHBondContact O-NH2 3.37Å; E458-R516 VanDerWaalsContact CD-NH2 3.35Å; E458-R516 WeakPolarHBondContact OE1-CG 3.2Å; E458-R516 IonicContact OE1-CZ 3.47Å; E458-R516 IonicContact OE1-NE 2.66Å; E458-R516 PolarHBondContact OE1-NE 2.6Å; E458-R516 IonicContact OE1-NH2 2.74Å; E458-R516 PolarHBondContact OE1-NH2 2.79Å; E458-R516 IonicContact OE2-CZ 3.5Å; E458-R516 IonicContact OE2-NE 3.64Å; E458-R516 IonicContact OE2-NH2 3.54Å; E458-R516 PolarHBondContact OE2-NH2 3.48Å; I512-R516 WeakPolarHBondContact O-CG 3.32Å; I512-R516 PolarHBondContact O-N 2.81Å; Q514-R516 PolarHBondContact O-N 2.97Å; R516-I518 VanDerWaalsContact C-N 3.29Å; R516-I518 PolarHBondContact O-N 3.42Å; R516-M519 PolarHBondContact O-N 3.12Å; R516-L520 PolarHBondContact O-N 2.76Å
517	N	66.3	Low	61.7	Low	115 Å²	115	108.5 Å²	108.5	62%	0.615	55%	0.546	S	S	*	.	H	α-helix	trans	-67.5	-26.9	176.4	-74.2	-4.8	0	0	0	113.4	R513 Q514	R513-N517 WeakPolarHBondContact O-CB 3.19Å; R513-N517 VanDerWaalsContact O-CG 3.3Å; R513-N517 PolarHBondContact O-N 3.24Å; Q514-N517 PolarHBondContact O-N 3.45Å
518	I	61.4	Low	59.1	Low	110 Å²	110	109.1 Å²	109.1	56%	0.564	56%	0.564	S	S	*	*	H	α-helix	trans	-75.8	-43.7	173.1	-69.6	165.5	0	0	0	110.7	Q514 K515 R516 L520 K521	Q514-I518 HydrophobicContact CG-CD1 3.97Å; Q514-I518 VanDerWaalsContact O-CG1 3.3Å; Q514-I518 WeakPolarHBondContact O-CG1 3.14Å; Q514-I518 PolarHBondContact O-N 2.91Å; K515-I518 PolarHBondContact O-N 2.96Å; R516-I518 VanDerWaalsContact C-N 3.29Å; R516-I518 PolarHBondContact O-N 3.42Å; I518-L520 PolarHBondContact O-N 2.99Å; I518-K521 PolarHBondContact O-N 2.84Å; I518-K521 VanDerWaalsContact O-N 3.13Å
519	M	51.1	Low	56.5	Low	157 Å²	157	116.2 Å²	116.2	77%	0.773	60%	0.599	S	S	*	*	H	α-helix	trans	-60	-25.9	178.4	-162.5	77.6	76.9	0	0	113.2	K515 R516 K521	K515-M519 PolarHBondContact O-N 3.18Å; R516-M519 PolarHBondContact O-N 3.12Å; M519-K521 VanDerWaalsContact C-N 3.3Å; M519-K521 PolarHBondContact O-N 2.87Å
520	L	50.3	Low	53.9	Low	141 Å²	141	120.1 Å²	120.1	74%	0.738	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	5	178.9	-75.3	168	0	0	0	114.7	R516 I518	R516-L520 PolarHBondContact O-N 2.76Å; I518-L520 PolarHBondContact O-N 2.99Å
521	K	41.8	Very low	51.3	Low	174 Å²	174	123.4 Å²	123.4	76%	0.757	64%	0.638	S	S	*	*	S	Bend	trans	-105.5	116.8	167.6	-70.1	-153.7	173.1	-165.9	0	110.9	I518 M519	I518-K521 PolarHBondContact O-N 2.84Å; I518-K521 VanDerWaalsContact O-N 3.13Å; M519-K521 VanDerWaalsContact C-N 3.3Å; M519-K521 PolarHBondContact O-N 2.87Å
522	P	38.1	Very low	48.7	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	65%	0.653	S	S	*	*			trans	-68.7	132.4	175.9	27.8	-33.2	0	0	0	111.4	E524	P522-E524 PolarHBondContact O-N 3.11Å
523	D	32.6	Very low	46.1	Very low	120 Å²	120	132 Å²	132	64%	0.642	68%	0.68	S	S	*	*			trans	-79.7	73.9	-179.4	-171.3	37.1	0	0	0	111.5	T525 K526	D523-T525 PolarHBondContact O-N 3.21Å; D523-K526 IonicContact OD2-NZ 2.73Å; D523-K526 PolarHBondContact OD2-NZ 2.91Å
524	E	39.3	Very low	43.7	Very low	180 Å²	180	132 Å²	132	84%	0.841	69%	0.688	S	S	*	*			trans	-69.4	74.8	169.3	-76.2	-159.3	141.7	0	0	111.7	P522	P522-E524 PolarHBondContact O-N 3.11Å
525	T	40.3	Very low	41.3	Very low	114 Å²	114	130.9 Å²	130.9	70%	0.699	69%	0.693	S	S	*	*			trans	-170.2	81.7	150.4	11.5	0	0	0	0	113	D523	D523-T525 PolarHBondContact O-N 3.21Å
526	K	38.8	Very low	39.2	Very low	176 Å²	176	134.8 Å²	134.8	77%	0.765	72%	0.718	S	S	*	*			trans	-161.4	51.5	165.7	-125.5	151.6	-88.5	131.9	0	117.1	D523	D523-K526 IonicContact OD2-NZ 2.73Å; D523-K526 PolarHBondContact OD2-NZ 2.91Å
527	S	28.9	Very low	37.1	Very low	120 Å²	120	134.6 Å²	134.6	84%	0.839	74%	0.743	S	S	*	*			trans	-155.2	144.2	161	57.3	0	0	0	0	115.3
528	S	29.4	Very low	35.2	Very low	118 Å²	118	135.4 Å²	135.4	83%	0.825	76%	0.758	S	S	*	*			trans	66	106.8	165.8	-121.6	0	0	0	0	120.7
529	I	31	Very low	33.6	Very low	156 Å²	156	133.9 Å²	133.9	80%	0.8	77%	0.77	S	S	*	*			trans	-73.2	133.6	140.8	-72.3	164.8	0	0	0	107.9
530	C	29.8	Very low	32.7	Very low	104 Å²	104	135.3 Å²	135.3	70%	0.703	78%	0.78	S	S	*	*			trans	170.9	126.6	132.6	-104.3	0	0	0	0	113.6
531	D	27.8	Very low	31.7	Very low	138 Å²	138	132 Å²	132	74%	0.738	78%	0.779	S	S	*	*			trans	50	121.9	140.5	-68.1	-49.9	0	0	0	125.4
532	M	28.1	Very low	31	Very low	151 Å²	151	132.7 Å²	132.7	74%	0.744	79%	0.785	S	S	*	*				63.6	109	129.1	-90	171.8	52.7	0	0	123.7
533	Q	29	Very low	30.6	Very low	142 Å²	142	132.8 Å²	132.8	66%	0.664	79%	0.789	S	S	*	*				90.4	126.2	114.7	-103.3	-164.5	-45.7	0	0	124
534	M	31.3	Very low	30.4	Very low	147 Å²	147	132.8 Å²	132.8	72%	0.724	80%	0.798	S	S	*	*			trans	90.8	134.1	139.1	-62	-40.8	-121.2	0	0	124.6
535	S	28.3	Very low	29.8	Very low	94 Å²	94	129.3 Å²	129.3	66%	0.657	79%	0.794	S	S	*	*			trans	74.4	103.5	135.4	61.7	0	0	0	0	122.3
536	D	26.7	Very low	29.4	Very low	169 Å²	169	130.1 Å²	130.1	90%	0.904	80%	0.798	S	S	*	*				54.8	131.2	110.4	-52.8	-17	0	0	0	121.9
537	G	28.5	Very low	29	Very low	83 Å²	83	129.6 Å²	129.6	86%	0.856	80%	0.803	S	S	*	*			trans	-178.7	84	168.5	0	0	0	0	0	112.1
538	S	27.7	Very low	29	Very low	132 Å²	132	129.3 Å²	129.3	92%	0.923	79%	0.792	S	S	*	*			trans	-89.5	152	-167.9	49.5	0	0	0	0	115.5
539	G	27.8	Very low	28.9	Very low	79 Å²	79	133.1 Å²	133.1	81%	0.814	79%	0.794	S	S	*	*			trans	-175.8	116.2	170.7	0	0	0	0	0	112.1
540	L	31.9	Very low	28.9	Very low	187 Å²	187	132.5 Å²	132.5	98%	0.979	79%	0.79	S	S	*	*			trans	-108.6	155	-173.3	-89.1	159.7	0	0	0	112.5
541	G	28.6	Very low	29	Very low	71 Å²	71	132 Å²	132	73%	0.732	79%	0.787	S	S	*	*			trans	-179.9	65.2	177.3	0	0	0	0	0	115.9
542	E	28.2	Very low	29	Very low	188 Å²	188	134.1 Å²	134.1	88%	0.879	80%	0.795	S	S	*	*			trans	34.9	119.4	155.1	-56.7	-178.4	151.4	0	0	119.1
543	S	28.4	Very low	29.2	Very low	119 Å²	119	135.8 Å²	135.8	83%	0.832	80%	0.798	S	S	*	*				-175.2	162.3	75	38.8	0	0	0	0	113.4
544	S	28.1	Very low	29	Very low	121 Å²	121	133.9 Å²	133.9	85%	0.846	80%	0.801	S	S	*	*			trans	63.7	81.7	173.1	-161	0	0	0	0	118.2
545	S	28.1	Very low	29.1	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	81%	0.807	S	S	*	*			trans	-65.4	163.7	154.2	49.9	0	0	0	0	110.9
546	V	31.6	Very low	29.6	Very low	130 Å²	130	138.3 Å²	138.3	79%	0.788	81%	0.811	S	S	*	*			cis	-136.9	134.1	35.1	174	0	0	0	0	113.3
547	L	29.2	Very low	29.8	Very low	165 Å²	165	136.5 Å²	136.5	86%	0.864	80%	0.801	S	S	*	*			trans	-116.9	168	158	-47.8	175.5	0	0	0	106.7
548	D	30.7	Very low	29.6	Very low	114 Å²	114	139.5 Å²	139.5	61%	0.61	80%	0.795	S	S	*	*			cis	-151.4	176.5	8.9	171.7	45	0	0	0	107.6	M550	D548-M550 WeakPolarHBondContact OD2-CG 3.5Å; D548-M550 PolarHBondContact OD2-N 3.04Å
549	F	27	Very low	29.7	Very low	199 Å²	199	137.8 Å²	137.8	87%	0.873	78%	0.783	S	S	*	*			trans	-154.8	96.6	132.2	-130.8	-82	0	0	0	115.5
550	M	30.1	Very low	30	Very low	143 Å²	143	141.5 Å²	141.5	70%	0.704	78%	0.783	S	S	*	*			trans	-77.5	160.2	164.2	-69	-151.3	77.7	0	0	113.9	D548	D548-M550 WeakPolarHBondContact OD2-CG 3.5Å; D548-M550 PolarHBondContact OD2-N 3.04Å
551	S	31.5	Very low	30	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	76%	0.764	S	S	*	*			trans	63.9	106.8	146.9	174.6	0	0	0	0	119.8
552	M	28.4	Very low	30.6	Very low	182 Å²	182	142.4 Å²	142.4	90%	0.897	77%	0.771	S	S	*	*			trans	-132.6	132.7	136.4	-88.6	-68.5	-77.6	0	0	110.6
553	K	31.8	Very low	31.2	Very low	185 Å²	185	136.8 Å²	136.8	80%	0.804	75%	0.752	S	S	*	*			trans	-81.4	164	162	-64.4	169	175.6	171.2	0	107.7
554	S	25.9	Very low	31.5	Very low	103 Å²	103	139 Å²	139	72%	0.72	75%	0.751	S	S	*	*			cis	-158.1	175.8	19.3	-163.6	0	0	0	0	111.2
555	Y	32.1	Very low	31.9	Very low	219 Å²	219	141.1 Å²	141.1	86%	0.859	75%	0.752	S	S	*	*			trans	-22.1	152.4	159.4	-75.4	-85.8	0	0	0	117.7
556	P	40.1	Very low	32.3	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	75%	0.753	S	S	*	*			cis	-136.3	164.9	46.6	42.5	-24.4	0	0	0	115.4
557	D	29.2	Very low	32.6	Very low	132 Å²	132	142.4 Å²	142.4	71%	0.706	75%	0.753	S	S	*	*				53.9	141.6	88	-153.8	19.8	0	0	0	117.5
558	M	25.5	Very low	32.9	Very low	146 Å²	146	143.2 Å²	143.2	72%	0.719	76%	0.757	S	S	*	*			trans	58.6	97.8	169.8	-70.2	-157.6	-78.7	0	0	121.6
559	S	30.3	Very low	32.7	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	76%	0.758	S	S	*	*				82.6	159.4	117	79.5	0	0	0	0	121.8
560	L	33.3	Very low	33	Very low	156 Å²	156	141.1 Å²	141.1	82%	0.817	76%	0.759	S	S	*	*			trans	71.5	146.2	162.4	-67.8	165.5	0	0	0	116.3
561	D	32.8	Very low	33.1	Very low	107 Å²	107	140.8 Å²	140.8	57%	0.572	77%	0.766	S	S	*	*			cis	-150.1	160.7	-3.5	-167.7	12.7	0	0	0	111.2	S563	D561-S563 VanDerWaalsContact C-N 3.32Å; D561-S563 PolarHBondContact O-N 2.97Å; D561-S563 WeakPolarHBondContact OD2-CB 3.18Å; D561-S563 PolarHBondContact OD2-OG 3.25Å
562	I	39.8	Very low	32.9	Very low	171 Å²	171	141.9 Å²	141.9	88%	0.877	77%	0.768	S	S	*	*			trans	-97.1	30.8	179.3	-41.2	-178.2	0	0	0	111.1
563	S	40.3	Very low	33	Very low	70 Å²	70	142.4 Å²	142.4	49%	0.49	77%	0.765	S	S	.	*			trans	-98.6	2.1	-169.6	49.6	0	0	0	0	115.8	D561	D561-S563 VanDerWaalsContact C-N 3.32Å; D561-S563 PolarHBondContact O-N 2.97Å; D561-S563 WeakPolarHBondContact OD2-CB 3.18Å; D561-S563 PolarHBondContact OD2-OG 3.25Å
564	M	34.9	Very low	33.5	Very low	166 Å²	166	141.5 Å²	141.5	82%	0.818	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	0.6	-175.2	-73.1	-94.3	65.5	0	0	116.1
565	L	36.6	Very low	33.5	Very low	165 Å²	165	145.3 Å²	145.3	86%	0.864	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	29.6	-178.9	-68.9	177.9	0	0	0	114.7
566	N	36.6	Very low	34.2	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	76%	0.759	S	S	*	*			trans	-141.2	128.5	155.8	-85.1	-68.9	0	0	0	106.6
567	P	39.4	Very low	33.8	Very low	120 Å²	120	137.9 Å²	137.9	78%	0.779	76%	0.76	S	S	*	*			cis	-146.5	136.3	42.7	37	-16.2	0	0	0	117.1
568	L	34	Very low	34.4	Very low	181 Å²	181	137.3 Å²	137.3	95%	0.948	76%	0.757	S	S	*	*			trans	-149.2	72.7	146.1	-157.1	76	0	0	0	111.6
569	G	28	Very low	35.2	Very low	61 Å²	61	137.2 Å²	137.2	63%	0.629	76%	0.755	S	S	*	*			trans	-86.7	147.8	178.5	0	0	0	0	0	113.5
570	K	32.8	Very low	36.1	Very low	208 Å²	208	140.7 Å²	140.7	90%	0.904	76%	0.76	S	S	*	*			trans	72.5	119.2	166.2	-45.8	167	-175.4	174.7	0	112.1
571	T	31.3	Very low	36.9	Very low	136 Å²	136	134.6 Å²	134.6	83%	0.834	74%	0.735	S	S	*	*				-170.1	170.9	53.3	52.6	0	0	0	0	108.3
572	V	26.5	Very low	37.6	Very low	118 Å²	118	135.8 Å²	135.8	72%	0.715	74%	0.737	S	S	*	*			cis	-158.2	168.2	11.5	85.4	0	0	0	0	111.9
573	K	32.1	Very low	38.2	Very low	192 Å²	192	132.8 Å²	132.8	84%	0.835	72%	0.719	S	S	*	*			trans	75.9	111.6	165.2	-79.3	166.5	-176.8	-179.6	0	120.1
574	K	41.7	Very low	38.8	Very low	167 Å²	167	136.2 Å²	136.2	73%	0.726	73%	0.727	S	S	*	*			trans	-73.7	156.2	146.4	-87.9	-164.2	171.2	-162.1	0	109.9	E579	K574-E579 IonicContact NZ-OE1 3.47Å; K574-E579 PolarHBondContact NZ-OE1 3.4Å
575	E	26.2	Very low	39.9	Very low	182 Å²	182	136.7 Å²	136.7	85%	0.85	72%	0.721	S	S	*	*			trans	-139.5	161.5	134.4	-97.4	-71.1	95	0	0	106.8
576	P	46.3	Very low	41.2	Very low	104 Å²	104	133.9 Å²	133.9	68%	0.675	71%	0.707	S	S	*	*			trans	-110	163.7	-149.7	40.3	-36.8	0	0	0	116
577	G	32.8	Very low	42.8	Very low	74 Å²	74	130.9 Å²	130.9	76%	0.763	69%	0.691	S	S	*	*			trans	134	65.2	161.6	0	0	0	0	0	116.2
578	N	41	Very low	44.1	Very low	119 Å²	119	127.3 Å²	127.3	64%	0.636	67%	0.672	S	S	*	*			trans	-159.4	39	157.4	-157.5	37.3	0	0	0	113.7
579	E	42.7	Very low	46	Very low	145 Å²	145	123.9 Å²	123.9	68%	0.678	65%	0.654	S	S	*	*			trans	-83.9	-16.9	-176.3	-61	-172.4	-179.8	0	0	112.6	K574 G581	K574-E579 IonicContact NZ-OE1 3.47Å; K574-E579 PolarHBondContact NZ-OE1 3.4Å; E579-G581 VanDerWaalsContact C-N 3.32Å; E579-G581 PolarHBondContact O-N 3.3Å
580	E	48	Very low	48.6	Very low	168 Å²	168	126.5 Å²	126.5	79%	0.785	65%	0.649	S	S	*	*	H	α-helix	trans	-65.7	-30.8	173.6	-62.7	179.1	142.6	0	0	113.2	H582	E580-H582 PolarHBondContact O-N 3.02Å
581	G	50.4	Low	50.8	Low	28 Å²	28	122.3 Å²	122.3	29%	0.289	64%	0.635	S	S	.	*	H	α-helix	trans	-70.4	-27.8	-175.9	0	0	0	0	0	114.4	E579 Y585	E579-G581 VanDerWaalsContact C-N 3.32Å; E579-G581 PolarHBondContact O-N 3.3Å; G581-Y585 WeakPolarHBondContact O-CD2 3.41Å; G581-Y585 WeakPolarHBondContact O-CE2 3.3Å
582	H	49	Very low	52.8	Low	132 Å²	132	121.1 Å²	121.1	61%	0.611	62%	0.623	S	S	*	*	H	α-helix	trans	-86.7	-42.6	-178.9	-74	-73.4	0	0	0	112.5	E580 H584 Y585 D586	E580-H582 PolarHBondContact O-N 3.02Å; H582-H584 PolarHBondContact O-N 2.85Å; H582-H584 VanDerWaalsContact O-N 3.13Å; H582-Y585 PolarHBondContact O-N 2.89Å; H582-D586 PolarHBondContact O-N 3.04Å
583	Q	51.3	Low	55.2	Low	108 Å²	108	121.1 Å²	121.1	51%	0.505	62%	0.616	S	S	.	*	H	α-helix	trans	-54.5	-35.9	177.3	-167.3	65.8	59.5	0	0	111.8	Y585 D586 D587	Q583-Y585 VanDerWaalsContact C-N 3.3Å; Q583-Y585 PolarHBondContact O-N 3.47Å; Q583-D586 PolarHBondContact O-N 3.5Å; Q583-D587 PolarHBondContact NE2-OD1 3.41Å; Q583-D587 VanDerWaalsContact O-CB 3.25Å; Q583-D587 WeakPolarHBondContact O-CB 3.45Å; Q583-D587 PolarHBondContact O-N 3.26Å
584	H	53	Low	57.5	Low	143 Å²	143	116.5 Å²	116.5	66%	0.662	60%	0.597	S	S	*	*	H	α-helix	trans	-65.3	-24.1	178.4	-107	-61.5	0	0	0	115.4	H582 A588	H582-H584 PolarHBondContact O-N 2.85Å; H582-H584 VanDerWaalsContact O-N 3.13Å; H584-A588 WeakPolarHBondContact O-CB 3.26Å
585	Y	57.2	Low	59	Low	175 Å²	175	114.5 Å²	114.5	69%	0.686	59%	0.588	S	S	*	*	H	α-helix	trans	-87.4	-44	173.9	-68.4	-75.2	0	0	0	111.2	G581 H582 Q583 D587 A588 D589	G581-Y585 WeakPolarHBondContact O-CD2 3.41Å; G581-Y585 WeakPolarHBondContact O-CE2 3.3Å; H582-Y585 PolarHBondContact O-N 2.89Å; Q583-Y585 VanDerWaalsContact C-N 3.3Å; Q583-Y585 PolarHBondContact O-N 3.47Å; Y585-D587 VanDerWaalsContact C-N 3.3Å; Y585-D587 PolarHBondContact O-N 3.18Å; Y585-A588 PolarHBondContact O-N 2.85Å; Y585-D589 PolarHBondContact O-N 3.29Å
586	D	64.8	Low	61.1	Low	106 Å²	106	112.7 Å²	112.7	57%	0.567	58%	0.58	S	S	*	*	H	α-helix	trans	-60.8	-40	176.9	-66.6	-29.3	0	0	0	111.5	H582 Q583 A588 K590	H582-D586 PolarHBondContact O-N 3.04Å; Q583-D586 PolarHBondContact O-N 3.5Å; D586-A588 VanDerWaalsContact C-N 3.35Å; D586-K590 WeakPolarHBondContact O-CB 3.47Å; D586-K590 PolarHBondContact O-N 3.1Å
587	D	69.7	Low	62.4	Low	81 Å²	81	113.2 Å²	113.2	43%	0.433	57%	0.573	S	S	.	*	H	α-helix	trans	-67.2	-33.5	174.5	-73.3	-3.1	0	0	0	112.3	Q583 Y585 L591	Q583-D587 PolarHBondContact NE2-OD1 3.41Å; Q583-D587 VanDerWaalsContact O-CB 3.25Å; Q583-D587 WeakPolarHBondContact O-CB 3.45Å; Q583-D587 PolarHBondContact O-N 3.26Å; Y585-D587 VanDerWaalsContact C-N 3.3Å; Y585-D587 PolarHBondContact O-N 3.18Å; D587-L591 WeakPolarHBondContact O-CB 3.5Å; D587-L591 PolarHBondContact O-N 3.22Å
588	A	68.1	Low	64.1	Low	45 Å²	45	111.6 Å²	111.6	37%	0.372	55%	0.553	S	S	.	*	H	α-helix	trans	-74.1	-44.5	178.9	0	0	0	0	0	112.2	H584 Y585 D586 K590 L591 L592	H584-A588 WeakPolarHBondContact O-CB 3.26Å; Y585-A588 PolarHBondContact O-N 2.85Å; D586-A588 VanDerWaalsContact C-N 3.35Å; A588-K590 VanDerWaalsContact C-N 3.32Å; A588-L591 WeakPolarHBondContact O-CB 3.43Å; A588-L591 PolarHBondContact O-N 2.92Å; A588-L591 VanDerWaalsContact O-N 3.16Å; A588-L592 PolarHBondContact O-N 3.33Å
589	D	74	Confident	64.8	Low	110 Å²	110	109.3 Å²	109.3	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-64.6	-37.7	174.2	-83.6	-7.9	0	0	0	110.9	Y585 L591 L592 Q593	Y585-D589 PolarHBondContact O-N 3.29Å; D589-L591 VanDerWaalsContact C-N 3.34Å; D589-L591 PolarHBondContact O-N 3.46Å; D589-L592 WeakPolarHBondContact O-CB 3.4Å; D589-L592 PolarHBondContact O-N 3.25Å; D589-Q593 WeakPolarHBondContact O-CB 3.43Å; D589-Q593 PolarHBondContact O-N 2.88Å
590	K	81.4	Confident	65.7	Low	116 Å²	116	105.3 Å²	105.3	50%	0.504	53%	0.53	S	S	.	.	H	α-helix	trans	-61.7	-38.7	170.9	-177.1	177.5	175.7	-63.5	0	112.6	D586 A588 Q593 E594	D586-K590 WeakPolarHBondContact O-CB 3.47Å; D586-K590 PolarHBondContact O-N 3.1Å; A588-K590 VanDerWaalsContact C-N 3.32Å; K590-Q593 PolarHBondContact O-N 2.96Å; K590-E594 IonicContact NZ-OE1 2.6Å; K590-E594 PolarHBondContact NZ-OE1 3.04Å; K590-E594 PolarHBondContact O-N 2.77Å
591	L	78.7	Confident	66.5	Low	119 Å²	119	104.7 Å²	104.7	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-69.4	-35.8	176.5	-142.7	76.7	0	0	0	112.3	D587 A588 D589 F595	D587-L591 WeakPolarHBondContact O-CB 3.5Å; D587-L591 PolarHBondContact O-N 3.22Å; A588-L591 WeakPolarHBondContact O-CB 3.43Å; A588-L591 PolarHBondContact O-N 2.92Å; A588-L591 VanDerWaalsContact O-N 3.16Å; D589-L591 VanDerWaalsContact C-N 3.34Å; D589-L591 PolarHBondContact O-N 3.46Å; L591-F595 WeakPolarHBondContact O-CB 3.4Å; L591-F595 PolarHBondContact O-N 3.02Å
592	L	73.8	Confident	66.8	Low	112 Å²	112	110 Å²	110	59%	0.586	54%	0.539	S	S	*	.	H	α-helix	trans	-64.7	-43.7	171.4	-89.4	152	0	0	0	111.7	A588 D589 F595 Q596	A588-L592 PolarHBondContact O-N 3.33Å; D589-L592 WeakPolarHBondContact O-CB 3.4Å; D589-L592 PolarHBondContact O-N 3.25Å; L592-F595 PolarHBondContact O-N 3.31Å; L592-Q596 WeakPolarHBondContact O-CB 3.39Å; L592-Q596 PolarHBondContact O-N 3.44Å
593	Q	77.6	Confident	67.1	Low	118 Å²	118	109.9 Å²	109.9	55%	0.551	55%	0.547	S	S	*	.	H	α-helix	trans	-59.7	-49.4	174.3	-171.9	89.2	25.5	0	0	111.2	D589 K590 F595 Q596 E597	D589-Q593 WeakPolarHBondContact O-CB 3.43Å; D589-Q593 PolarHBondContact O-N 2.88Å; K590-Q593 PolarHBondContact O-N 2.96Å; Q593-F595 VanDerWaalsContact C-N 3.33Å; Q593-F595 PolarHBondContact O-N 3.19Å; Q593-Q596 WeakPolarHBondContact O-CB 3.38Å; Q593-Q596 PolarHBondContact O-N 3.41Å; Q593-E597 PolarHBondContact O-N 2.83Å
594	E	78.9	Confident	66.8	Low	94 Å²	94	110.2 Å²	110.2	44%	0.439	56%	0.559	S	S	.	*	H	α-helix	trans	-63	-36.5	176.9	-77.9	177.7	-169.1	0	0	112.3	K590 A598	K590-E594 IonicContact NZ-OE1 2.6Å; K590-E594 PolarHBondContact NZ-OE1 3.04Å; K590-E594 PolarHBondContact O-N 2.77Å; E594-A598 WeakPolarHBondContact O-CB 3.38Å; E594-A598 PolarHBondContact O-N 2.88Å
595	F	73.4	Confident	66.6	Low	125 Å²	125	106.9 Å²	106.9	55%	0.548	55%	0.552	S	S	.	*	H	α-helix	trans	-66.4	-41.7	173.6	-172.1	-96.9	0	0	0	112	L591 L592 Q593 A598 Q599	L591-F595 WeakPolarHBondContact O-CB 3.4Å; L591-F595 PolarHBondContact O-N 3.02Å; L592-F595 PolarHBondContact O-N 3.31Å; Q593-F595 VanDerWaalsContact C-N 3.33Å; Q593-F595 PolarHBondContact O-N 3.19Å; F595-A598 PolarHBondContact O-N 3.33Å; F595-Q599 HydrophobicContact CD1-CG 4.23Å; F595-Q599 HydrophobicContact CE1-CG 4.01Å; F595-Q599 HydrophobicContact CZ-CG 4.41Å; F595-Q599 VanDerWaalsContact O-CG 3.26Å; F595-Q599 WeakPolarHBondContact O-CG 3.14Å; F595-Q599 PolarHBondContact O-N 2.99Å
596	Q	71.5	Confident	66.4	Low	145 Å²	145	110 Å²	110	68%	0.678	56%	0.563	S	S	*	*	H	α-helix	trans	-60	-47.3	176.2	-166.8	88.1	-14.8	0	0	111	L592 Q593 Q599 A600	L592-Q596 WeakPolarHBondContact O-CB 3.39Å; L592-Q596 PolarHBondContact O-N 3.44Å; Q593-Q596 WeakPolarHBondContact O-CB 3.38Å; Q593-Q596 PolarHBondContact O-N 3.41Å; Q596-Q599 PolarHBondContact O-N 2.9Å; Q596-A600 PolarHBondContact O-N 2.87Å
597	E	72.9	Confident	65.5	Low	114 Å²	114	110.8 Å²	110.8	53%	0.533	57%	0.574	S	S	.	*	H	α-helix	trans	-67.8	-41.3	177.9	-70.4	-177.3	176.4	0	0	112.1	Q593 Q599 A600 E601	Q593-E597 PolarHBondContact O-N 2.83Å; E597-Q599 PolarHBondContact O-N 3.16Å; E597-A600 WeakPolarHBondContact O-CA 3.49Å; E597-A600 WeakPolarHBondContact O-CB 3.48Å; E597-A600 PolarHBondContact O-N 3.04Å; E597-E601 PolarHBondContact O-N 3.25Å
598	A	67.6	Low	64.2	Low	41 Å²	41	111.6 Å²	111.6	34%	0.339	59%	0.586	S	S	.	*	H	α-helix	trans	-67.7	-18.1	175.6	0	0	0	0	0	113.6	E594 F595 R602	E594-A598 WeakPolarHBondContact O-CB 3.38Å; E594-A598 PolarHBondContact O-N 2.88Å; F595-A598 PolarHBondContact O-N 3.33Å; A598-R602 PolarHBondContact O-NE 2.98Å; A598-R602 PolarHBondContact O-NH2 2.94Å; A598-R602 VanDerWaalsContact O-NH2 3.1Å
599	Q	56.2	Low	63.1	Low	71 Å²	71	114 Å²	114	33%	0.332	60%	0.6	S	S	.	*	H	α-helix	trans	-81.3	-42.1	166.3	-65.4	-72.5	2.5	0	0	110.8	F595 Q596 E597 E601 R602 V603	F595-Q599 HydrophobicContact CD1-CG 4.23Å; F595-Q599 HydrophobicContact CE1-CG 4.01Å; F595-Q599 HydrophobicContact CZ-CG 4.41Å; F595-Q599 VanDerWaalsContact O-CG 3.26Å; F595-Q599 WeakPolarHBondContact O-CG 3.14Å; F595-Q599 PolarHBondContact O-N 2.99Å; Q596-Q599 PolarHBondContact O-N 2.9Å; E597-Q599 PolarHBondContact O-N 3.16Å; Q599-E601 PolarHBondContact O-N 2.95Å; Q599-R602 PolarHBondContact O-N 3.06Å; Q599-V603 WeakPolarHBondContact O-CG2 3.17Å; Q599-V603 PolarHBondContact O-N 2.99Å
600	A	62.4	Low	61.7	Low	60 Å²	60	115.2 Å²	115.2	50%	0.496	61%	0.606	S	S	.	*	H	α-helix	trans	-60.3	-44.5	177.6	0	0	0	0	0	112.6	Q596 E597 R602 V603 C604	Q596-A600 PolarHBondContact O-N 2.87Å; E597-A600 WeakPolarHBondContact O-CA 3.49Å; E597-A600 WeakPolarHBondContact O-CB 3.48Å; E597-A600 PolarHBondContact O-N 3.04Å; A600-R602 PolarHBondContact O-N 3.38Å; A600-V603 PolarHBondContact O-N 3.13Å; A600-C604 VanDerWaalsContact O-CB 3.3Å; A600-C604 WeakPolarHBondContact O-CB 3.22Å; A600-C604 PolarHBondContact O-N 2.9Å
601	E	63.6	Low	59.9	Low	155 Å²	155	117.7 Å²	117.7	72%	0.724	62%	0.624	S	S	*	*	H	α-helix	trans	-59.7	-44.8	174.2	-81.6	-151.2	126.7	0	0	112.2	E597 Q599 V603 C604 S605	E597-E601 PolarHBondContact O-N 3.25Å; Q599-E601 PolarHBondContact O-N 2.95Å; E601-V603 VanDerWaalsContact C-N 3.32Å; E601-V603 PolarHBondContact O-N 3.45Å; E601-C604 PolarHBondContact O-N 3.43Å; E601-S605 WeakPolarHBondContact O-CB 3.25Å; E601-S605 PolarHBondContact O-N 2.81Å
602	R	58.2	Low	57.9	Low	141 Å²	141	117.2 Å²	117.2	53%	0.532	63%	0.631	S	S	.	*	H	α-helix	trans	-61.4	-40.1	178.3	-86.7	178.7	-75.4	160.9	-1.4	112	A598 Q599 A600 S605	A598-R602 PolarHBondContact O-NE 2.98Å; A598-R602 PolarHBondContact O-NH2 2.94Å; A598-R602 VanDerWaalsContact O-NH2 3.1Å; Q599-R602 PolarHBondContact O-N 3.06Å; A600-R602 PolarHBondContact O-N 3.38Å; R602-S605 PolarHBondContact O-OG 3.43Å
603	V	55.1	Low	56.2	Low	129 Å²	129	116.8 Å²	116.8	78%	0.782	64%	0.637	S	S	*	*	H	α-helix	trans	-72.1	-30.5	176.4	173.8	0	0	0	0	112.5	Q599 A600 E601	Q599-V603 WeakPolarHBondContact O-CG2 3.17Å; Q599-V603 PolarHBondContact O-N 2.99Å; A600-V603 PolarHBondContact O-N 3.13Å; E601-V603 VanDerWaalsContact C-N 3.32Å; E601-V603 PolarHBondContact O-N 3.45Å
604	C	45	Very low	54.3	Low	114 Å²	114	119.4 Å²	119.4	77%	0.77	65%	0.654	S	S	*	*	H	α-helix	trans	-83.8	-22.1	178.6	-153.9	0	0	0	0	113.1	A600 E601	A600-C604 VanDerWaalsContact O-CB 3.3Å; A600-C604 WeakPolarHBondContact O-CB 3.22Å; A600-C604 PolarHBondContact O-N 2.9Å; E601-C604 PolarHBondContact O-N 3.43Å
605	S	49.1	Very low	52	Low	74 Å²	74	120.3 Å²	120.3	52%	0.517	67%	0.671	S	S	.	*	S	Bend	trans	-65.3	133.4	176.1	76.4	0	0	0	0	111.8	E601 R602	E601-S605 WeakPolarHBondContact O-CB 3.25Å; E601-S605 PolarHBondContact O-N 2.81Å; R602-S605 PolarHBondContact O-OG 3.43Å
606	R	53.1	Low	50.1	Low	239 Å²	239	122.4 Å²	122.4	90%	0.902	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-69.1	132.5	174.3	-90.3	-174.2	170.8	-175.9	-1.9	110.1
607	P	45.5	Very low	48.1	Very low	123 Å²	123	120 Å²	120	80%	0.799	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-61.6	148.4	171.9	27	-34.4	0	0	0	110.7
608	S	41.8	Very low	46.3	Very low	99 Å²	99	120.4 Å²	120.4	69%	0.692	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.7	147.2	-175	58.2	0	0	0	0	112.4	N610	S608-N610 PolarHBondContact O-N 2.6Å
609	S	44.2	Very low	44.9	Very low	94 Å²	94	127.4 Å²	127.4	66%	0.657	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-69	6.4	-162.1	51.4	0	0	0	0	117
610	N	45	Very low	43.7	Very low	136 Å²	136	134.6 Å²	134.6	73%	0.727	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-98.9	4.4	-162.5	-64.2	-11.3	0	0	0	114.6	S608	S608-N610 PolarHBondContact O-N 2.6Å
611	L	43.6	Very low	42.2	Very low	168 Å²	168	137.4 Å²	137.4	88%	0.88	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-108.3	3	175.4	-61.1	180	0	0	0	113.7	S613	L611-S613 PolarHBondContact O-N 3.47Å
612	S	37.8	Very low	40.6	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	77%	0.766	S	S	*	*	S	Bend	trans	-78.6	6.9	-177.5	-54	0	0	0	0	114.9
613	S	37.4	Very low	39.4	Very low	102 Å²	102	137.4 Å²	137.4	71%	0.713	77%	0.77	S	S	*	*			trans	-128.5	94.2	-171.3	-65	0	0	0	0	111.5	L611	L611-S613 PolarHBondContact O-N 3.47Å
614	L	39	Very low	38.2	Very low	174 Å²	174	138.5 Å²	138.5	91%	0.911	77%	0.767	S	S	*	*	S	Bend	trans	164.3	66	139.5	-87.6	178.1	0	0	0	111.7
615	S	30.5	Very low	37.5	Very low	113 Å²	113	141.4 Å²	141.4	79%	0.79	77%	0.774	S	S	*	*			trans	-160.8	88.5	163.7	46.2	0	0	0	0	112.3
616	N	33.1	Very low	36.4	Very low	169 Å²	169	141.5 Å²	141.5	90%	0.904	79%	0.787	S	S	*	*			trans	-160	158.2	168.4	-100.1	-38.7	0	0	0	110.3
617	A	30	Very low	35.2	Very low	94 Å²	94	135.8 Å²	135.8	78%	0.777	78%	0.783	S	S	*	*			trans	65.4	103.2	-162.1	0	0	0	0	0	112
618	S	34.8	Very low	35.4	Very low	123 Å²	123	135.5 Å²	135.5	86%	0.86	78%	0.782	S	S	*	*			cis	76.6	129.7	32.8	-153.1	0	0	0	0	114.2
619	E	37.3	Very low	34.8	Very low	187 Å²	187	136.3 Å²	136.3	87%	0.874	79%	0.787	S	S	*	*			trans	-74.8	148.9	-170.7	-61.1	162	105.9	0	0	113.1
620	R	31.7	Very low	34.1	Very low	222 Å²	222	139.6 Å²	139.6	84%	0.838	79%	0.791	S	S	*	*			trans	-157	154.8	153.9	-129.3	-170.7	160.3	117.5	4.5	113.5
621	D	30.5	Very low	33.5	Very low	120 Å²	120	139.9 Å²	139.9	64%	0.642	79%	0.792	S	S	*	*			trans	59.5	89.2	156.5	-52.7	-29.2	0	0	0	119
622	Q	30.9	Very low	32.8	Very low	161 Å²	161	135.6 Å²	135.6	75%	0.752	79%	0.789	S	S	*	*				32.4	137.3	115.7	-86.6	-179.3	-5.8	0	0	121.4
623	H	31.9	Very low	32.4	Very low	134 Å²	134	136.7 Å²	136.7	62%	0.62	79%	0.79	S	S	*	*			trans	84.8	122.4	140.3	-70.2	-42.6	0	0	0	121.8
624	H	29.9	Very low	32.1	Very low	152 Å²	152	135.3 Å²	135.3	70%	0.704	79%	0.793	S	S	*	*			trans	88.6	119.5	139.2	-58.6	-23.7	0	0	0	122
625	L	30.8	Very low	31.8	Very low	175 Å²	175	133.6 Å²	133.6	92%	0.916	79%	0.785	S	S	*	*			trans	65	143.6	139.5	-59	170.4	0	0	0	120.1
626	G	26.3	Very low	31.9	Very low	77 Å²	77	137.1 Å²	137.1	79%	0.794	79%	0.788	S	S	*	*			trans	130.8	110.9	155.6	0	0	0	0	0	116.7
627	S	27.9	Very low	31.8	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	78%	0.781	S	S	*	*			trans	-128.8	168.9	151.1	-42.7	0	0	0	0	106.7
628	P	49.8	Very low	31.8	Very low	118 Å²	118	140 Å²	140	77%	0.766	79%	0.788	S	S	*	*			cis	-126.1	-146.8	-14.9	39.6	-21.3	0	0	0	110.3
629	S	29.3	Very low	31.7	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	79%	0.788	S	S	*	*			trans	105.6	148.1	167.2	-51.1	0	0	0	0	116
630	H	29.4	Very low	31.4	Very low	163 Å²	163	140 Å²	140	76%	0.755	79%	0.786	S	S	*	*			cis	-171.7	149.6	-20.1	178.5	-135.4	0	0	0	109.8
631	L	31.3	Very low	31.4	Very low	142 Å²	142	138.1 Å²	138.1	74%	0.743	79%	0.786	S	S	*	*			trans	67.2	145.1	170.6	-73.3	167.4	0	0	0	120.9	V633	L631-V633 HydrophobicContact CD2-CG2 4.49Å
632	G	28.6	Very low	31.6	Very low	78 Å²	78	139 Å²	139	80%	0.804	79%	0.791	S	S	*	*			trans	163.1	77.2	174.8	0	0	0	0	0	111.4
633	V	30.2	Very low	31.9	Very low	133 Å²	133	136.9 Å²	136.9	81%	0.806	79%	0.791	S	S	*	*			trans	-76.3	143.3	-169.7	175.6	0	0	0	0	112.8	L631	L631-V633 HydrophobicContact CD2-CG2 4.49Å
634	G	31.1	Very low	31.9	Very low	74 Å²	74	140.8 Å²	140.8	76%	0.763	80%	0.802	S	S	*	*			trans	179.4	79	171.1	0	0	0	0	0	113.2
635	D	33.5	Very low	32.2	Very low	138 Å²	138	142.4 Å²	142.4	74%	0.738	81%	0.81	S	S	*	*			trans	-70.4	141.2	173	-76.6	-58.6	0	0	0	112.2
636	H	31	Very low	32.3	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.866	81%	0.807	S	S	*	*				-163.3	130.9	118.3	-114	-80.5	0	0	0	111.7
637	T	30.8	Very low	32.7	Very low	122 Å²	122	147.5 Å²	147.5	75%	0.748	81%	0.81	S	S	*	*			trans	-89.6	147.9	176.6	49.3	0	0	0	0	112.4
638	E	30.6	Very low	33	Very low	200 Å²	200	150.8 Å²	150.8	94%	0.935	81%	0.812	S	S	*	*			trans	-144.9	157.6	147.2	-144.3	161.3	-138.2	0	0	110.9
639	M	33.9	Very low	32.3	Very low	172 Å²	172	150.6 Å²	150.6	85%	0.847	81%	0.814	S	S	*	*			trans	-106.1	156.4	-155.9	-78.1	169.3	50	0	0	115.3
640	V	31	Very low	33	Very low	140 Å²	140	151 Å²	151	85%	0.848	81%	0.814	S	S	*	*			trans	-72.6	139.3	171.7	177.9	0	0	0	0	110.6
641	H	31.7	Very low	33.3	Very low	181 Å²	181	152.2 Å²	152.2	84%	0.838	82%	0.82	S	S	*	*			trans	-113.8	131.7	166.8	-105.4	-74.8	0	0	0	110.8
642	D	33.2	Very low	34.1	Very low	139 Å²	139	150.4 Å²	150.4	74%	0.743	82%	0.817	S	S	*	*			trans	-105.3	126.4	173	-174.1	17.3	0	0	0	109.6
643	P	38.7	Very low	34.4	Very low	116 Å²	116	156.1 Å²	156.1	75%	0.753	82%	0.822	S	S	*	*			trans	-102.3	87.7	-174.7	36.8	-31.7	0	0	0	113
644	Y	31.3	Very low	34.6	Very low	216 Å²	216	153.3 Å²	153.3	85%	0.847	82%	0.82	S	S	*	*			trans	-145.7	83	169.1	-145	-84.1	0	0	0	114.6
645	E	35.3	Very low	35	Very low	187 Å²	187	155.5 Å²	155.5	87%	0.874	82%	0.824	S	S	*	*			trans	-171.7	125.2	141.6	-113.5	179.2	-152.9	0	0	110.8
646	F	32.8	Very low	35.3	Very low	195 Å²	195	153 Å²	153	86%	0.855	82%	0.823	S	S	*	*			trans	-157.2	94.9	161	-144.1	-89.1	0	0	0	111.9
647	L	35.1	Very low	35.8	Very low	163 Å²	163	152 Å²	152	85%	0.853	82%	0.824	S	S	*	*			trans	-142	95.8	169.6	-80.6	179.5	0	0	0	110.4
648	Q	35	Very low	36.3	Very low	187 Å²	187	155.2 Å²	155.2	87%	0.874	85%	0.851	S	S	*	*			trans	-174	163.3	133.8	-101.4	155.3	55.1	0	0	112.3
649	S	34.2	Very low	36.6	Very low	115 Å²	115	153 Å²	153	80%	0.804	85%	0.847	S	S	*	*			trans	-87	158.2	-170.3	-60.2	0	0	0	0	113.3
650	P	44.6	Very low	36.7	Very low	122 Å²	122	151.9 Å²	151.9	79%	0.792	85%	0.847	S	S	*	*			trans	-89.2	153.6	177.9	36.2	-35.1	0	0	0	113.1
651	E	34.4	Very low	37	Very low	189 Å²	189	152.6 Å²	152.6	88%	0.883	85%	0.847	S	S	*	*			trans	-140.9	162.8	158.4	-87.9	-103.6	113.7	0	0	108.2
652	P	49.8	Very low	37.3	Very low	104 Å²	104	150.9 Å²	150.9	68%	0.675	85%	0.847	S	S	*	*			trans	-117	-161.3	-146	42.9	-33.8	0	0	0	116
653	E	34.4	Very low	37.6	Very low	198 Å²	198	151.7 Å²	151.7	93%	0.925	85%	0.854	S	S	*	*			trans	76.8	148.5	-178.7	-52	-164.2	168.1	0	0	115.8
654	G	35	Very low	37.5	Very low	74 Å²	74	154.1 Å²	154.1	76%	0.763	86%	0.861	S	S	*	*			cis	-160	177.3	2.3	0	0	0	0	0	113.2
655	S	38.2	Very low	38	Very low	120 Å²	120	149.6 Å²	149.6	84%	0.839	86%	0.862	S	S	*	*			trans	-81.4	144.4	-176.4	57.6	0	0	0	0	114.1
656	A	40.1	Very low	38.2	Very low	87 Å²	87	146.8 Å²	146.8	72%	0.719	86%	0.861	S	S	*	*				164	142.8	112.6	0	0	0	0	0	114.3
657	N	42.6	Very low	38.6	Very low	164 Å²	164	142.8 Å²	142.8	88%	0.877	86%	0.861	S	S	*	*			trans	5.3	127.7	149.9	-48.5	-11.5	0	0	0	119.4
658	S	40	Very low	38.9	Very low	190 Å²	190	140.9 Å²	140.9	100%	1.329	86%	0.862	S	S	*	*				-154.8	0	93	-170.8	0	0	0	0	111.6

Retrieved 658 of 658 residues in 132.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).