A0A087Y8T8_POEFO Loading...

Angiopoietin-like 1a

AlphaFold DB , UniProt , Accession A0A087Y8T8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 483 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	36.1	Very low	37.5	Very low	223 Å²	223	147.6 Å²	147.6	100%	1.099	83%	0.829	S	S	*	*				0	112.4	0	-65.6	145.7	93.4	0	0	105.6
2	Q	35	Very low	37	Very low	194 Å²	194	148.9 Å²	148.9	91%	0.907	83%	0.831	S	S	*	*				57.7	125.1	96.9	-68.4	174.3	-23.3	0	0	112.3
3	G	37.3	Very low	36.3	Very low	60 Å²	60	147.2 Å²	147.2	62%	0.619	83%	0.833	S	S	*	*			cis	165.2	141.7	-3.9	0	0	0	0	0	110
4	P	55.9	Low	35.9	Very low	131 Å²	131	149.1 Å²	149.1	85%	0.851	84%	0.838	S	S	*	*			trans	-81.9	149.3	-170.6	32.9	-36	0	0	0	113.8
5	I	38.5	Very low	35.4	Very low	155 Å²	155	146.5 Å²	146.5	80%	0.795	83%	0.834	S	S	*	*			trans	-145.3	136.2	-178.2	-60.4	-176.5	0	0	0	110.4
6	W	32.7	Very low	35.2	Very low	223 Å²	223	147.2 Å²	147.2	85%	0.845	83%	0.833	S	S	*	*			cis	-149.4	160.6	-19.5	-121.3	59.9	0	0	0	106.2
7	S	37.8	Very low	35	Very low	98 Å²	98	150.3 Å²	150.3	69%	0.685	83%	0.829	S	S	*	*			trans	-95.7	170.7	166.4	-75.2	0	0	0	0	111.2
8	L	33.7	Very low	34.8	Very low	159 Å²	159	150 Å²	150	83%	0.832	82%	0.821	S	S	*	*			trans	74.6	115.9	172.9	-57.3	153.3	0	0	0	116.2
9	C	32.1	Very low	34.6	Very low	125 Å²	125	150.1 Å²	150.1	85%	0.845	81%	0.814	S	S	*	*				-165.3	90.7	118.4	-116.4	0	0	0	0	110.8
10	A	39.3	Very low	34.3	Very low	101 Å²	101	146.9 Å²	146.9	84%	0.835	80%	0.804	S	S	*	*			trans	-91.8	100.5	164.1	0	0	0	0	0	108.3
11	L	33.8	Very low	34	Very low	155 Å²	155	148.7 Å²	148.7	81%	0.812	81%	0.805	S	S	*	*			trans	-167	170.1	173.1	-107.2	164.2	0	0	0	109.2
12	L	31.7	Very low	33.5	Very low	163 Å²	163	142.8 Å²	142.8	85%	0.853	78%	0.784	S	S	*	*			trans	70.1	66	178	-56.9	171.9	0	0	0	116.7
13	C	28.3	Very low	33.1	Very low	126 Å²	126	144.2 Å²	144.2	85%	0.851	78%	0.781	S	S	*	*			trans	-134.8	91.1	143.8	-88.1	0	0	0	0	109
14	L	30.8	Very low	32.6	Very low	174 Å²	174	147 Å²	147	91%	0.911	79%	0.791	S	S	*	*			trans	171	99.5	156.2	-99.9	169.6	0	0	0	111.1
15	S	28.1	Very low	31.1	Very low	110 Å²	110	146.2 Å²	146.2	77%	0.769	79%	0.789	S	S	*	*			trans	-175.6	99.6	144.5	55.6	0	0	0	0	112.2
16	L	31.7	Very low	30.8	Very low	158 Å²	158	149.1 Å²	149.1	83%	0.827	79%	0.79	S	S	*	*				-164.4	112.7	126.8	-90	175.1	0	0	0	103.4
17	W	32.2	Very low	30.5	Very low	200 Å²	200	145.6 Å²	145.6	76%	0.758	79%	0.787	S	S	*	*				65.1	135	65.1	-74.7	1.8	0	0	0	113.3
18	E	31.8	Very low	30.1	Very low	145 Å²	145	145.1 Å²	145.1	68%	0.678	79%	0.79	S	S	*	*			cis	-159.8	172.7	-16	-122	161	-167.9	0	0	106.9
19	E	31.4	Very low	30.2	Very low	151 Å²	151	149.6 Å²	149.6	71%	0.706	80%	0.795	S	S	*	*			cis	-140.5	-164.1	12.6	-137.5	-138.4	120.4	0	0	108.3
20	S	27.9	Very low	30	Very low	87 Å²	87	155.4 Å²	155.4	61%	0.608	80%	0.799	S	S	*	*			cis	-150.6	-178.3	10.6	-169.7	0	0	0	0	112
21	F	27.9	Very low	29.6	Very low	185 Å²	185	157.2 Å²	157.2	81%	0.811	80%	0.801	S	S	*	*			trans	-86.8	173.1	174.3	-93.5	-124.1	0	0	0	111.8
22	C	25.5	Very low	29.4	Very low	98 Å²	98	159.2 Å²	159.2	66%	0.662	80%	0.803	S	S	*	*			cis	-159.1	147.2	28.9	-156.2	0	0	0	0	115.6
23	R	27	Very low	29.3	Very low	224 Å²	224	160.7 Å²	160.7	85%	0.845	81%	0.805	S	S	*	*			trans	41.8	106.3	149.4	-78.5	178.1	169	173.3	-2.8	122.4
24	S	26.2	Very low	29.5	Very low	119 Å²	119	164.8 Å²	164.8	83%	0.832	81%	0.809	S	S	*	*				57.9	112.1	109.2	173.9	0	0	0	0	121.3
25	S	25.7	Very low	29.5	Very low	115 Å²	115	161.6 Å²	161.6	80%	0.804	80%	0.801	S	S	*	*				-151.5	171.4	123.1	-160.8	0	0	0	0	111.9
26	R	30.4	Very low	29.9	Very low	216 Å²	216	164.9 Å²	164.9	82%	0.815	81%	0.809	S	S	*	*			trans	-67.8	152.9	174.2	-52.6	165	-175	155.9	0.1	108.7
27	D	28.4	Very low	29.8	Very low	148 Å²	148	166.9 Å²	166.9	79%	0.791	81%	0.814	S	S	*	*				-176.4	177	61.8	-124.4	-51.6	0	0	0	114.6
28	A	29.4	Very low	29.7	Very low	89 Å²	89	168.6 Å²	168.6	74%	0.736	82%	0.821	S	S	*	*			trans	44.3	119.3	154.7	0	0	0	0	0	122.3
29	R	34.3	Very low	29.7	Very low	253 Å²	253	167.3 Å²	167.3	96%	0.955	83%	0.827	S	S	*	*			trans	-54.2	138.6	166.4	-60.4	167.8	173.4	166.4	-4.7	113.5
30	R	28.8	Very low	29.8	Very low	246 Å²	246	169.4 Å²	169.4	93%	0.928	83%	0.834	S	S	*	*			trans	-154.8	126.5	144.1	-136.1	171.4	-174.6	168.9	2	113.5
31	T	31.1	Very low	30.1	Very low	140 Å²	140	177.2 Å²	177.2	86%	0.859	85%	0.85	S	S	*	*			trans	-72.2	148	171.8	27	0	0	0	0	111.6
32	K	29.4	Very low	30.5	Very low	196 Å²	196	173.1 Å²	173.1	85%	0.852	85%	0.851	S	S	*	*			trans	-102.3	122.4	167.6	-77.2	-176.2	175.1	176.9	0	109.7
33	E	29.6	Very low	31.2	Very low	194 Å²	194	172.7 Å²	172.7	91%	0.907	86%	0.855	S	S	*	*			trans	-113.4	140.4	153.4	-73.9	-171.7	129.7	0	0	108.6
34	F	32.3	Very low	32.1	Very low	212 Å²	212	168.3 Å²	168.3	93%	0.93	86%	0.855	S	S	*	*			trans	-82.8	130.2	172.2	-92	-99.5	0	0	0	109.7
35	S	30.6	Very low	32.6	Very low	108 Å²	108	170.3 Å²	170.3	76%	0.755	86%	0.857	S	S	*	*			trans	-135.1	138.1	165.6	61.5	0	0	0	0	110.9	Q37	S35-Q37 PolarHBondContact O-N 3.35Å
36	L	36.1	Very low	33.8	Very low	179 Å²	179	168.5 Å²	168.5	94%	0.937	85%	0.848	S	S	*	*			trans	-76.7	114.8	-176.9	-75.6	150.1	0	0	0	110.3	R38	L36-R38 PolarHBondContact O-N 2.65Å; L36-R38 VanDerWaalsContact O-N 3.12Å
37	Q	29.8	Very low	34.8	Very low	199 Å²	199	165.2 Å²	165.2	93%	0.93	85%	0.847	S	S	*	*			trans	-69.9	107.4	176.9	-77.2	-172.7	-27.8	0	0	111.6	S35	S35-Q37 PolarHBondContact O-N 3.35Å
38	R	29.5	Very low	35.9	Very low	237 Å²	237	162.7 Å²	162.7	89%	0.894	85%	0.846	S	S	*	*			trans	-97.9	102.7	163.5	-171	177.1	-172.6	168.4	5.3	109.2	L36	L36-R38 PolarHBondContact O-N 2.65Å; L36-R38 VanDerWaalsContact O-N 3.12Å
39	S	32.7	Very low	36.9	Very low	117 Å²	117	167.5 Å²	167.5	82%	0.818	85%	0.851	S	S	*	*			trans	-56.8	138.9	-177.8	-175.7	0	0	0	0	112.8
40	K	33.9	Very low	37.6	Very low	195 Å²	195	165.2 Å²	165.2	85%	0.848	85%	0.848	S	S	*	*			trans	-106.7	139.5	167.8	-74.4	-178.3	177.6	176.6	0	108.5
41	R	34.4	Very low	38.5	Very low	251 Å²	251	159.4 Å²	159.4	95%	0.947	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-66.7	145	175.2	-65.8	178.5	178.3	168.7	-2	110.7
42	A	34.7	Very low	39.8	Very low	99 Å²	99	158.1 Å²	158.1	82%	0.818	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-78.5	171.3	173.7	0	0	0	0	0	112.3
43	A	40.1	Very low	41.5	Very low	90 Å²	90	158 Å²	158	74%	0.744	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-75.6	169.2	170.7	0	0	0	0	0	110.9
44	P	46.9	Very low	42.8	Very low	132 Å²	132	154.5 Å²	154.5	86%	0.857	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-75.5	142.8	-174.3	31.8	-33.9	0	0	0	112
45	D	36.6	Very low	43.9	Very low	161 Å²	161	152.7 Å²	152.7	86%	0.861	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-103.1	159.2	169.1	-157	-3	0	0	0	110.3
46	A	49.8	Very low	45.1	Very low	76 Å²	76	155.3 Å²	155.3	63%	0.628	83%	0.825	S	S	*	*			trans	-92.9	-178.5	-176.7	0	0	0	0	0	112.9	A48	A46-A48 PolarHBondContact O-N 3.15Å
47	D	53.1	Low	46.3	Very low	147 Å²	147	153.1 Å²	153.1	79%	0.786	82%	0.818	S	S	*	*			trans	58.1	40.7	161.8	-70.1	-1.4	0	0	0	119.3	K49	D47-K49 PolarHBondContact O-N 3.41Å; D47-K49 VanDerWaalsContact O-N 3.11Å
48	A	49.9	Very low	47.4	Very low	95 Å²	95	148.3 Å²	148.3	79%	0.785	80%	0.804	S	S	*	*			trans	-76.1	87.1	155.3	0	0	0	0	0	111.2	A46 K50	A46-A48 PolarHBondContact O-N 3.15Å; A48-K50 PolarHBondContact O-N 3.29Å
49	K	51.7	Low	48.6	Very low	190 Å²	190	144.2 Å²	144.2	83%	0.826	80%	0.795	S	S	*	*			trans	-59.3	105.3	177.6	-69.6	178.3	-179.1	173.9	0	111.9	D47 C51	D47-K49 PolarHBondContact O-N 3.41Å; D47-K49 VanDerWaalsContact O-N 3.11Å; K49-C51 PolarHBondContact O-N 3.19Å
50	K	49.1	Very low	49.8	Very low	205 Å²	205	147 Å²	147	89%	0.891	80%	0.796	S	S	*	*			trans	-77.7	113.5	172.6	-76.5	-175.2	175.6	179.8	0	111.1	A48	A48-K50 PolarHBondContact O-N 3.29Å
51	C	46.6	Very low	50.8	Low	125 Å²	125	147 Å²	147	85%	0.845	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-78.5	116.3	163	-61.6	0	0	0	0	109.6	K49	K49-C51 PolarHBondContact O-N 3.19Å
52	S	58.6	Low	52	Low	113 Å²	113	142.3 Å²	142.3	79%	0.79	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-94.1	128.7	166.8	53.3	0	0	0	0	110.3
53	Y	65.3	Low	53	Low	192 Å²	192	144.2 Å²	144.2	75%	0.753	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-99.3	141.3	171.1	53.6	-96.6	0	0	0	110.3	F55	Y53-F55 AromaticContact CD2-CD2 3.84Å; Y53-F55 HydrophobicContact CD2-CD2 3.84Å; Y53-F55 AromaticContact CD2-CE2 3.51Å; Y53-F55 HydrophobicContact CD2-CE2 3.51Å; Y53-F55 HydrophobicContact CE2-CD2 4.23Å; Y53-F55 AromaticContact CE2-CE2 3.79Å; Y53-F55 HydrophobicContact CE2-CE2 3.79Å; Y53-F55 HydrophobicContact CG-CE2 4.48Å
54	T	57.3	Low	54	Low	121 Å²	121	142.1 Å²	142.1	74%	0.742	77%	0.771	S	S	*	*			trans	-124.3	113.7	176.5	-55.9	0	0	0	0	108.4	L56	T54-L56 PolarHBondContact O-N 3.34Å
55	F	55.9	Low	54.4	Low	175 Å²	175	141.7 Å²	141.7	77%	0.768	77%	0.768	S	S	*	*			trans	-82.2	111	173.2	-74.5	-82.2	0	0	0	109.8	Y53 V57	Y53-F55 AromaticContact CD2-CD2 3.84Å; Y53-F55 HydrophobicContact CD2-CD2 3.84Å; Y53-F55 AromaticContact CD2-CE2 3.51Å; Y53-F55 HydrophobicContact CD2-CE2 3.51Å; Y53-F55 HydrophobicContact CE2-CD2 4.23Å; Y53-F55 AromaticContact CE2-CE2 3.79Å; Y53-F55 HydrophobicContact CE2-CE2 3.79Å; Y53-F55 HydrophobicContact CG-CE2 4.48Å; F55-V57 PolarHBondContact O-N 3Å
56	L	56	Low	55	Low	163 Å²	163	141.3 Å²	141.3	85%	0.853	77%	0.765	S	S	*	*			trans	-83.3	105.2	167.5	-72.6	168.2	0	0	0	108.7	T54 P58	T54-L56 PolarHBondContact O-N 3.34Å; L56-P58 WeakPolarHBondContact O-CD 3.29Å
57	V	59.9	Low	54.9	Low	132 Å²	132	143.4 Å²	143.4	80%	0.8	77%	0.774	S	S	*	*			trans	-83.9	118.6	171	-177.9	0	0	0	0	108.2	F55	F55-V57 PolarHBondContact O-N 3Å
58	P	52.6	Low	54.8	Low	98 Å²	98	140.5 Å²	140.5	64%	0.636	77%	0.77	S	S	*	*			trans	-74.4	139.3	177.5	29.6	-33.4	0	0	0	111.4	L56 Q60	L56-P58 WeakPolarHBondContact O-CD 3.29Å; P58-Q60 PolarHBondContact O-N 3.34Å
59	E	55.9	Low	54.4	Low	151 Å²	151	140.5 Å²	140.5	71%	0.706	76%	0.764	S	S	*	*			trans	-64.8	95.7	168.1	-78.3	-165.4	177	0	0	110.3	R61	E59-R61 PolarHBondContact O-N 2.92Å; E59-R61 IonicContact OE2-CZ 2.72Å; E59-R61 IonicContact OE2-NE 2.74Å; E59-R61 PolarHBondContact OE2-NE 3.42Å; E59-R61 IonicContact OE2-NH2 3.56Å; E59-R61 PolarHBondContact OE2-NH2 3.03Å
60	Q	57.6	Low	54.4	Low	177 Å²	177	138.3 Å²	138.3	83%	0.827	77%	0.767	S	S	*	*			trans	-73.6	91.4	165.6	-73.5	-166.8	-15	0	0	109.9	P58 I62	P58-Q60 PolarHBondContact O-N 3.34Å; Q60-I62 PolarHBondContact O-N 3.18Å
61	R	54.2	Low	54.2	Low	193 Å²	193	134 Å²	134	73%	0.728	76%	0.758	S	S	*	*			trans	-71.9	114.5	169.8	-65.3	-172.4	177.2	-147.3	-5.6	109.3	E59 T63	E59-R61 PolarHBondContact O-N 2.92Å; E59-R61 IonicContact OE2-CZ 2.72Å; E59-R61 IonicContact OE2-NE 2.74Å; E59-R61 PolarHBondContact OE2-NE 3.42Å; E59-R61 IonicContact OE2-NH2 3.56Å; E59-R61 PolarHBondContact OE2-NH2 3.03Å; R61-T63 PolarHBondContact O-N 3.09Å
62	I	59.3	Low	54.2	Low	153 Å²	153	131.4 Å²	131.4	79%	0.785	75%	0.752	S	S	*	*			trans	-73.3	94.9	-180	-56.1	175.7	0	0	0	109	Q60	Q60-I62 PolarHBondContact O-N 3.18Å
63	T	55.7	Low	54	Low	140 Å²	140	132.4 Å²	132.4	86%	0.859	76%	0.756	S	S	*	*			trans	-106.3	83.4	173	54.3	0	0	0	0	110.5	R61	R61-T63 PolarHBondContact O-N 3.09Å
64	G	61.8	Low	53.5	Low	46 Å²	46	131.9 Å²	131.9	47%	0.474	76%	0.761	S	S	.	*	S	Bend	trans	-166.6	150.7	173.7	0	0	0	0	0	110.8	I66	G64-I66 PolarHBondContact O-N 2.96Å
65	P	55.2	Low	53.4	Low	122 Å²	122	131.7 Å²	131.7	79%	0.792	76%	0.761	S	S	*	*			trans	-68	129.2	-179.7	27.8	-33.7	0	0	0	111.1	C67	P65-C67 PolarHBondContact O-N 3.11Å
66	I	50.5	Low	53.5	Low	154 Å²	154	128.4 Å²	128.4	79%	0.79	75%	0.752	S	S	*	*			trans	-81.2	97.3	178.5	-57.6	176	0	0	0	109	G64 A68	G64-I66 PolarHBondContact O-N 2.96Å; I66-A68 PolarHBondContact O-N 3.04Å; I66-A68 VanDerWaalsContact O-N 3.11Å
67	C	47.5	Very low	53.6	Low	120 Å²	120	130 Å²	130	81%	0.811	75%	0.752	S	S	*	*			trans	-74.8	94.5	172.8	-66.1	0	0	0	0	110.7	P65 S69	P65-C67 PolarHBondContact O-N 3.11Å; C67-S69 PolarHBondContact O-N 3Å; C67-S69 VanDerWaalsContact O-N 3.16Å
68	A	50	Low	53.6	Low	86 Å²	86	130.7 Å²	130.7	71%	0.711	75%	0.751	S	S	*	*			trans	-73.8	99.9	174.1	0	0	0	0	0	111.2	I66 T70	I66-A68 PolarHBondContact O-N 3.04Å; I66-A68 VanDerWaalsContact O-N 3.11Å; A68-T70 PolarHBondContact O-N 3.42Å
69	S	42.3	Very low	54.2	Low	95 Å²	95	135.2 Å²	135.2	66%	0.664	76%	0.755	S	S	*	*			trans	-70.8	112.6	171.5	-178.5	0	0	0	0	110.7	C67 T71	C67-S69 PolarHBondContact O-N 3Å; C67-S69 VanDerWaalsContact O-N 3.16Å; S69-T71 PolarHBondContact O-N 3.33Å; S69-T71 VanDerWaalsContact O-N 3.08Å; S69-T71 PolarHBondContact OG-OG1 3.07Å
70	T	51.1	Low	54.7	Low	143 Å²	143	132.9 Å²	132.9	88%	0.877	75%	0.751	S	S	*	*			trans	-80.8	80.8	174.7	52.5	0	0	0	0	111	A68	A68-T70 PolarHBondContact O-N 3.42Å
71	T	45.8	Very low	55.7	Low	116 Å²	116	127.6 Å²	127.6	71%	0.712	73%	0.731	S	S	*	*			trans	-126.7	143.9	173.2	41.9	0	0	0	0	110.6	S69	S69-T71 PolarHBondContact O-N 3.33Å; S69-T71 VanDerWaalsContact O-N 3.08Å; S69-T71 PolarHBondContact OG-OG1 3.07Å
72	G	45.6	Very low	56.7	Low	70 Å²	70	129.4 Å²	129.4	72%	0.722	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-67.3	169.8	-173.5	0	0	0	0	0	114.8
73	P	53.7	Low	57.6	Low	134 Å²	134	128.7 Å²	128.7	87%	0.87	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-80.8	131.4	-165.5	31.2	-35.1	0	0	0	113.9
74	E	56.4	Low	58.8	Low	181 Å²	181	125.6 Å²	125.6	85%	0.846	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-85.4	149.4	150.8	-70.2	-142.8	137.4	0	0	110.7	D76	E74-D76 VanDerWaalsContact C-N 3.35Å; E74-D76 PolarHBondContact O-N 3.47Å
75	P	54.6	Low	59.7	Low	116 Å²	116	128 Å²	128	75%	0.753	71%	0.712	S	S	*	*			trans	-80.5	79.8	176.3	33.7	-34.6	0	0	0	111	K77	P75-K77 PolarHBondContact O-N 3.4Å
76	D	58	Low	61.1	Low	106 Å²	106	124.6 Å²	124.6	57%	0.567	69%	0.694	S	S	*	*			trans	-55.7	117.6	167.6	177.2	9.2	0	0	0	110.4	E74 D78 R79	E74-D76 VanDerWaalsContact C-N 3.35Å; E74-D76 PolarHBondContact O-N 3.47Å; D76-D78 PolarHBondContact OD1-N 2.95Å; D76-D78 VanDerWaalsContact OD1-N 3.08Å; D76-R79 HydrophobicContact CB-CB 4.33Å
77	K	58.7	Low	62.8	Low	196 Å²	196	121.8 Å²	121.8	85%	0.852	68%	0.681	S	S	*	*	S	Bend	trans	-85.6	-19.3	-174.1	-71.1	-176.8	178.4	176.9	0	113.9	P75 R79	P75-K77 PolarHBondContact O-N 3.4Å; K77-R79 VanDerWaalsContact C-N 3.34Å
78	D	58.4	Low	64.7	Low	147 Å²	147	120.3 Å²	120.3	79%	0.786	67%	0.668	S	S	*	*	S	Bend	trans	-95.7	5	-178.6	-65.8	-27.7	0	0	0	111.9	D76 V80	D76-D78 PolarHBondContact OD1-N 2.95Å; D76-D78 VanDerWaalsContact OD1-N 3.08Å; D78-V80 PolarHBondContact O-N 3.44Å
79	R	65.7	Low	66.4	Low	193 Å²	193	124.2 Å²	124.2	73%	0.728	66%	0.664	S	S	*	*			trans	-70.7	87.8	177.7	-173.4	178.3	171.6	178.7	-1.9	111.8	D76 K77 T81	D76-R79 HydrophobicContact CB-CB 4.33Å; K77-R79 VanDerWaalsContact C-N 3.34Å; R79-T81 PolarHBondContact O-N 2.99Å; R79-T81 VanDerWaalsContact O-N 3.11Å
80	V	67.1	Low	68.8	Low	102 Å²	102	126.6 Å²	126.6	62%	0.618	67%	0.665	S	S	*	*			trans	-38.1	114.9	173.8	-177	0	0	0	0	111.5	D78 D84 I85	D78-V80 PolarHBondContact O-N 3.44Å; V80-D84 HydrophobicContact CG1-CB 4.32Å; V80-I85 HydrophobicContact CG1-CD1 4Å; V80-I85 HydrophobicContact CG1-CG1 3.76Å
81	T	77.4	Confident	70.6	Confident	66 Å²	66	123.7 Å²	123.7	41%	0.405	65%	0.647	S	S	.	*			trans	-87.6	169.5	-176.6	78	0	0	0	0	111.4	R79 M83 D84 I85	R79-T81 PolarHBondContact O-N 2.99Å; R79-T81 VanDerWaalsContact O-N 3.11Å; T81-M83 PolarHBondContact O-N 2.85Å; T81-M83 PolarHBondContact OG1-N 2.99Å; T81-D84 WeakPolarHBondContact CA-OD2 3.39Å; T81-D84 WeakPolarHBondContact CB-OD2 3.41Å; T81-D84 WeakPolarHBondContact CG2-OD2 3.48Å; T81-D84 PolarHBondContact N-OD2 3.38Å; T81-D84 PolarHBondContact O-N 2.95Å; T81-D84 VanDerWaalsContact OG1-CG 3.3Å; T81-D84 PolarHBondContact OG1-N 3.08Å; T81-D84 PolarHBondContact OG1-OD2 2.95Å; T81-I85 PolarHBondContact O-N 3.45Å
82	R	76.1	Confident	72.7	Confident	232 Å²	232	122.9 Å²	122.9	88%	0.875	64%	0.638	S	S	*	*	H	α-helix	trans	-67.2	-18.8	173.5	-161.8	177.2	-174.6	-175.8	2.2	112.7	A86	R82-A86 PolarHBondContact O-N 3.47Å
83	M	78.6	Confident	74.8	Confident	138 Å²	138	123.1 Å²	123.1	68%	0.68	62%	0.622	S	S	*	*	H	α-helix	trans	-78.8	-47	176.1	-69.7	172.1	57.2	0	0	110.7	T81 I85 A86 D87	T81-M83 PolarHBondContact O-N 2.85Å; T81-M83 PolarHBondContact OG1-N 2.99Å; M83-I85 PolarHBondContact O-N 3.25Å; M83-A86 CarbonylContact O-C 3.56Å; M83-A86 WeakPolarHBondContact O-CA 3.43Å; M83-A86 WeakPolarHBondContact O-CB 3.46Å; M83-A86 PolarHBondContact O-N 3.44Å; M83-D87 PolarHBondContact O-N 2.9Å
84	D	79.8	Confident	76.6	Confident	74 Å²	74	122.8 Å²	122.8	40%	0.396	61%	0.607	S	S	.	*	H	α-helix	trans	-57.2	-38.3	178.8	-47.8	-59.3	0	0	0	111.9	V80 T81 A86 V88	V80-D84 HydrophobicContact CG1-CB 4.32Å; T81-D84 WeakPolarHBondContact CA-OD2 3.39Å; T81-D84 WeakPolarHBondContact CB-OD2 3.41Å; T81-D84 WeakPolarHBondContact CG2-OD2 3.48Å; T81-D84 PolarHBondContact N-OD2 3.38Å; T81-D84 PolarHBondContact O-N 2.95Å; T81-D84 VanDerWaalsContact OG1-CG 3.3Å; T81-D84 PolarHBondContact OG1-N 3.08Å; T81-D84 PolarHBondContact OG1-OD2 2.95Å; D84-A86 VanDerWaalsContact C-N 3.34Å; D84-V88 WeakPolarHBondContact O-CB 3.49Å; D84-V88 VanDerWaalsContact O-CG2 3.28Å; D84-V88 WeakPolarHBondContact O-CG2 3.26Å; D84-V88 PolarHBondContact O-N 3.4Å
85	I	82.3	Confident	78.1	Confident	97 Å²	97	118.8 Å²	118.8	50%	0.497	59%	0.588	S	S	.	*	H	α-helix	trans	-69	-30.7	175.5	-62.7	171	0	0	0	112.1	V80 T81 M83 R89	V80-I85 HydrophobicContact CG1-CD1 4Å; V80-I85 HydrophobicContact CG1-CG1 3.76Å; T81-I85 PolarHBondContact O-N 3.45Å; M83-I85 PolarHBondContact O-N 3.25Å; I85-R89 VanDerWaalsContact O-CB 3.28Å; I85-R89 WeakPolarHBondContact O-CB 3.29Å; I85-R89 PolarHBondContact O-N 3.21Å
86	A	83.8	Confident	79.7	Confident	50 Å²	50	120.5 Å²	120.5	41%	0.413	58%	0.58	S	S	.	*	H	α-helix	trans	-74.1	-45.4	175.2	0	0	0	0	0	111.1	R82 M83 D84 R89 E90	R82-A86 PolarHBondContact O-N 3.47Å; M83-A86 CarbonylContact O-C 3.56Å; M83-A86 WeakPolarHBondContact O-CA 3.43Å; M83-A86 WeakPolarHBondContact O-CB 3.46Å; M83-A86 PolarHBondContact O-N 3.44Å; D84-A86 VanDerWaalsContact C-N 3.34Å; A86-R89 CarbonylContact O-C 3.51Å; A86-R89 WeakPolarHBondContact O-CA 3.26Å; A86-R89 WeakPolarHBondContact O-CB 3.45Å; A86-R89 PolarHBondContact O-N 3.15Å; A86-R89 VanDerWaalsContact O-N 3.11Å; A86-E90 PolarHBondContact O-N 3.12Å
87	D	86.7	Confident	81.2	Confident	96 Å²	96	123.6 Å²	123.6	51%	0.513	58%	0.584	S	S	.	*	H	α-helix	trans	-63.7	-45.4	-179.8	-65.5	-3.4	0	0	0	111.1	M83 R89 E90 V91	M83-D87 PolarHBondContact O-N 2.9Å; D87-R89 VanDerWaalsContact C-N 3.29Å; D87-R89 PolarHBondContact O-N 3.27Å; D87-E90 PolarHBondContact O-N 3.45Å; D87-E90 VanDerWaalsContact O-N 3.14Å; D87-V91 WeakPolarHBondContact O-CG2 3.29Å; D87-V91 PolarHBondContact O-N 3.23Å
88	V	85.9	Confident	82.5	Confident	89 Å²	89	118.4 Å²	118.4	54%	0.539	56%	0.562	S	S	.	*	H	α-helix	trans	-61.1	-37.8	173.1	170.2	0	0	0	0	111.5	D84 L92	D84-V88 WeakPolarHBondContact O-CB 3.49Å; D84-V88 VanDerWaalsContact O-CG2 3.28Å; D84-V88 WeakPolarHBondContact O-CG2 3.26Å; D84-V88 PolarHBondContact O-N 3.4Å; V88-L92 HydrophobicContact CG1-CD1 4.05Å; V88-L92 WeakPolarHBondContact O-CB 3.3Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.48Å; V88-L92 PolarHBondContact O-N 2.93Å
89	R	87.4	Confident	83.7	Confident	167 Å²	167	116 Å²	116	63%	0.63	55%	0.548	S	S	*	.	H	α-helix	trans	-66.9	-36.5	175.1	176.8	176.8	-69.9	-165.4	-3.5	111.9	I85 A86 D87 N93	I85-R89 VanDerWaalsContact O-CB 3.28Å; I85-R89 WeakPolarHBondContact O-CB 3.29Å; I85-R89 PolarHBondContact O-N 3.21Å; A86-R89 CarbonylContact O-C 3.51Å; A86-R89 WeakPolarHBondContact O-CA 3.26Å; A86-R89 WeakPolarHBondContact O-CB 3.45Å; A86-R89 PolarHBondContact O-N 3.15Å; A86-R89 VanDerWaalsContact O-N 3.11Å; D87-R89 VanDerWaalsContact C-N 3.29Å; D87-R89 PolarHBondContact O-N 3.27Å; R89-N93 WeakPolarHBondContact O-CB 3.43Å; R89-N93 PolarHBondContact O-N 2.82Å; R89-N93 PolarHBondContact O-ND2 3.15Å
90	E	90.9	Very high	84.7	Confident	145 Å²	145	111 Å²	111	68%	0.678	53%	0.533	S	S	*	.	H	α-helix	trans	-69.9	-42.5	176	-174.4	149.8	178.3	0	0	111.9	A86 D87 L92 N93 K94	A86-E90 PolarHBondContact O-N 3.12Å; D87-E90 PolarHBondContact O-N 3.45Å; D87-E90 VanDerWaalsContact O-N 3.14Å; E90-L92 PolarHBondContact O-N 2.95Å; E90-N93 PolarHBondContact O-N 3.47Å; E90-K94 PolarHBondContact O-N 2.95Å
91	V	89.7	Confident	85.5	Confident	82 Å²	82	110.1 Å²	110.1	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-59	-45.4	172.8	172.9	0	0	0	0	111.5	D87 N93 K94 Q95	D87-V91 WeakPolarHBondContact O-CG2 3.29Å; D87-V91 PolarHBondContact O-N 3.23Å; V91-N93 PolarHBondContact O-N 2.97Å; V91-K94 WeakPolarHBondContact O-CB 3.5Å; V91-K94 PolarHBondContact O-N 3.23Å; V91-Q95 WeakPolarHBondContact O-CG 3.37Å; V91-Q95 PolarHBondContact O-N 3.41Å
92	L	89.3	Confident	85.4	Confident	100 Å²	100	112.3 Å²	112.3	52%	0.524	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-38.4	176.1	-74.9	169.5	0	0	0	112.6	V88 E90 K94 R96	V88-L92 HydrophobicContact CG1-CD1 4.05Å; V88-L92 WeakPolarHBondContact O-CB 3.3Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.48Å; V88-L92 PolarHBondContact O-N 2.93Å; E90-L92 PolarHBondContact O-N 2.95Å; L92-K94 VanDerWaalsContact C-N 3.33Å; L92-R96 WeakPolarHBondContact O-CB 3.12Å; L92-R96 PolarHBondContact O-N 3.44Å
93	N	90.9	Very high	85.5	Confident	75 Å²	75	107.3 Å²	107.3	40%	0.401	52%	0.523	S	S	.	.	H	α-helix	trans	-67.2	-33.1	174.7	-75.8	-24.9	0	0	0	112.4	R89 E90 V91 R97	R89-N93 WeakPolarHBondContact O-CB 3.43Å; R89-N93 PolarHBondContact O-N 2.82Å; R89-N93 PolarHBondContact O-ND2 3.15Å; E90-N93 PolarHBondContact O-N 3.47Å; V91-N93 PolarHBondContact O-N 2.97Å; N93-R97 WeakPolarHBondContact O-CG 3.47Å; N93-R97 PolarHBondContact O-N 2.79Å
94	K	91.3	Very high	85.4	Confident	126 Å²	126	106.1 Å²	106.1	55%	0.548	52%	0.519	S	S	.	.	H	α-helix	trans	-68.4	-52	173.3	-170.7	-173.6	180	-159.7	0	111.2	E90 V91 L92 R96 R97 E98	E90-K94 PolarHBondContact O-N 2.95Å; V91-K94 WeakPolarHBondContact O-CB 3.5Å; V91-K94 PolarHBondContact O-N 3.23Å; L92-K94 VanDerWaalsContact C-N 3.33Å; K94-R96 VanDerWaalsContact C-N 3.27Å; K94-R96 PolarHBondContact O-N 3.46Å; K94-R97 PolarHBondContact O-N 2.94Å; K94-R97 VanDerWaalsContact O-N 3.1Å; K94-E98 WeakPolarHBondContact CE-OE1 3.48Å; K94-E98 IonicContact NZ-OE1 2.99Å; K94-E98 PolarHBondContact O-N 3.47Å; K94-E98 VanDerWaalsContact O-N 3.08Å
95	Q	87.3	Confident	85.1	Confident	97 Å²	97	106.6 Å²	106.6	45%	0.453	53%	0.525	S	S	.	.	H	α-helix	trans	-58.6	-37.4	178.3	-73.9	-179.1	-20	0	0	112.5	V91 R97 E98 I99	V91-Q95 WeakPolarHBondContact O-CG 3.37Å; V91-Q95 PolarHBondContact O-N 3.41Å; Q95-R97 PolarHBondContact O-N 3.24Å; Q95-E98 PolarHBondContact O-N 3.06Å; Q95-I99 VanDerWaalsContact O-CG1 3.31Å; Q95-I99 WeakPolarHBondContact O-CG1 3.33Å; Q95-I99 PolarHBondContact O-N 3.04Å
96	R	88.3	Confident	84.7	Confident	152 Å²	152	106.9 Å²	106.9	57%	0.574	53%	0.531	S	S	*	.	H	α-helix	trans	-55.6	-50.6	173	172	174.4	-65.5	-75.8	-2	112.2	L92 K94 E98 I99 E100	L92-R96 WeakPolarHBondContact O-CB 3.12Å; L92-R96 PolarHBondContact O-N 3.44Å; K94-R96 VanDerWaalsContact C-N 3.27Å; K94-R96 PolarHBondContact O-N 3.46Å; R96-E98 VanDerWaalsContact C-N 3.32Å; R96-E98 PolarHBondContact O-N 2.96Å; R96-I99 PolarHBondContact O-N 3.25Å; R96-E100 WeakPolarHBondContact CD-OE1 3.5Å; R96-E100 WeakPolarHBondContact CG-OE1 3.4Å; R96-E100 IonicContact NH1-OE1 2.83Å; R96-E100 WeakPolarHBondContact O-CG 3.45Å; R96-E100 PolarHBondContact O-N 2.92Å
97	R	89.8	Confident	84.2	Confident	172 Å²	172	110.8 Å²	110.8	65%	0.649	54%	0.541	S	S	*	.	H	α-helix	trans	-64.1	-37.3	179.5	-66.6	169	-176.6	160.3	1.6	112	N93 K94 Q95 E100 T101	N93-R97 WeakPolarHBondContact O-CG 3.47Å; N93-R97 PolarHBondContact O-N 2.79Å; K94-R97 PolarHBondContact O-N 2.94Å; K94-R97 VanDerWaalsContact O-N 3.1Å; Q95-R97 PolarHBondContact O-N 3.24Å; R97-E100 PolarHBondContact O-N 3.37Å; R97-T101 WeakPolarHBondContact O-CG2 3.27Å; R97-T101 PolarHBondContact O-N 3.27Å; R97-T101 PolarHBondContact O-OG1 3Å
98	E	86.8	Confident	83.5	Confident	87 Å²	87	110.8 Å²	110.8	41%	0.407	54%	0.544	S	S	.	.	H	α-helix	trans	-66.3	-37.5	175.7	-69.1	170.2	175.2	0	0	111.8	K94 Q95 R96 T101 L102	K94-E98 WeakPolarHBondContact CE-OE1 3.48Å; K94-E98 IonicContact NZ-OE1 2.99Å; K94-E98 PolarHBondContact O-N 3.47Å; K94-E98 VanDerWaalsContact O-N 3.08Å; Q95-E98 PolarHBondContact O-N 3.06Å; R96-E98 VanDerWaalsContact C-N 3.32Å; R96-E98 PolarHBondContact O-N 2.96Å; E98-T101 PolarHBondContact O-OG1 2.77Å; E98-T101 VanDerWaalsContact O-OG1 3.11Å; E98-L102 WeakPolarHBondContact O-CB 3.42Å; E98-L102 WeakPolarHBondContact O-CD1 3.5Å; E98-L102 WeakPolarHBondContact O-CG 3.43Å; E98-L102 PolarHBondContact O-N 2.92Å; E98-L102 VanDerWaalsContact O-N 3.08Å
99	I	82.6	Confident	82.8	Confident	95 Å²	95	110.9 Å²	110.9	49%	0.487	54%	0.541	S	S	.	.	H	α-helix	trans	-67.3	-42.8	173.3	-68.9	163.3	0	0	0	111.1	Q95 R96 L102 Q103	Q95-I99 VanDerWaalsContact O-CG1 3.31Å; Q95-I99 WeakPolarHBondContact O-CG1 3.33Å; Q95-I99 PolarHBondContact O-N 3.04Å; R96-I99 PolarHBondContact O-N 3.25Å; I99-L102 PolarHBondContact O-N 3.18Å; I99-Q103 WeakPolarHBondContact O-CG 3.5Å; I99-Q103 PolarHBondContact O-N 3.46Å
100	E	86.2	Confident	82.4	Confident	89 Å²	89	104.5 Å²	104.5	42%	0.416	53%	0.527	S	S	.	.	H	α-helix	trans	-64	-39.1	179.2	-72.8	160.3	-174.5	0	0	112	R96 R97 L104	R96-E100 WeakPolarHBondContact CD-OE1 3.5Å; R96-E100 WeakPolarHBondContact CG-OE1 3.4Å; R96-E100 IonicContact NH1-OE1 2.83Å; R96-E100 WeakPolarHBondContact O-CG 3.45Å; R96-E100 PolarHBondContact O-N 2.92Å; R97-E100 PolarHBondContact O-N 3.37Å; E100-L104 PolarHBondContact O-N 3.25Å
101	T	84.7	Confident	81.9	Confident	84 Å²	84	102 Å²	102	52%	0.515	52%	0.519	S	S	.	.	H	α-helix	trans	-72.3	-36.6	173.9	54.9	0	0	0	0	113.1	R97 E98 Q103 L104 V105	R97-T101 WeakPolarHBondContact O-CG2 3.27Å; R97-T101 PolarHBondContact O-N 3.27Å; R97-T101 PolarHBondContact O-OG1 3Å; E98-T101 PolarHBondContact O-OG1 2.77Å; E98-T101 VanDerWaalsContact O-OG1 3.11Å; T101-Q103 VanDerWaalsContact C-N 3.35Å; T101-Q103 PolarHBondContact O-N 3.23Å; T101-L104 PolarHBondContact O-N 2.96Å; T101-V105 PolarHBondContact O-N 3.01Å
102	L	76.1	Confident	81.3	Confident	111 Å²	111	102.7 Å²	102.7	58%	0.581	52%	0.519	S	S	*	.	H	α-helix	trans	-65.3	-35.6	175.1	-75.3	168.1	0	0	0	112.6	E98 I99 V105 V106	E98-L102 WeakPolarHBondContact O-CB 3.42Å; E98-L102 WeakPolarHBondContact O-CD1 3.5Å; E98-L102 WeakPolarHBondContact O-CG 3.43Å; E98-L102 PolarHBondContact O-N 2.92Å; E98-L102 VanDerWaalsContact O-N 3.08Å; I99-L102 PolarHBondContact O-N 3.18Å; L102-V105 PolarHBondContact O-N 3.46Å; L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.43Å; L102-V106 VanDerWaalsContact O-N 3.13Å
103	Q	76.8	Confident	80.7	Confident	127 Å²	127	101.6 Å²	101.6	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-43.6	175.3	-77.5	174.5	-6.7	0	0	112.4	I99 T101 V105 V106 E107	I99-Q103 WeakPolarHBondContact O-CG 3.5Å; I99-Q103 PolarHBondContact O-N 3.46Å; T101-Q103 VanDerWaalsContact C-N 3.35Å; T101-Q103 PolarHBondContact O-N 3.23Å; Q103-V105 VanDerWaalsContact C-N 3.34Å; Q103-V105 PolarHBondContact O-N 3.42Å; Q103-V106 PolarHBondContact O-N 2.88Å; Q103-E107 PolarHBondContact O-N 3.22Å; Q103-E107 VanDerWaalsContact O-N 3.1Å
104	L	77.3	Confident	80.3	Confident	113 Å²	113	102 Å²	102	59%	0.592	52%	0.518	S	S	*	.	H	α-helix	trans	-59.9	-40.9	175.8	-80.2	161.8	0	0	0	112.7	E100 T101 E107 V108	E100-L104 PolarHBondContact O-N 3.25Å; T101-L104 PolarHBondContact O-N 2.96Å; L104-E107 PolarHBondContact O-N 3.12Å; L104-V108 WeakPolarHBondContact O-CG2 3.28Å; L104-V108 PolarHBondContact O-N 3.47Å
105	V	74	Confident	80.1	Confident	84 Å²	84	101.8 Å²	101.8	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-43	177.4	176.3	0	0	0	0	111.3	T101 L102 Q103 E107 V108 D109	T101-V105 PolarHBondContact O-N 3.01Å; L102-V105 PolarHBondContact O-N 3.46Å; Q103-V105 VanDerWaalsContact C-N 3.34Å; Q103-V105 PolarHBondContact O-N 3.42Å; V105-E107 VanDerWaalsContact C-N 3.3Å; V105-E107 PolarHBondContact O-N 3.19Å; V105-V108 PolarHBondContact O-N 3.05Å; V105-D109 PolarHBondContact O-N 3Å
106	V	73.8	Confident	79.5	Confident	104 Å²	104	101.5 Å²	101.5	63%	0.63	52%	0.519	S	S	*	.	H	α-helix	trans	-64.1	-33.5	178.7	171.2	0	0	0	0	112.3	L102 Q103 G110	L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.43Å; L102-V106 VanDerWaalsContact O-N 3.13Å; Q103-V106 PolarHBondContact O-N 2.88Å; V106-G110 PolarHBondContact O-N 3.43Å
107	E	73.1	Confident	79.2	Confident	132 Å²	132	99.9 Å²	99.9	62%	0.617	52%	0.517	S	S	*	.	H	α-helix	trans	-69.6	-42.1	175.2	-173.2	169.2	-163.5	0	0	112.3	Q103 L104 V105 G110 N111	Q103-E107 PolarHBondContact O-N 3.22Å; Q103-E107 VanDerWaalsContact O-N 3.1Å; L104-E107 PolarHBondContact O-N 3.12Å; V105-E107 VanDerWaalsContact C-N 3.3Å; V105-E107 PolarHBondContact O-N 3.19Å; E107-G110 PolarHBondContact O-N 3.12Å; E107-N111 PolarHBondContact O-N 2.88Å; E107-N111 VanDerWaalsContact O-N 3.08Å; E107-N111 PolarHBondContact O-ND2 3.12Å
108	V	71.6	Confident	79.1	Confident	96 Å²	96	97.1 Å²	97.1	58%	0.582	51%	0.514	S	S	*	.	H	α-helix	trans	-61.6	-46.6	174.7	172.6	0	0	0	0	111.3	L104 V105 G110 N111 L112	L104-V108 WeakPolarHBondContact O-CG2 3.28Å; L104-V108 PolarHBondContact O-N 3.47Å; V105-V108 PolarHBondContact O-N 3.05Å; V108-G110 VanDerWaalsContact C-N 3.3Å; V108-G110 PolarHBondContact O-N 3.03Å; V108-N111 PolarHBondContact O-N 3.1Å; V108-L112 PolarHBondContact O-N 3.39Å
109	D	71.5	Confident	79	Confident	90 Å²	90	97.9 Å²	97.9	48%	0.481	52%	0.52	S	S	.	.	H	α-helix	trans	-61.2	-38.1	174.7	-88	-16.7	0	0	0	112.2	V105 N111 L112 V113	V105-D109 PolarHBondContact O-N 3Å; D109-N111 VanDerWaalsContact C-N 3.34Å; D109-N111 PolarHBondContact O-N 3.28Å; D109-L112 PolarHBondContact O-N 3.02Å; D109-V113 VanDerWaalsContact O-CB 3.32Å; D109-V113 WeakPolarHBondContact O-CB 3.35Å; D109-V113 VanDerWaalsContact O-CG2 3.25Å; D109-V113 WeakPolarHBondContact O-CG2 3.49Å; D109-V113 PolarHBondContact O-N 3.16Å
110	G	79.5	Confident	79.1	Confident	33 Å²	33	99.8 Å²	99.8	34%	0.34	52%	0.521	S	S	.	.	H	α-helix	trans	-59.6	-42.2	175.5	0	0	0	0	0	113	V106 E107 V108 N114	V106-G110 PolarHBondContact O-N 3.43Å; E107-G110 PolarHBondContact O-N 3.12Å; V108-G110 VanDerWaalsContact C-N 3.3Å; V108-G110 PolarHBondContact O-N 3.03Å; G110-N114 PolarHBondContact O-N 3.08Å; G110-N114 PolarHBondContact O-ND2 2.86Å
111	N	78.9	Confident	79.2	Confident	94 Å²	94	102.9 Å²	102.9	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-69.6	-47.7	176.4	-72.7	-40.6	0	0	0	111.9	E107 V108 D109 V113 N114 E115	E107-N111 PolarHBondContact O-N 2.88Å; E107-N111 VanDerWaalsContact O-N 3.08Å; E107-N111 PolarHBondContact O-ND2 3.12Å; V108-N111 PolarHBondContact O-N 3.1Å; D109-N111 VanDerWaalsContact C-N 3.34Å; D109-N111 PolarHBondContact O-N 3.28Å; N111-V113 VanDerWaalsContact C-N 3.26Å; N111-V113 PolarHBondContact O-N 3.02Å; N111-N114 WeakPolarHBondContact O-CA 3.4Å; N111-N114 WeakPolarHBondContact O-CB 3.39Å; N111-N114 PolarHBondContact O-N 3.47Å; N111-E115 PolarHBondContact O-N 3.08Å; N111-E115 VanDerWaalsContact O-N 3.08Å
112	L	78.4	Confident	79.5	Confident	95 Å²	95	104.7 Å²	104.7	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-56	-41.1	175.7	-179.5	62.7	0	0	0	111.9	V108 D109 N114 E115 M116	V108-L112 PolarHBondContact O-N 3.39Å; D109-L112 PolarHBondContact O-N 3.02Å; L112-N114 VanDerWaalsContact C-N 3.27Å; L112-N114 PolarHBondContact O-N 3.37Å; L112-E115 PolarHBondContact O-N 2.88Å; L112-M116 WeakPolarHBondContact O-CB 3.41Å; L112-M116 PolarHBondContact O-N 3.45Å
113	V	76.6	Confident	80.1	Confident	78 Å²	78	102.7 Å²	102.7	47%	0.473	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-28.8	175.3	162.9	0	0	0	0	112.7	D109 N111 K117	D109-V113 VanDerWaalsContact O-CB 3.32Å; D109-V113 WeakPolarHBondContact O-CB 3.35Å; D109-V113 VanDerWaalsContact O-CG2 3.25Å; D109-V113 WeakPolarHBondContact O-CG2 3.49Å; D109-V113 PolarHBondContact O-N 3.16Å; N111-V113 VanDerWaalsContact C-N 3.26Å; N111-V113 PolarHBondContact O-N 3.02Å; V113-K117 WeakPolarHBondContact O-CE 3.48Å; V113-K117 VanDerWaalsContact O-CG 3.31Å; V113-K117 WeakPolarHBondContact O-CG 3.4Å; V113-K117 PolarHBondContact O-N 3.38Å
114	N	81.9	Confident	80.5	Confident	82 Å²	82	105.3 Å²	105.3	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-78	-41.2	176.3	-70.9	-30.7	0	0	0	112.3	G110 N111 L112 M116 K117 L118	G110-N114 PolarHBondContact O-N 3.08Å; G110-N114 PolarHBondContact O-ND2 2.86Å; N111-N114 WeakPolarHBondContact O-CA 3.4Å; N111-N114 WeakPolarHBondContact O-CB 3.39Å; N111-N114 PolarHBondContact O-N 3.47Å; L112-N114 VanDerWaalsContact C-N 3.27Å; L112-N114 PolarHBondContact O-N 3.37Å; N114-M116 VanDerWaalsContact C-N 3.32Å; N114-M116 PolarHBondContact O-N 3.36Å; N114-K117 WeakPolarHBondContact O-CB 3.43Å; N114-K117 PolarHBondContact O-N 3Å; N114-K117 PolarHBondContact OD1-NZ 2.66Å; N114-L118 PolarHBondContact O-N 3.29Å
115	E	86.3	Confident	81.1	Confident	122 Å²	122	104.4 Å²	104.4	57%	0.57	53%	0.532	S	S	*	.	H	α-helix	trans	-59.5	-44.1	170	-63.8	-173.8	158.9	0	0	111.2	N111 L112 K117 L118 L119	N111-E115 PolarHBondContact O-N 3.08Å; N111-E115 VanDerWaalsContact O-N 3.08Å; L112-E115 PolarHBondContact O-N 2.88Å; E115-K117 PolarHBondContact O-N 3.11Å; E115-K117 VanDerWaalsContact O-N 3.13Å; E115-L118 PolarHBondContact O-N 3.41Å; E115-L119 WeakPolarHBondContact O-CG 3.43Å; E115-L119 PolarHBondContact O-N 3.06Å
116	M	76.6	Confident	81.6	Confident	92 Å²	92	106.1 Å²	106.1	45%	0.453	54%	0.535	S	S	.	.	H	α-helix	trans	-62.6	-14.8	173	-104.9	-77.2	-177.1	0	0	114.6	L112 N114 R120	L112-M116 WeakPolarHBondContact O-CB 3.41Å; L112-M116 PolarHBondContact O-N 3.45Å; N114-M116 VanDerWaalsContact C-N 3.32Å; N114-M116 PolarHBondContact O-N 3.36Å; M116-R120 WeakPolarHBondContact O-CD 3.36Å; M116-R120 WeakPolarHBondContact O-CG 3.38Å; M116-R120 PolarHBondContact O-NH1 2.95Å; M116-R120 PolarHBondContact SD-NH1 2.9Å; M116-R120 PolarHBondContact SD-NH2 3.26Å; M116-R120 VanDerWaalsContact SD-NH2 3.43Å
117	K	80.8	Confident	82	Confident	118 Å²	118	106.1 Å²	106.1	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-87.1	-41.4	167.8	-68.7	161.6	-160.6	161.1	0	110.9	V113 N114 E115 R120 K121	V113-K117 WeakPolarHBondContact O-CE 3.48Å; V113-K117 VanDerWaalsContact O-CG 3.31Å; V113-K117 WeakPolarHBondContact O-CG 3.4Å; V113-K117 PolarHBondContact O-N 3.38Å; N114-K117 WeakPolarHBondContact O-CB 3.43Å; N114-K117 PolarHBondContact O-N 3Å; N114-K117 PolarHBondContact OD1-NZ 2.66Å; E115-K117 PolarHBondContact O-N 3.11Å; E115-K117 VanDerWaalsContact O-N 3.13Å; K117-R120 PolarHBondContact O-N 3.46Å; K117-K121 PolarHBondContact O-N 3.33Å
118	L	88.7	Confident	82.7	Confident	113 Å²	113	103 Å²	103	59%	0.592	53%	0.525	S	S	*	.	H	α-helix	trans	-63.2	-52.1	179.5	-172.7	63.7	0	0	0	111.2	N114 E115 R120 K121 E122	N114-L118 PolarHBondContact O-N 3.29Å; E115-L118 PolarHBondContact O-N 3.41Å; L118-R120 VanDerWaalsContact C-N 3.26Å; L118-R120 PolarHBondContact O-N 3.29Å; L118-K121 WeakPolarHBondContact O-CA 3.24Å; L118-K121 WeakPolarHBondContact O-CB 3.48Å; L118-K121 PolarHBondContact O-N 2.8Å; L118-E122 PolarHBondContact O-N 3.2Å
119	L	84.1	Confident	83.6	Confident	104 Å²	104	106 Å²	106	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-58.3	-36.1	176.4	-67.3	170	0	0	0	112.2	E115 S123	E115-L119 WeakPolarHBondContact O-CG 3.43Å; E115-L119 PolarHBondContact O-N 3.06Å; L119-S123 WeakPolarHBondContact O-CB 3.24Å; L119-S123 PolarHBondContact O-N 3.44Å
120	R	83.6	Confident	84.6	Confident	134 Å²	134	105.7 Å²	105.7	51%	0.506	53%	0.527	S	S	.	.	H	α-helix	trans	-71.8	-28.2	173.6	-75.9	-176.9	-176.2	110.3	-6.6	113.5	M116 K117 L118 R124	M116-R120 WeakPolarHBondContact O-CD 3.36Å; M116-R120 WeakPolarHBondContact O-CG 3.38Å; M116-R120 PolarHBondContact O-NH1 2.95Å; M116-R120 PolarHBondContact SD-NH1 2.9Å; M116-R120 PolarHBondContact SD-NH2 3.26Å; M116-R120 VanDerWaalsContact SD-NH2 3.43Å; K117-R120 PolarHBondContact O-N 3.46Å; L118-R120 VanDerWaalsContact C-N 3.26Å; L118-R120 PolarHBondContact O-N 3.29Å; R120-R124 VanDerWaalsContact O-CG 3.29Å; R120-R124 WeakPolarHBondContact O-CG 3.43Å; R120-R124 PolarHBondContact O-N 3.3Å
121	K	89.4	Confident	84.9	Confident	154 Å²	154	107.7 Å²	107.7	67%	0.67	53%	0.533	S	S	*	.	H	α-helix	trans	-73.9	-44.6	173.8	-174.9	-174.9	177.4	-172.7	0	110.3	K117 L118 R124 N125	K117-K121 PolarHBondContact O-N 3.33Å; L118-K121 WeakPolarHBondContact O-CA 3.24Å; L118-K121 WeakPolarHBondContact O-CB 3.48Å; L118-K121 PolarHBondContact O-N 2.8Å; K121-R124 PolarHBondContact O-N 2.97Å; K121-N125 PolarHBondContact O-N 3.3Å; K121-N125 VanDerWaalsContact O-N 3.16Å
122	E	91	Very high	85.5	Confident	122 Å²	122	109.1 Å²	109.1	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-64.7	-46.6	176.5	-176.6	168.2	-149.6	0	0	111.9	L118 R124 N125 M126	L118-E122 PolarHBondContact O-N 3.2Å; E122-R124 VanDerWaalsContact C-N 3.27Å; E122-R124 PolarHBondContact O-N 3.34Å; E122-N125 WeakPolarHBondContact O-CB 3.43Å; E122-N125 PolarHBondContact O-N 3.35Å; E122-M126 PolarHBondContact O-N 2.83Å
123	S	88.4	Confident	86.1	Confident	69 Å²	69	109.6 Å²	109.6	48%	0.483	54%	0.539	S	S	.	.	H	α-helix	trans	-53.2	-41.7	173.8	171.2	0	0	0	0	112.5	L119 N127	L119-S123 WeakPolarHBondContact O-CB 3.24Å; L119-S123 PolarHBondContact O-N 3.44Å; S123-N127 VanDerWaalsContact O-CB 3.25Å; S123-N127 WeakPolarHBondContact O-CB 3.03Å; S123-N127 PolarHBondContact O-N 2.97Å
124	R	85.4	Confident	86.7	Confident	183 Å²	183	113.2 Å²	113.2	69%	0.691	55%	0.545	S	S	*	.	H	α-helix	trans	-66.4	-42.3	175.1	-70.7	170.5	-166.2	163.3	5.2	112.6	R120 K121 E122 N127 S128	R120-R124 VanDerWaalsContact O-CG 3.29Å; R120-R124 WeakPolarHBondContact O-CG 3.43Å; R120-R124 PolarHBondContact O-N 3.3Å; K121-R124 PolarHBondContact O-N 2.97Å; E122-R124 VanDerWaalsContact C-N 3.27Å; E122-R124 PolarHBondContact O-N 3.34Å; R124-N127 PolarHBondContact O-N 3.4Å; R124-S128 PolarHBondContact O-N 2.94Å; R124-S128 PolarHBondContact O-OG 2.97Å
125	N	88.8	Confident	86.9	Confident	94 Å²	94	114.6 Å²	114.6	50%	0.503	55%	0.55	S	S	.	.	H	α-helix	trans	-61.5	-52.3	176.2	-177.8	-48.8	0	0	0	110.2	K121 E122 N127 S128 R129	K121-N125 PolarHBondContact O-N 3.3Å; K121-N125 VanDerWaalsContact O-N 3.16Å; E122-N125 WeakPolarHBondContact O-CB 3.43Å; E122-N125 PolarHBondContact O-N 3.35Å; N125-N127 VanDerWaalsContact C-N 3.31Å; N125-N127 PolarHBondContact O-N 3.02Å; N125-S128 PolarHBondContact O-N 3.45Å; N125-S128 VanDerWaalsContact O-N 3.09Å; N125-S128 PolarHBondContact O-OG 3Å; N125-R129 PolarHBondContact O-N 3.45Å; N125-R129 WeakPolarHBondContact OD1-CD 3.44Å
126	M	86.2	Confident	87.2	Confident	119 Å²	119	114.2 Å²	114.2	59%	0.586	55%	0.548	S	S	*	.	H	α-helix	trans	-57.7	-42.2	177	-174.4	160.4	62	0	0	111.9	E122 S128 R129 V130	E122-M126 PolarHBondContact O-N 2.83Å; M126-S128 PolarHBondContact O-N 3.46Å; M126-R129 PolarHBondContact O-N 3.48Å; M126-V130 WeakPolarHBondContact O-CG2 3.23Å; M126-V130 PolarHBondContact O-N 3.4Å
127	N	80.6	Confident	87.8	Confident	104 Å²	104	114.4 Å²	114.4	56%	0.556	55%	0.551	S	S	*	*	H	α-helix	trans	-63.7	-40.7	176.1	-160.7	48.3	0	0	0	112.1	S123 R124 N125 R129 V130 T131	S123-N127 VanDerWaalsContact O-CB 3.25Å; S123-N127 WeakPolarHBondContact O-CB 3.03Å; S123-N127 PolarHBondContact O-N 2.97Å; R124-N127 PolarHBondContact O-N 3.4Å; N125-N127 VanDerWaalsContact C-N 3.31Å; N125-N127 PolarHBondContact O-N 3.02Å; N127-R129 VanDerWaalsContact C-N 3.34Å; N127-R129 PolarHBondContact O-N 3.41Å; N127-V130 PolarHBondContact O-N 3.25Å; N127-T131 PolarHBondContact O-N 3.35Å; N127-T131 PolarHBondContact O-OG1 2.84Å; N127-T131 VanDerWaalsContact O-OG1 3.07Å
128	S	88.7	Confident	88.1	Confident	67 Å²	67	112 Å²	112	47%	0.469	54%	0.543	S	S	.	.	H	α-helix	trans	-63.6	-36.6	173.1	59.5	0	0	0	0	113.2	R124 N125 M126 T131 Q132	R124-S128 PolarHBondContact O-N 2.94Å; R124-S128 PolarHBondContact O-OG 2.97Å; N125-S128 PolarHBondContact O-N 3.45Å; N125-S128 VanDerWaalsContact O-N 3.09Å; N125-S128 PolarHBondContact O-OG 3Å; M126-S128 PolarHBondContact O-N 3.46Å; S128-T131 PolarHBondContact O-N 3.45Å; S128-Q132 WeakPolarHBondContact O-CB 3.49Å; S128-Q132 PolarHBondContact O-N 2.75Å
129	R	91.1	Very high	88	Confident	159 Å²	159	113 Å²	113	60%	0.6	54%	0.544	S	S	*	.	H	α-helix	trans	-66.6	-39.6	173.8	-68.8	177.9	67.9	-172	1	111.6	N125 M126 N127 Q132 L133	N125-R129 PolarHBondContact O-N 3.45Å; N125-R129 WeakPolarHBondContact OD1-CD 3.44Å; M126-R129 PolarHBondContact O-N 3.48Å; N127-R129 VanDerWaalsContact C-N 3.34Å; N127-R129 PolarHBondContact O-N 3.41Å; R129-Q132 PolarHBondContact O-N 2.9Å; R129-L133 WeakPolarHBondContact O-CB 3.46Å; R129-L133 VanDerWaalsContact O-CG 3.31Å; R129-L133 WeakPolarHBondContact O-CG 3.45Å; R129-L133 PolarHBondContact O-N 2.85Å
130	V	91.1	Very high	88.3	Confident	83 Å²	83	112.7 Å²	112.7	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-62.9	-44	173.2	169.6	0	0	0	0	111.1	M126 N127 Q132 L133 Y134	M126-V130 WeakPolarHBondContact O-CG2 3.23Å; M126-V130 PolarHBondContact O-N 3.4Å; N127-V130 PolarHBondContact O-N 3.25Å; V130-Q132 VanDerWaalsContact C-N 3.34Å; V130-Q132 PolarHBondContact O-N 3Å; V130-L133 PolarHBondContact O-N 2.76Å; V130-Y134 VanDerWaalsContact O-CB 3.31Å; V130-Y134 WeakPolarHBondContact O-CB 3.49Å; V130-Y134 PolarHBondContact O-N 2.94Å
131	T	86.9	Confident	88.4	Confident	76 Å²	76	110.9 Å²	110.9	47%	0.466	54%	0.54	S	S	.	.	H	α-helix	trans	-61.2	-41.8	173.8	-52.6	0	0	0	0	111.9	N127 S128 Y134 M135	N127-T131 PolarHBondContact O-N 3.35Å; N127-T131 PolarHBondContact O-OG1 2.84Å; N127-T131 VanDerWaalsContact O-OG1 3.07Å; S128-T131 PolarHBondContact O-N 3.45Å; T131-Y134 PolarHBondContact O-N 3.38Å; T131-M135 WeakPolarHBondContact O-CG 3.3Å; T131-M135 PolarHBondContact O-N 3.29Å
132	Q	91.8	Very high	87.9	Confident	124 Å²	124	107.4 Å²	107.4	58%	0.579	53%	0.527	S	S	*	.	H	α-helix	trans	-64.6	-45.7	178.2	-171	175	9.3	0	0	112.1	S128 R129 V130 Y134 M135 Q136	S128-Q132 WeakPolarHBondContact O-CB 3.49Å; S128-Q132 PolarHBondContact O-N 2.75Å; R129-Q132 PolarHBondContact O-N 2.9Å; V130-Q132 VanDerWaalsContact C-N 3.34Å; V130-Q132 PolarHBondContact O-N 3Å; Q132-Y134 VanDerWaalsContact C-N 3.35Å; Q132-Y134 PolarHBondContact O-N 3.18Å; Q132-M135 PolarHBondContact O-N 2.78Å; Q132-Q136 WeakPolarHBondContact O-CG 3.47Å; Q132-Q136 PolarHBondContact O-N 3.43Å
133	L	91.1	Very high	87.7	Confident	105 Å²	105	109.6 Å²	109.6	55%	0.55	53%	0.531	S	S	.	.	H	α-helix	trans	-63.3	-39.3	175.2	-71.3	167.1	0	0	0	111.9	R129 V130 Q136 L137	R129-L133 WeakPolarHBondContact O-CB 3.46Å; R129-L133 VanDerWaalsContact O-CG 3.31Å; R129-L133 WeakPolarHBondContact O-CG 3.45Å; R129-L133 PolarHBondContact O-N 2.85Å; V130-L133 PolarHBondContact O-N 2.76Å; L133-Q136 PolarHBondContact O-N 3.27Å; L133-L137 WeakPolarHBondContact O-CB 3.33Å; L133-L137 PolarHBondContact O-N 2.95Å
134	Y	89.1	Confident	87.2	Confident	153 Å²	153	112.7 Å²	112.7	60%	0.6	54%	0.535	S	S	*	.	H	α-helix	trans	-61.6	-43.8	175	-179.2	-94	0	0	0	111.8	V130 T131 Q132 L137 L138	V130-Y134 VanDerWaalsContact O-CB 3.31Å; V130-Y134 WeakPolarHBondContact O-CB 3.49Å; V130-Y134 PolarHBondContact O-N 2.94Å; T131-Y134 PolarHBondContact O-N 3.38Å; Q132-Y134 VanDerWaalsContact C-N 3.35Å; Q132-Y134 PolarHBondContact O-N 3.18Å; Y134-L137 PolarHBondContact O-N 2.81Å; Y134-L138 HydrophobicContact CE1-CD2 4.44Å; Y134-L138 VanDerWaalsContact O-CB 3.27Å; Y134-L138 WeakPolarHBondContact O-CB 3.22Å; Y134-L138 PolarHBondContact O-N 2.79Å
135	M	85.8	Confident	87	Confident	111 Å²	111	113.1 Å²	113.1	55%	0.547	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-37	176.5	-68.8	-59.2	-64	0	0	112.6	T131 Q132 L138 H139	T131-M135 WeakPolarHBondContact O-CG 3.3Å; T131-M135 PolarHBondContact O-N 3.29Å; Q132-M135 PolarHBondContact O-N 2.78Å; M135-L138 HydrophobicContact SD-CD2 4.4Å; M135-H139 WeakPolarHBondContact O-CB 3.34Å; M135-H139 PolarHBondContact O-N 3.33Å
136	Q	91.6	Very high	86.5	Confident	115 Å²	115	112.5 Å²	112.5	54%	0.537	53%	0.534	S	S	.	.	H	α-helix	trans	-64	-48.5	173.4	-74.1	177.1	-48	0	0	111.6	Q132 L133 L138 H139 E140	Q132-Q136 WeakPolarHBondContact O-CG 3.47Å; Q132-Q136 PolarHBondContact O-N 3.43Å; L133-Q136 PolarHBondContact O-N 3.27Å; Q136-L138 PolarHBondContact O-N 3.3Å; Q136-H139 PolarHBondContact O-N 3.37Å; Q136-E140 PolarHBondContact O-N 3.2Å
137	L	89.4	Confident	86.3	Confident	96 Å²	96	110.7 Å²	110.7	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-61.5	-42.9	177.5	178.8	61.4	0	0	0	111.8	L133 Y134 H139 E140 I141	L133-L137 WeakPolarHBondContact O-CB 3.33Å; L133-L137 PolarHBondContact O-N 2.95Å; Y134-L137 PolarHBondContact O-N 2.81Å; L137-H139 VanDerWaalsContact C-N 3.33Å; L137-H139 PolarHBondContact O-N 3.05Å; L137-E140 PolarHBondContact O-N 2.64Å; L137-I141 HydrophobicContact CD1-CD1 3.98Å; L137-I141 HydrophobicContact CD1-CG1 4.22Å; L137-I141 HydrophobicContact CG-CD1 3.83Å; L137-I141 HydrophobicContact CG-CG1 4.48Å; L137-I141 WeakPolarHBondContact O-CB 3.4Å; L137-I141 VanDerWaalsContact O-CG1 3.26Å; L137-I141 WeakPolarHBondContact O-CG1 3.09Å; L137-I141 PolarHBondContact O-N 3.18Å
138	L	88.4	Confident	86.4	Confident	66 Å²	66	109.2 Å²	109.2	35%	0.346	52%	0.524	S	S	.	.	H	α-helix	trans	-59.8	-43.6	175.7	-178.6	63.5	0	0	0	111.6	Y134 M135 Q136 I141 I142	Y134-L138 HydrophobicContact CE1-CD2 4.44Å; Y134-L138 VanDerWaalsContact O-CB 3.27Å; Y134-L138 WeakPolarHBondContact O-CB 3.22Å; Y134-L138 PolarHBondContact O-N 2.79Å; M135-L138 HydrophobicContact SD-CD2 4.4Å; Q136-L138 PolarHBondContact O-N 3.3Å; L138-I141 PolarHBondContact O-N 2.03Å; L138-I142 HydrophobicContact CD1-CD1 4.22Å; L138-I142 HydrophobicContact CG-CD1 4.06Å; L138-I142 VanDerWaalsContact O-CG1 3.27Å; L138-I142 WeakPolarHBondContact O-CG1 3.35Å; L138-I142 PolarHBondContact O-N 2.88Å
139	H	86.1	Confident	86.1	Confident	134 Å²	134	110.9 Å²	110.9	62%	0.62	53%	0.527	S	S	*	.	H	α-helix	trans	-66.9	-38.3	177.8	-166.6	74.2	0	0	0	112.3	M135 Q136 L137 R143	M135-H139 WeakPolarHBondContact O-CB 3.34Å; M135-H139 PolarHBondContact O-N 3.33Å; Q136-H139 PolarHBondContact O-N 3.37Å; L137-H139 VanDerWaalsContact C-N 3.33Å; L137-H139 PolarHBondContact O-N 3.05Å; H139-R143 WeakPolarHBondContact O-CB 3.26Å; H139-R143 PolarHBondContact O-N 3.12Å
140	E	90.5	Very high	85.7	Confident	98 Å²	98	109.5 Å²	109.5	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-68.2	-39.4	174.9	-161.1	-169.8	141.7	0	0	112.4	Q136 L137 R143 K144	Q136-E140 PolarHBondContact O-N 3.2Å; L137-E140 PolarHBondContact O-N 2.64Å; E140-R143 PolarHBondContact O-N 3.17Å; E140-K144 HydrophobicContact CG-CD 4.34Å; E140-K144 WeakPolarHBondContact O-CB 3.31Å; E140-K144 WeakPolarHBondContact O-CG 3.47Å; E140-K144 PolarHBondContact O-N 3.31Å; E140-K144 VanDerWaalsContact OE1-CE 3.26Å; E140-K144 WeakPolarHBondContact OE1-CE 3.49Å; E140-K144 IonicContact OE1-NZ 3.58Å; E140-K144 PolarHBondContact OE1-NZ 3.05Å
141	I	84.8	Confident	85.2	Confident	97 Å²	97	110.8 Å²	110.8	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-62.3	-45.5	175.2	-72.9	168	0	0	0	110.9	L137 L138 K144 R145	L137-I141 HydrophobicContact CD1-CD1 3.98Å; L137-I141 HydrophobicContact CD1-CG1 4.22Å; L137-I141 HydrophobicContact CG-CD1 3.83Å; L137-I141 HydrophobicContact CG-CG1 4.48Å; L137-I141 WeakPolarHBondContact O-CB 3.4Å; L137-I141 VanDerWaalsContact O-CG1 3.26Å; L137-I141 WeakPolarHBondContact O-CG1 3.09Å; L137-I141 PolarHBondContact O-N 3.18Å; L138-I141 PolarHBondContact O-N 2.03Å; I141-K144 PolarHBondContact O-N 2.76Å; I141-R145 WeakPolarHBondContact O-CB 3.36Å; I141-R145 PolarHBondContact O-N 3.34Å
142	I	79.9	Confident	84.9	Confident	80 Å²	80	109 Å²	109	41%	0.41	52%	0.523	S	S	.	.	H	α-helix	trans	-60.9	-52.3	176.4	-69.1	165.2	0	0	0	109.7	L138 K144 R145 D146	L138-I142 HydrophobicContact CD1-CD1 4.22Å; L138-I142 HydrophobicContact CG-CD1 4.06Å; L138-I142 VanDerWaalsContact O-CG1 3.27Å; L138-I142 WeakPolarHBondContact O-CG1 3.35Å; L138-I142 PolarHBondContact O-N 2.88Å; I142-K144 VanDerWaalsContact C-N 3.32Å; I142-K144 PolarHBondContact O-N 2.94Å; I142-R145 WeakPolarHBondContact O-CA 3.03Å; I142-R145 WeakPolarHBondContact O-CB 3.41Å; I142-R145 PolarHBondContact O-N 2.85Å; I142-D146 WeakPolarHBondContact CG2-OD2 3.49Å; I142-D146 VanDerWaalsContact O-CG 3.29Å; I142-D146 PolarHBondContact O-N 3.22Å
143	R	85.4	Confident	84.7	Confident	169 Å²	169	107.2 Å²	107.2	64%	0.638	52%	0.515	S	S	*	.	H	α-helix	trans	-57.6	-41.2	178.7	-174.1	179.1	178.1	-166.5	-1.1	113.1	H139 E140 D146 N147	H139-R143 WeakPolarHBondContact O-CB 3.26Å; H139-R143 PolarHBondContact O-N 3.12Å; E140-R143 PolarHBondContact O-N 3.17Å; R143-D146 PolarHBondContact O-N 2.89Å; R143-N147 WeakPolarHBondContact O-CB 3.36Å; R143-N147 VanDerWaalsContact O-CG 3.3Å; R143-N147 PolarHBondContact O-N 3.39Å; R143-N147 VanDerWaalsContact O-N 3.08Å; R143-N147 PolarHBondContact O-OD1 3.16Å; R143-N147 VanDerWaalsContact O-OD1 3.13Å
144	K	79.2	Confident	84.7	Confident	133 Å²	133	106.9 Å²	106.9	58%	0.578	51%	0.513	S	S	*	.	H	α-helix	trans	-67.8	-35.1	176.2	-81	176.1	168.2	168.8	0	112.4	E140 I141 I142 S148	E140-K144 HydrophobicContact CG-CD 4.34Å; E140-K144 WeakPolarHBondContact O-CB 3.31Å; E140-K144 WeakPolarHBondContact O-CG 3.47Å; E140-K144 PolarHBondContact O-N 3.31Å; E140-K144 VanDerWaalsContact OE1-CE 3.26Å; E140-K144 WeakPolarHBondContact OE1-CE 3.49Å; E140-K144 IonicContact OE1-NZ 3.58Å; E140-K144 PolarHBondContact OE1-NZ 3.05Å; I141-K144 PolarHBondContact O-N 2.76Å; I142-K144 VanDerWaalsContact C-N 3.32Å; I142-K144 PolarHBondContact O-N 2.94Å; K144-S148 WeakPolarHBondContact O-CB 2.92Å; K144-S148 PolarHBondContact O-N 2.96Å; K144-S148 VanDerWaalsContact O-N 3.09Å
145	R	80.8	Confident	84.5	Confident	193 Å²	193	105.7 Å²	105.7	73%	0.728	51%	0.514	S	S	*	.	H	α-helix	trans	-64.9	-45.7	173.4	178.4	-176	179.3	171.3	0.5	111.6	I141 I142 S148 L149	I141-R145 WeakPolarHBondContact O-CB 3.36Å; I141-R145 PolarHBondContact O-N 3.34Å; I142-R145 WeakPolarHBondContact O-CA 3.03Å; I142-R145 WeakPolarHBondContact O-CB 3.41Å; I142-R145 PolarHBondContact O-N 2.85Å; R145-S148 WeakPolarHBondContact O-CB 3.39Å; R145-S148 PolarHBondContact O-N 3.02Å; R145-S148 VanDerWaalsContact O-N 3.16Å; R145-L149 PolarHBondContact O-N 3.09Å
146	D	77.4	Confident	84.6	Confident	81 Å²	81	105.6 Å²	105.6	43%	0.433	52%	0.515	S	S	.	.	H	α-helix	trans	-68.5	-44.4	-176	-60.2	-24.4	0	0	0	110.7	I142 R143 S148 L149 E150	I142-D146 WeakPolarHBondContact CG2-OD2 3.49Å; I142-D146 VanDerWaalsContact O-CG 3.29Å; I142-D146 PolarHBondContact O-N 3.22Å; R143-D146 PolarHBondContact O-N 2.89Å; D146-S148 VanDerWaalsContact C-N 3.26Å; D146-S148 PolarHBondContact O-N 3.31Å; D146-L149 WeakPolarHBondContact O-CB 3.49Å; D146-L149 PolarHBondContact O-N 3.44Å; D146-E150 PolarHBondContact O-N 2.93Å; D146-E150 VanDerWaalsContact O-N 3.11Å
147	N	83.1	Confident	84.7	Confident	81 Å²	81	107.4 Å²	107.4	43%	0.433	52%	0.517	S	S	.	.	H	α-helix	trans	-55.7	-38.8	169.3	-73.6	24.9	0	0	0	112.6	R143 L149 E150 L151	R143-N147 WeakPolarHBondContact O-CB 3.36Å; R143-N147 VanDerWaalsContact O-CG 3.3Å; R143-N147 PolarHBondContact O-N 3.39Å; R143-N147 VanDerWaalsContact O-N 3.08Å; R143-N147 PolarHBondContact O-OD1 3.16Å; R143-N147 VanDerWaalsContact O-OD1 3.13Å; N147-L149 VanDerWaalsContact C-N 3.3Å; N147-L149 PolarHBondContact O-N 3.12Å; N147-E150 PolarHBondContact O-N 3.4Å; N147-L151 WeakPolarHBondContact O-CG 3.37Å; N147-L151 PolarHBondContact O-N 3.06Å; N147-L151 VanDerWaalsContact O-N 3.08Å
148	S	82.4	Confident	84.8	Confident	72 Å²	72	107.1 Å²	107.1	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-69.1	-27.8	177.6	-172.2	0	0	0	0	112.9	K144 R145 D146 A152	K144-S148 WeakPolarHBondContact O-CB 2.92Å; K144-S148 PolarHBondContact O-N 2.96Å; K144-S148 VanDerWaalsContact O-N 3.09Å; R145-S148 WeakPolarHBondContact O-CB 3.39Å; R145-S148 PolarHBondContact O-N 3.02Å; R145-S148 VanDerWaalsContact O-N 3.16Å; D146-S148 VanDerWaalsContact C-N 3.26Å; D146-S148 PolarHBondContact O-N 3.31Å; S148-A152 PolarHBondContact O-N 3.14Å; S148-A152 VanDerWaalsContact O-N 3.15Å
149	L	82.6	Confident	84.8	Confident	103 Å²	103	109.5 Å²	109.5	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-73.9	-39.7	174.8	-178.7	62.1	0	0	0	111.1	R145 D146 N147 A152 Q153	R145-L149 PolarHBondContact O-N 3.09Å; D146-L149 WeakPolarHBondContact O-CB 3.49Å; D146-L149 PolarHBondContact O-N 3.44Å; N147-L149 VanDerWaalsContact C-N 3.3Å; N147-L149 PolarHBondContact O-N 3.12Å; L149-A152 PolarHBondContact O-N 2.67Å; L149-Q153 WeakPolarHBondContact O-CG 3.35Å; L149-Q153 PolarHBondContact O-N 2.74Å
150	E	83.6	Confident	85.1	Confident	129 Å²	129	107.9 Å²	107.9	60%	0.603	53%	0.528	S	S	*	.	H	α-helix	trans	-62.6	-43.4	173.3	-66.7	-170.2	151	0	0	111.9	D146 N147 Q153 L154	D146-E150 PolarHBondContact O-N 2.93Å; D146-E150 VanDerWaalsContact O-N 3.11Å; N147-E150 PolarHBondContact O-N 3.4Å; E150-Q153 PolarHBondContact O-N 2.82Å; E150-L154 WeakPolarHBondContact O-CG 3.09Å; E150-L154 PolarHBondContact O-N 2.9Å
151	L	80.5	Confident	85.3	Confident	111 Å²	111	107.9 Å²	107.9	58%	0.581	53%	0.534	S	S	*	.	H	α-helix	trans	-58.8	-49.2	174.6	-75.3	167.9	0	0	0	112	N147 Q153 L154 E155	N147-L151 WeakPolarHBondContact O-CG 3.37Å; N147-L151 PolarHBondContact O-N 3.06Å; N147-L151 VanDerWaalsContact O-N 3.08Å; L151-Q153 VanDerWaalsContact C-N 3.28Å; L151-Q153 PolarHBondContact O-N 2.97Å; L151-L154 WeakPolarHBondContact O-CB 3.43Å; L151-L154 PolarHBondContact O-N 2.74Å; L151-E155 PolarHBondContact O-N 2.91Å
152	A	80.3	Confident	85.6	Confident	37 Å²	37	106.4 Å²	106.4	31%	0.306	53%	0.529	S	S	.	.	H	α-helix	trans	-62.3	-34.3	177.5	0	0	0	0	0	112.7	S148 L149 N156	S148-A152 PolarHBondContact O-N 3.14Å; S148-A152 VanDerWaalsContact O-N 3.15Å; L149-A152 PolarHBondContact O-N 2.67Å; A152-N156 PolarHBondContact O-N 2.59Å; A152-N156 PolarHBondContact O-ND2 2.83Å
153	Q	87.6	Confident	86.1	Confident	87 Å²	87	104.2 Å²	104.2	41%	0.407	52%	0.521	S	S	.	.	H	α-helix	trans	-68.9	-33.7	172.4	-74.8	-175.4	32.9	0	0	113	L149 E150 L151 R157	L149-Q153 WeakPolarHBondContact O-CG 3.35Å; L149-Q153 PolarHBondContact O-N 2.74Å; E150-Q153 PolarHBondContact O-N 2.82Å; L151-Q153 VanDerWaalsContact C-N 3.28Å; L151-Q153 PolarHBondContact O-N 2.97Å; Q153-R157 VanDerWaalsContact O-CG 3.29Å; Q153-R157 WeakPolarHBondContact O-CG 3.33Å; Q153-R157 PolarHBondContact O-N 2.97Å; Q153-R157 PolarHBondContact O-NE 2.84Å; Q153-R157 VanDerWaalsContact OE1-NH2 3.1Å
154	L	90.4	Very high	86.5	Confident	98 Å²	98	100.7 Å²	100.7	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-71.3	-44	175.8	-73.7	167.7	0	0	0	111.1	E150 L151 N156 R157 V158	E150-L154 WeakPolarHBondContact O-CG 3.09Å; E150-L154 PolarHBondContact O-N 2.9Å; L151-L154 WeakPolarHBondContact O-CB 3.43Å; L151-L154 PolarHBondContact O-N 2.74Å; L154-N156 VanDerWaalsContact C-N 3.34Å; L154-N156 PolarHBondContact O-N 2.87Å; L154-R157 PolarHBondContact O-N 3.46Å; L154-R157 VanDerWaalsContact O-N 3.12Å; L154-V158 WeakPolarHBondContact O-CG2 3.46Å; L154-V158 PolarHBondContact O-N 2.92Å
155	E	85.1	Confident	87	Confident	129 Å²	129	101 Å²	101	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-56.4	-45.9	174.1	-72.4	-176.1	129.1	0	0	111.9	L151 R157 V158 L159	L151-E155 PolarHBondContact O-N 2.91Å; E155-R157 VanDerWaalsContact C-N 3.32Å; E155-R157 PolarHBondContact O-N 2.81Å; E155-V158 PolarHBondContact O-N 3.32Å; E155-L159 WeakPolarHBondContact O-CB 3.39Å; E155-L159 WeakPolarHBondContact O-CG 3.23Å; E155-L159 PolarHBondContact O-N 3.24Å
156	N	88.8	Confident	87.2	Confident	108 Å²	108	97.6 Å²	97.6	58%	0.578	51%	0.511	S	S	*	.	H	α-helix	trans	-62.8	-36.3	177	-83.6	-87.5	0	0	0	112.8	A152 L154 N160	A152-N156 PolarHBondContact O-N 2.59Å; A152-N156 PolarHBondContact O-ND2 2.83Å; L154-N156 VanDerWaalsContact C-N 3.34Å; L154-N156 PolarHBondContact O-N 2.87Å; N156-N160 WeakPolarHBondContact O-CB 3.3Å; N156-N160 PolarHBondContact O-N 2.74Å; N156-N160 VanDerWaalsContact O-N 3.09Å
157	R	92.9	Very high	87.9	Confident	153 Å²	153	100.8 Å²	100.8	58%	0.577	52%	0.517	S	S	*	.	H	α-helix	trans	-67.8	-42.9	173.9	-69.7	173.5	-143.6	-149.8	6.5	111.6	Q153 L154 E155 N160 V161	Q153-R157 VanDerWaalsContact O-CG 3.29Å; Q153-R157 WeakPolarHBondContact O-CG 3.33Å; Q153-R157 PolarHBondContact O-N 2.97Å; Q153-R157 PolarHBondContact O-NE 2.84Å; Q153-R157 VanDerWaalsContact OE1-NH2 3.1Å; L154-R157 PolarHBondContact O-N 3.46Å; L154-R157 VanDerWaalsContact O-N 3.12Å; E155-R157 VanDerWaalsContact C-N 3.32Å; E155-R157 PolarHBondContact O-N 2.81Å; R157-N160 PolarHBondContact O-N 3.26Å; R157-V161 WeakPolarHBondContact O-CG2 3.23Å; R157-V161 PolarHBondContact O-N 3.16Å
158	V	92.3	Very high	88.5	Confident	90 Å²	90	102.6 Å²	102.6	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-61.3	-52.4	176.8	171.7	0	0	0	0	110.2	L154 E155 N160 V161 T162	L154-V158 WeakPolarHBondContact O-CG2 3.46Å; L154-V158 PolarHBondContact O-N 2.92Å; E155-V158 PolarHBondContact O-N 3.32Å; V158-N160 VanDerWaalsContact C-N 3.31Å; V158-N160 PolarHBondContact O-N 2.91Å; V158-V161 PolarHBondContact O-N 3.34Å; V158-V161 VanDerWaalsContact O-N 3.16Å; V158-T162 PolarHBondContact O-N 3.01Å; V158-T162 PolarHBondContact O-OG1 2.87Å
159	L	87.9	Confident	88.8	Confident	117 Å²	117	101.9 Å²	101.9	61%	0.613	52%	0.524	S	S	*	.	H	α-helix	trans	-55.4	-43.5	177.8	-72.4	168.2	0	0	0	112.5	E155 T162 S163	E155-L159 WeakPolarHBondContact O-CB 3.39Å; E155-L159 WeakPolarHBondContact O-CG 3.23Å; E155-L159 PolarHBondContact O-N 3.24Å; L159-T162 PolarHBondContact O-N 2.74Å; L159-S163 WeakPolarHBondContact O-CB 3.48Å; L159-S163 PolarHBondContact O-N 3.45Å
160	N	92.5	Very high	89	Confident	100 Å²	100	100.9 Å²	100.9	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-49.2	176.9	-171.7	42.4	0	0	0	111.7	N156 R157 V158 T162 S163 E164	N156-N160 WeakPolarHBondContact O-CB 3.3Å; N156-N160 PolarHBondContact O-N 2.74Å; N156-N160 VanDerWaalsContact O-N 3.09Å; R157-N160 PolarHBondContact O-N 3.26Å; V158-N160 VanDerWaalsContact C-N 3.31Å; V158-N160 PolarHBondContact O-N 2.91Å; N160-T162 PolarHBondContact O-N 3Å; N160-S163 WeakPolarHBondContact O-CB 3.35Å; N160-S163 PolarHBondContact O-N 3.08Å; N160-S163 VanDerWaalsContact O-N 3.14Å; N160-S163 PolarHBondContact O-OG 3.03Å; N160-E164 PolarHBondContact O-N 2.86Å
161	V	94.3	Very high	89.5	Confident	98 Å²	98	103.4 Å²	103.4	59%	0.594	53%	0.53	S	S	*	.	H	α-helix	trans	-62.1	-41.1	177.4	171.1	0	0	0	0	111.8	R157 V158 S163 E164 M165	R157-V161 WeakPolarHBondContact O-CG2 3.23Å; R157-V161 PolarHBondContact O-N 3.16Å; V158-V161 PolarHBondContact O-N 3.34Å; V158-V161 VanDerWaalsContact O-N 3.16Å; V161-S163 VanDerWaalsContact C-N 3.31Å; V161-S163 PolarHBondContact O-N 3Å; V161-E164 PolarHBondContact O-N 2.67Å; V161-M165 WeakPolarHBondContact O-CB 3.44Å; V161-M165 PolarHBondContact O-N 2.7Å
162	T	90.9	Very high	89.9	Confident	65 Å²	65	105.6 Å²	105.6	40%	0.399	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-37.4	174.6	-54.2	0	0	0	0	111.4	V158 L159 N160 M165 M166	V158-T162 PolarHBondContact O-N 3.01Å; V158-T162 PolarHBondContact O-OG1 2.87Å; L159-T162 PolarHBondContact O-N 2.74Å; N160-T162 PolarHBondContact O-N 3Å; T162-M165 PolarHBondContact O-N 2.87Å; T162-M166 HydrophobicContact CG2-CE 4.29Å; T162-M166 WeakPolarHBondContact O-CG 3.26Å; T162-M166 PolarHBondContact O-N 2.91Å
163	S	91.3	Very high	90.2	Very high	35 Å²	35	111.1 Å²	111.1	25%	0.245	55%	0.549	C	S	.	.	H	α-helix	trans	-65.8	-40.9	176.4	84.5	0	0	0	0	112.9	L159 N160 V161 M166 R167	L159-S163 WeakPolarHBondContact O-CB 3.48Å; L159-S163 PolarHBondContact O-N 3.45Å; N160-S163 WeakPolarHBondContact O-CB 3.35Å; N160-S163 PolarHBondContact O-N 3.08Å; N160-S163 VanDerWaalsContact O-N 3.14Å; N160-S163 PolarHBondContact O-OG 3.03Å; V161-S163 VanDerWaalsContact C-N 3.31Å; V161-S163 PolarHBondContact O-N 3Å; S163-M166 PolarHBondContact O-N 3.25Å; S163-R167 WeakPolarHBondContact O-CG 3.09Å; S163-R167 PolarHBondContact O-N 3.21Å
164	E	92.1	Very high	90.2	Very high	94 Å²	94	111.7 Å²	111.7	44%	0.439	55%	0.552	S	S	.	*	H	α-helix	trans	-69.8	-36.9	174.8	-74.2	-56.3	124	0	0	112.2	N160 V161 M166 R167 L168	N160-E164 PolarHBondContact O-N 2.86Å; V161-E164 PolarHBondContact O-N 2.67Å; E164-M166 PolarHBondContact O-N 2.85Å; E164-R167 PolarHBondContact O-N 2.86Å; E164-R167 VanDerWaalsContact OE1-CD 3.22Å; E164-R167 WeakPolarHBondContact OE1-CD 3.49Å; E164-R167 IonicContact OE1-CZ 3.27Å; E164-R167 IonicContact OE1-NE 3.15Å; E164-R167 IonicContact OE1-NH1 3.18Å; E164-R167 PolarHBondContact OE1-NH1 3.48Å; E164-L168 WeakPolarHBondContact O-CB 3.29Å; E164-L168 PolarHBondContact O-N 2.67Å
165	M	89.7	Confident	90.3	Very high	139 Å²	139	112.3 Å²	112.3	69%	0.685	56%	0.555	S	S	*	*	H	α-helix	trans	-61.6	-41.4	172.7	-176.3	175.4	173.3	0	0	111.8	V161 T162 L168 A169	V161-M165 WeakPolarHBondContact O-CB 3.44Å; V161-M165 PolarHBondContact O-N 2.7Å; T162-M165 PolarHBondContact O-N 2.87Å; M165-L168 PolarHBondContact O-N 2.58Å; M165-A169 WeakPolarHBondContact O-CB 3.35Å; M165-A169 PolarHBondContact O-N 3.33Å
166	M	86.2	Confident	90.3	Very high	123 Å²	123	110.8 Å²	110.8	61%	0.606	55%	0.548	S	S	*	.	H	α-helix	trans	-66.3	-39.4	173.8	-72	-172.7	-66.4	0	0	112.4	T162 S163 E164 A169 S170	T162-M166 HydrophobicContact CG2-CE 4.29Å; T162-M166 WeakPolarHBondContact O-CG 3.26Å; T162-M166 PolarHBondContact O-N 2.91Å; S163-M166 PolarHBondContact O-N 3.25Å; E164-M166 PolarHBondContact O-N 2.85Å; M166-A169 PolarHBondContact O-N 2.63Å; M166-S170 PolarHBondContact O-N 3.08Å
167	R	92.6	Very high	90.2	Very high	147 Å²	147	108.4 Å²	108.4	56%	0.555	54%	0.543	S	S	*	.	H	α-helix	trans	-62	-42.4	173.4	-75.8	169	170.2	161.9	3.1	111.9	S163 E164 S170 R171	S163-R167 WeakPolarHBondContact O-CG 3.09Å; S163-R167 PolarHBondContact O-N 3.21Å; E164-R167 PolarHBondContact O-N 2.86Å; E164-R167 VanDerWaalsContact OE1-CD 3.22Å; E164-R167 WeakPolarHBondContact OE1-CD 3.49Å; E164-R167 IonicContact OE1-CZ 3.27Å; E164-R167 IonicContact OE1-NE 3.15Å; E164-R167 IonicContact OE1-NH1 3.18Å; E164-R167 PolarHBondContact OE1-NH1 3.48Å; R167-S170 PolarHBondContact O-N 3.25Å; R167-R171 WeakPolarHBondContact O-CG 3.44Å; R167-R171 PolarHBondContact O-N 3.03Å; R167-R171 VanDerWaalsContact O-N 3.11Å
168	L	94	Very high	89.9	Confident	120 Å²	120	108.6 Å²	108.6	63%	0.628	54%	0.544	S	S	*	.	H	α-helix	trans	-65.5	-44.8	177.1	-176.6	61.2	0	0	0	111.7	E164 M165 S170 R171 Y172	E164-L168 WeakPolarHBondContact O-CB 3.29Å; E164-L168 PolarHBondContact O-N 2.67Å; M165-L168 PolarHBondContact O-N 2.58Å; L168-S170 VanDerWaalsContact C-N 3.32Å; L168-S170 PolarHBondContact O-N 2.82Å; L168-R171 PolarHBondContact O-N 3.43Å; L168-Y172 PolarHBondContact O-N 2.91Å
169	A	89	Confident	89.7	Confident	56 Å²	56	110 Å²	110	46%	0.463	54%	0.543	S	S	.	.	H	α-helix	trans	-61.6	-38	176.4	0	0	0	0	0	112.7	M165 M166 Y172 K173	M165-A169 WeakPolarHBondContact O-CB 3.35Å; M165-A169 PolarHBondContact O-N 3.33Å; M166-A169 PolarHBondContact O-N 2.63Å; A169-Y172 PolarHBondContact O-N 3Å; A169-K173 PolarHBondContact O-N 2.91Å; A169-K173 VanDerWaalsContact O-N 3.1Å
170	S	87.9	Confident	89.6	Confident	83 Å²	83	107.4 Å²	107.4	58%	0.58	54%	0.538	S	S	*	.	H	α-helix	trans	-62.9	-47.6	174	-171.7	0	0	0	0	111.9	M166 R167 L168 Y172 K173 E174	M166-S170 PolarHBondContact O-N 3.08Å; R167-S170 PolarHBondContact O-N 3.25Å; L168-S170 VanDerWaalsContact C-N 3.32Å; L168-S170 PolarHBondContact O-N 2.82Å; S170-Y172 VanDerWaalsContact C-N 3.29Å; S170-Y172 PolarHBondContact O-N 3.17Å; S170-K173 PolarHBondContact O-N 3.45Å; S170-E174 PolarHBondContact O-N 3.15Å; S170-E174 VanDerWaalsContact O-N 3.08Å
171	R	92.5	Very high	89.4	Confident	181 Å²	181	107.3 Å²	107.3	68%	0.683	54%	0.541	S	S	*	.	H	α-helix	trans	-62.1	-34.7	174.9	-71.6	177.8	178	175.6	1.5	112.9	R167 L168 E174 L175	R167-R171 WeakPolarHBondContact O-CG 3.44Å; R167-R171 PolarHBondContact O-N 3.03Å; R167-R171 VanDerWaalsContact O-N 3.11Å; L168-R171 PolarHBondContact O-N 3.43Å; R171-E174 PolarHBondContact O-N 2.74Å; R171-L175 WeakPolarHBondContact O-CB 3.46Å; R171-L175 PolarHBondContact O-N 3.23Å
172	Y	89.9	Confident	89.1	Confident	158 Å²	158	108.5 Å²	108.5	62%	0.62	54%	0.542	S	S	*	.	H	α-helix	trans	-65.1	-45.8	176.6	-166.2	-88.9	0	0	0	111.4	L168 A169 S170 E174 L175 E176	L168-Y172 PolarHBondContact O-N 2.91Å; A169-Y172 PolarHBondContact O-N 3Å; S170-Y172 VanDerWaalsContact C-N 3.29Å; S170-Y172 PolarHBondContact O-N 3.17Å; Y172-E174 VanDerWaalsContact C-N 3.3Å; Y172-E174 PolarHBondContact O-N 2.94Å; Y172-L175 WeakPolarHBondContact O-CB 3.4Å; Y172-L175 PolarHBondContact O-N 3.43Å; Y172-L175 VanDerWaalsContact O-N 3.16Å; Y172-E176 WeakPolarHBondContact O-CB 3.19Å; Y172-E176 PolarHBondContact O-N 3.03Å
173	K	86.6	Confident	88.8	Confident	152 Å²	152	106.3 Å²	106.3	66%	0.661	53%	0.53	S	S	*	.	H	α-helix	trans	-61.2	-36.3	173.7	-75.7	-170.1	170.8	-169.5	0	113.2	A169 S170 A177	A169-K173 PolarHBondContact O-N 2.91Å; A169-K173 VanDerWaalsContact O-N 3.1Å; S170-K173 PolarHBondContact O-N 3.45Å; K173-A177 WeakPolarHBondContact O-CB 3.29Å; K173-A177 PolarHBondContact O-N 2.72Å
174	E	88.4	Confident	88.6	Confident	99 Å²	99	106.1 Å²	106.1	46%	0.463	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-40.7	174.5	-159.2	-159.1	141.6	0	0	111.8	S170 R171 Y172 A177 R178	S170-E174 PolarHBondContact O-N 3.15Å; S170-E174 VanDerWaalsContact O-N 3.08Å; R171-E174 PolarHBondContact O-N 2.74Å; Y172-E174 VanDerWaalsContact C-N 3.3Å; Y172-E174 PolarHBondContact O-N 2.94Å; E174-A177 PolarHBondContact O-N 3.47Å; E174-R178 VanDerWaalsContact O-CG 3.27Å; E174-R178 WeakPolarHBondContact O-CG 3.49Å; E174-R178 PolarHBondContact O-N 3.3Å; E174-R178 IonicContact OE1-CZ 3.7Å; E174-R178 IonicContact OE1-NE 3.47Å; E174-R178 PolarHBondContact OE1-NE 2.92Å; E174-R178 IonicContact OE1-NH2 3.64Å; E174-R178 PolarHBondContact OE1-NH2 2.86Å
175	L	91.1	Very high	88.4	Confident	111 Å²	111	105.3 Å²	105.3	58%	0.581	54%	0.536	S	S	*	.	H	α-helix	trans	-66.8	-40.9	176.2	-175.8	62.8	0	0	0	112	R171 Y172 R178 F179	R171-L175 WeakPolarHBondContact O-CB 3.46Å; R171-L175 PolarHBondContact O-N 3.23Å; Y172-L175 WeakPolarHBondContact O-CB 3.4Å; Y172-L175 PolarHBondContact O-N 3.43Å; Y172-L175 VanDerWaalsContact O-N 3.16Å; L175-R178 PolarHBondContact O-N 2.89Å; L175-F179 PolarHBondContact O-N 2.98Å
176	E	85.7	Confident	88.2	Confident	98 Å²	98	101.6 Å²	101.6	46%	0.458	52%	0.521	S	S	.	.	H	α-helix	trans	-59.5	-46.4	174	-177.1	176.4	-154.2	0	0	111.4	Y172 R178 F179 A180	Y172-E176 WeakPolarHBondContact O-CB 3.19Å; Y172-E176 PolarHBondContact O-N 3.03Å; E176-R178 PolarHBondContact O-N 2.97Å; E176-F179 PolarHBondContact O-N 3.41Å; E176-A180 PolarHBondContact O-N 2.89Å
177	A	86.5	Confident	88	Confident	58 Å²	58	97.3 Å²	97.3	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-39.8	174.7	0	0	0	0	0	112.8	K173 E174 F179 A180 T181	K173-A177 WeakPolarHBondContact O-CB 3.29Å; K173-A177 PolarHBondContact O-N 2.72Å; E174-A177 PolarHBondContact O-N 3.47Å; A177-F179 VanDerWaalsContact C-N 3.33Å; A177-A180 PolarHBondContact O-N 2.59Å; A177-T181 PolarHBondContact O-N 2.6Å; A177-T181 VanDerWaalsContact O-N 3.12Å; A177-T181 PolarHBondContact O-OG1 3.05Å
178	R	86.1	Confident	87.8	Confident	156 Å²	156	95.6 Å²	95.6	59%	0.589	50%	0.502	S	S	*	.	H	α-helix	trans	-66.1	-33.2	173.9	-71.6	165	177.7	-110.8	7.9	112.5	E174 L175 E176 T181 M182	E174-R178 VanDerWaalsContact O-CG 3.27Å; E174-R178 WeakPolarHBondContact O-CG 3.49Å; E174-R178 PolarHBondContact O-N 3.3Å; E174-R178 IonicContact OE1-CZ 3.7Å; E174-R178 IonicContact OE1-NE 3.47Å; E174-R178 PolarHBondContact OE1-NE 2.92Å; E174-R178 IonicContact OE1-NH2 3.64Å; E174-R178 PolarHBondContact OE1-NH2 2.86Å; L175-R178 PolarHBondContact O-N 2.89Å; E176-R178 PolarHBondContact O-N 2.97Å; R178-T181 PolarHBondContact O-OG1 2.93Å; R178-T181 VanDerWaalsContact O-OG1 3.08Å; R178-M182 PolarHBondContact O-N 2.94Å
179	F	88.9	Confident	87.5	Confident	119 Å²	119	95 Å²	95	52%	0.522	50%	0.496	S	S	.	.	H	α-helix	trans	-71.6	-41.9	175	-171.2	-95.6	0	0	0	111.4	L175 E176 A177 T181 M182 A183	L175-F179 PolarHBondContact O-N 2.98Å; E176-F179 PolarHBondContact O-N 3.41Å; A177-F179 VanDerWaalsContact C-N 3.33Å; F179-T181 PolarHBondContact O-N 2.81Å; F179-M182 PolarHBondContact O-N 3.45Å; F179-A183 WeakPolarHBondContact O-CB 3.49Å; F179-A183 PolarHBondContact O-N 2.85Å
180	A	85.3	Confident	87.2	Confident	63 Å²	63	93.6 Å²	93.6	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-60.7	-42.4	176.1	0	0	0	0	0	112.6	E176 A177 A183 G184	E176-A180 PolarHBondContact O-N 2.89Å; A177-A180 PolarHBondContact O-N 2.59Å; A180-A183 PolarHBondContact O-N 2.83Å; A180-G184 PolarHBondContact O-N 3.26Å
181	T	89.2	Confident	87.1	Confident	98 Å²	98	94.4 Å²	94.4	60%	0.601	48%	0.479	S	S	*	.	H	α-helix	trans	-66.8	-36.9	175.4	55.9	0	0	0	0	112.4	A177 R178 F179 G184 V185	A177-T181 PolarHBondContact O-N 2.6Å; A177-T181 VanDerWaalsContact O-N 3.12Å; A177-T181 PolarHBondContact O-OG1 3.05Å; R178-T181 PolarHBondContact O-OG1 2.93Å; R178-T181 VanDerWaalsContact O-OG1 3.08Å; F179-T181 PolarHBondContact O-N 2.81Å; T181-G184 PolarHBondContact O-N 2.95Å; T181-V185 WeakPolarHBondContact O-CG2 3.37Å; T181-V185 PolarHBondContact O-N 3.11Å; T181-V185 VanDerWaalsContact O-N 3.12Å
182	M	86.5	Confident	86.9	Confident	124 Å²	124	91 Å²	91	61%	0.611	48%	0.475	S	S	*	.	H	α-helix	trans	-65.4	-43.2	174.5	-170.7	176.1	-67.3	0	0	112.2	R178 F179 G184 V185 V186	R178-M182 PolarHBondContact O-N 2.94Å; F179-M182 PolarHBondContact O-N 3.45Å; M182-G184 VanDerWaalsContact C-N 3.33Å; M182-G184 PolarHBondContact O-N 2.87Å; M182-V185 PolarHBondContact O-N 2.91Å; M182-V186 WeakPolarHBondContact O-CG2 3.11Å; M182-V186 PolarHBondContact O-N 2.79Å
183	A	85.8	Confident	86.7	Confident	18 Å²	18	87.7 Å²	87.7	15%	0.149	47%	0.466	C	S	.	.	H	α-helix	trans	-60.1	-41.5	174.9	0	0	0	0	0	112	F179 A180 V185 V186 N187 V219	F179-A183 WeakPolarHBondContact O-CB 3.49Å; F179-A183 PolarHBondContact O-N 2.85Å; A180-A183 PolarHBondContact O-N 2.83Å; A183-V185 PolarHBondContact O-N 3.25Å; A183-V186 PolarHBondContact O-N 3.14Å; A183-N187 PolarHBondContact O-N 2.92Å; A183-V219 HydrophobicContact CB-CB 4.09Å; A183-V219 HydrophobicContact CB-CG1 4.07Å; A183-V219 HydrophobicContact CB-CG2 4.01Å
184	G	85.6	Confident	86.5	Confident	31 Å²	31	82.5 Å²	82.5	32%	0.32	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-38.8	173.9	0	0	0	0	0	113.6	A180 T181 M182 N187 N188	A180-G184 PolarHBondContact O-N 3.26Å; T181-G184 PolarHBondContact O-N 2.95Å; M182-G184 VanDerWaalsContact C-N 3.33Å; M182-G184 PolarHBondContact O-N 2.87Å; G184-N187 PolarHBondContact O-N 2.92Å; G184-N188 WeakPolarHBondContact O-CB 3.31Å; G184-N188 VanDerWaalsContact O-CG 3.28Å; G184-N188 PolarHBondContact O-N 2.75Å; G184-N188 PolarHBondContact O-ND2 3.15Å
185	V	88.5	Confident	86.3	Confident	78 Å²	78	80.3 Å²	80.3	47%	0.473	45%	0.451	S	S	.	.	H	α-helix	trans	-64.7	-43	173.9	172.1	0	0	0	0	111.3	T181 M182 A183 N188 Q189	T181-V185 WeakPolarHBondContact O-CG2 3.37Å; T181-V185 PolarHBondContact O-N 3.11Å; T181-V185 VanDerWaalsContact O-N 3.12Å; M182-V185 PolarHBondContact O-N 2.91Å; A183-V185 PolarHBondContact O-N 3.25Å; V185-N188 PolarHBondContact O-N 2.87Å; V185-Q189 WeakPolarHBondContact O-CG 3.48Å; V185-Q189 PolarHBondContact O-N 3.2Å
186	V	86.3	Confident	86	Confident	61 Å²	61	79.6 Å²	79.6	37%	0.37	45%	0.447	S	S	.	.	H	α-helix	trans	-63.9	-41.1	177.3	174.2	0	0	0	0	111.6	M182 A183 Q189 S190	M182-V186 WeakPolarHBondContact O-CG2 3.11Å; M182-V186 PolarHBondContact O-N 2.79Å; A183-V186 PolarHBondContact O-N 3.14Å; V186-Q189 PolarHBondContact O-N 3.09Å; V186-S190 PolarHBondContact O-N 2.87Å; V186-S190 PolarHBondContact O-OG 3.13Å
187	N	82.4	Confident	85.8	Confident	32 Å²	32	80.2 Å²	80.2	17%	0.171	45%	0.45	C	S	.	.	H	α-helix	trans	-65.8	-40.1	176.6	-164.9	48.7	0	0	0	112.2	A183 G184 Q189 S190 I191	A183-N187 PolarHBondContact O-N 2.92Å; G184-N187 PolarHBondContact O-N 2.92Å; N187-Q189 VanDerWaalsContact C-N 3.31Å; N187-Q189 PolarHBondContact O-N 2.94Å; N187-S190 PolarHBondContact O-N 2.97Å; N187-S190 PolarHBondContact O-OG 2.85Å; N187-I191 WeakPolarHBondContact O-CD1 3.32Å; N187-I191 VanDerWaalsContact O-CG1 3.29Å; N187-I191 WeakPolarHBondContact O-CG1 3.49Å; N187-I191 PolarHBondContact O-N 2.9Å; N187-I191 VanDerWaalsContact O-N 3.15Å
188	N	87.8	Confident	85.4	Confident	111 Å²	111	82.5 Å²	82.5	59%	0.594	45%	0.451	S	S	*	.	H	α-helix	trans	-65	-35.3	173.4	-72.4	-27.3	0	0	0	112.2	G184 V185 L192	G184-N188 WeakPolarHBondContact O-CB 3.31Å; G184-N188 VanDerWaalsContact O-CG 3.28Å; G184-N188 PolarHBondContact O-N 2.75Å; G184-N188 PolarHBondContact O-ND2 3.15Å; V185-N188 PolarHBondContact O-N 2.87Å; N188-L192 WeakPolarHBondContact O-CB 3.43Å; N188-L192 PolarHBondContact O-N 2.87Å; N188-L192 VanDerWaalsContact O-N 3.12Å
189	Q	86.4	Confident	85.2	Confident	107 Å²	107	81 Å²	81	50%	0.5	45%	0.45	S	S	.	.	H	α-helix	trans	-69.8	-41.3	175.9	-75.6	175.2	-9	0	0	112.5	V185 V186 N187 L192 I193	V185-Q189 WeakPolarHBondContact O-CG 3.48Å; V185-Q189 PolarHBondContact O-N 3.2Å; V186-Q189 PolarHBondContact O-N 3.09Å; N187-Q189 VanDerWaalsContact C-N 3.31Å; N187-Q189 PolarHBondContact O-N 2.94Å; Q189-L192 PolarHBondContact O-N 2.97Å; Q189-I193 WeakPolarHBondContact O-CD1 3.43Å; Q189-I193 VanDerWaalsContact O-CG1 3.26Å; Q189-I193 WeakPolarHBondContact O-CG1 3.22Å; Q189-I193 PolarHBondContact O-N 3.34Å
190	S	83.3	Confident	84.7	Confident	28 Å²	28	78.3 Å²	78.3	20%	0.196	45%	0.446	C	S	.	.	H	α-helix	trans	-65.5	-38.5	177.1	59.6	0	0	0	0	112.3	V186 N187 I193 A194	V186-S190 PolarHBondContact O-N 2.87Å; V186-S190 PolarHBondContact O-OG 3.13Å; N187-S190 PolarHBondContact O-N 2.97Å; N187-S190 PolarHBondContact O-OG 2.85Å; S190-I193 PolarHBondContact O-N 3.35Å; S190-A194 WeakPolarHBondContact O-CB 3.33Å; S190-A194 PolarHBondContact O-N 2.87Å
191	I	86.8	Confident	84.1	Confident	99 Å²	99	80.7 Å²	80.7	51%	0.508	45%	0.447	S	S	.	.	H	α-helix	trans	-61.7	-44.3	172.8	-66.9	165.1	0	0	0	111	N187 A194 A195	N187-I191 WeakPolarHBondContact O-CD1 3.32Å; N187-I191 VanDerWaalsContact O-CG1 3.29Å; N187-I191 WeakPolarHBondContact O-CG1 3.49Å; N187-I191 PolarHBondContact O-N 2.9Å; N187-I191 VanDerWaalsContact O-N 3.15Å; I191-A194 PolarHBondContact O-N 2.76Å; I191-A195 PolarHBondContact O-N 2.92Å; I191-A195 VanDerWaalsContact O-N 3.07Å
192	L	87.3	Confident	83.4	Confident	111 Å²	111	84.7 Å²	84.7	58%	0.581	45%	0.452	S	S	*	.	H	α-helix	trans	-63.8	-42.1	177.9	-167.6	78.3	0	0	0	111.9	N188 Q189 A195 L196	N188-L192 WeakPolarHBondContact O-CB 3.43Å; N188-L192 PolarHBondContact O-N 2.87Å; N188-L192 VanDerWaalsContact O-N 3.12Å; Q189-L192 PolarHBondContact O-N 2.97Å; L192-A195 PolarHBondContact O-N 3.28Å; L192-L196 HydrophobicContact CG-CD1 4.19Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.4Å
193	I	85.9	Confident	82.6	Confident	87 Å²	87	83.9 Å²	83.9	45%	0.446	45%	0.454	S	S	.	.	H	α-helix	trans	-61.5	-49.7	176.9	-70.2	162.9	0	0	0	110.3	Q189 S190 A195 L196 E197	Q189-I193 WeakPolarHBondContact O-CD1 3.43Å; Q189-I193 VanDerWaalsContact O-CG1 3.26Å; Q189-I193 WeakPolarHBondContact O-CG1 3.22Å; Q189-I193 PolarHBondContact O-N 3.34Å; S190-I193 PolarHBondContact O-N 3.35Å; I193-A195 VanDerWaalsContact C-N 3.31Å; I193-A195 PolarHBondContact O-N 2.82Å; I193-L196 PolarHBondContact O-N 3.44Å; I193-L196 VanDerWaalsContact O-N 3.11Å; I193-E197 HydrophobicContact CG2-CG 4.34Å; I193-E197 WeakPolarHBondContact O-CG 3.34Å; I193-E197 PolarHBondContact O-N 2.89Å
194	A	83.1	Confident	81.5	Confident	44 Å²	44	89.5 Å²	89.5	36%	0.364	48%	0.48	S	S	.	.	H	α-helix	trans	-59.2	-39.5	178.8	0	0	0	0	0	112.8	S190 I191 E197 E198 L215	S190-A194 WeakPolarHBondContact O-CB 3.33Å; S190-A194 PolarHBondContact O-N 2.87Å; I191-A194 PolarHBondContact O-N 2.76Å; A194-E197 PolarHBondContact O-N 2.93Å; A194-E198 PolarHBondContact O-N 3.47Å; A194-L215 HydrophobicContact CB-CD1 4.42Å
195	A	83.9	Confident	80.1	Confident	53 Å²	53	90.9 Å²	90.9	44%	0.438	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-38.3	175.9	0	0	0	0	0	112.7	I191 L192 I193 Q199	I191-A195 PolarHBondContact O-N 2.92Å; I191-A195 VanDerWaalsContact O-N 3.07Å; L192-A195 PolarHBondContact O-N 3.28Å; I193-A195 VanDerWaalsContact C-N 3.31Å; I193-A195 PolarHBondContact O-N 2.82Å; A195-Q199 WeakPolarHBondContact O-CB 3.22Å; A195-Q199 PolarHBondContact O-N 3.22Å
196	L	84.5	Confident	78.8	Confident	96 Å²	96	97.6 Å²	97.6	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-70.3	-37.9	175.6	-71.3	168.8	0	0	0	112.1	L192 I193 Q199 C200	L192-L196 HydrophobicContact CG-CD1 4.19Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.4Å; I193-L196 PolarHBondContact O-N 3.44Å; I193-L196 VanDerWaalsContact O-N 3.11Å; L196-Q199 PolarHBondContact O-N 3.09Å; L196-C200 VanDerWaalsContact O-CB 3.26Å; L196-C200 WeakPolarHBondContact O-CB 3.46Å; L196-C200 PolarHBondContact O-N 3.16Å
197	E	81.2	Confident	77	Confident	110 Å²	110	99.2 Å²	99.2	51%	0.514	53%	0.526	S	S	.	.	H	α-helix	trans	-61.6	-46.2	172.2	-73.9	179	163.7	0	0	111.3	I193 A194 Q199 C200 M201	I193-E197 HydrophobicContact CG2-CG 4.34Å; I193-E197 WeakPolarHBondContact O-CG 3.34Å; I193-E197 PolarHBondContact O-N 2.89Å; A194-E197 PolarHBondContact O-N 2.93Å; E197-Q199 PolarHBondContact O-N 3.28Å; E197-C200 WeakPolarHBondContact O-CB 3.37Å; E197-C200 PolarHBondContact O-N 3.28Å; E197-M201 WeakPolarHBondContact O-CG 3.35Å; E197-M201 PolarHBondContact O-N 3.08Å
198	E	79.7	Confident	75.6	Confident	106 Å²	106	105.8 Å²	105.8	50%	0.495	56%	0.555	S	S	.	*	H	α-helix	trans	-62.7	-42.9	176	-160	-164.5	175.4	0	0	111.7	A194 C200 M201 R202	A194-E198 PolarHBondContact O-N 3.47Å; E198-C200 VanDerWaalsContact C-N 3.31Å; E198-C200 PolarHBondContact O-N 3.03Å; E198-M201 PolarHBondContact O-N 3.11Å; E198-R202 VanDerWaalsContact CD-NH2 3.34Å; E198-R202 VanDerWaalsContact O-CG 3.29Å; E198-R202 WeakPolarHBondContact O-CG 3.47Å; E198-R202 PolarHBondContact O-N 2.98Å; E198-R202 IonicContact OE1-CZ 3.56Å; E198-R202 VanDerWaalsContact OE1-CZ 3.27Å; E198-R202 IonicContact OE1-NE 2.92Å; E198-R202 PolarHBondContact OE1-NE 2.97Å; E198-R202 VanDerWaalsContact OE1-NE 3.15Å; E198-R202 IonicContact OE1-NH2 2.65Å; E198-R202 PolarHBondContact OE1-NH2 2.97Å; E198-R202 IonicContact OE2-NH2 3.55Å
199	Q	81.3	Confident	74.1	Confident	125 Å²	125	106.9 Å²	106.9	58%	0.584	56%	0.561	S	S	*	*	H	α-helix	trans	-63.5	-37	176.9	-171.5	172.1	-0.8	0	0	112.1	A195 L196 E197 R202 T203	A195-Q199 WeakPolarHBondContact O-CB 3.22Å; A195-Q199 PolarHBondContact O-N 3.22Å; L196-Q199 PolarHBondContact O-N 3.09Å; E197-Q199 PolarHBondContact O-N 3.28Å; Q199-R202 PolarHBondContact O-N 3.44Å; Q199-T203 PolarHBondContact O-N 3.02Å; Q199-T203 PolarHBondContact O-OG1 3.03Å
200	C	78	Confident	72.9	Confident	63 Å²	63	106.6 Å²	106.6	43%	0.426	57%	0.568	S	S	.	*	H	α-helix	trans	-66.7	-44.4	175.3	-166.1	0	0	0	0	112	L196 E197 E198 R202 T203 L204	L196-C200 VanDerWaalsContact O-CB 3.26Å; L196-C200 WeakPolarHBondContact O-CB 3.46Å; L196-C200 PolarHBondContact O-N 3.16Å; E197-C200 WeakPolarHBondContact O-CB 3.37Å; E197-C200 PolarHBondContact O-N 3.28Å; E198-C200 VanDerWaalsContact C-N 3.31Å; E198-C200 PolarHBondContact O-N 3.03Å; C200-R202 VanDerWaalsContact C-N 3.26Å; C200-R202 PolarHBondContact O-N 3.15Å; C200-T203 PolarHBondContact O-N 2.83Å; C200-T203 PolarHBondContact O-OG1 3.13Å; C200-T203 VanDerWaalsContact O-OG1 3.09Å; C200-L204 PolarHBondContact O-N 2.99Å
201	M	72.7	Confident	71.6	Confident	112 Å²	112	111.3 Å²	111.3	55%	0.552	60%	0.598	S	S	*	*	H	α-helix	trans	-63.2	-31.2	175.2	-72.9	-64.3	-72.4	0	0	112.7	E197 E198	E197-M201 WeakPolarHBondContact O-CG 3.35Å; E197-M201 PolarHBondContact O-N 3.08Å; E198-M201 PolarHBondContact O-N 3.11Å
202	R	73.8	Confident	70.4	Confident	183 Å²	183	112.7 Å²	112.7	69%	0.691	61%	0.611	S	S	*	*	H	α-helix	trans	-73.7	-29.6	174.6	-71.4	171.4	-179.4	-156.7	6.1	113.4	E198 Q199 C200	E198-R202 VanDerWaalsContact CD-NH2 3.34Å; E198-R202 VanDerWaalsContact O-CG 3.29Å; E198-R202 WeakPolarHBondContact O-CG 3.47Å; E198-R202 PolarHBondContact O-N 2.98Å; E198-R202 IonicContact OE1-CZ 3.56Å; E198-R202 VanDerWaalsContact OE1-CZ 3.27Å; E198-R202 IonicContact OE1-NE 2.92Å; E198-R202 PolarHBondContact OE1-NE 2.97Å; E198-R202 VanDerWaalsContact OE1-NE 3.15Å; E198-R202 IonicContact OE1-NH2 2.65Å; E198-R202 PolarHBondContact OE1-NH2 2.97Å; E198-R202 IonicContact OE2-NH2 3.55Å; Q199-R202 PolarHBondContact O-N 3.44Å; C200-R202 VanDerWaalsContact C-N 3.26Å; C200-R202 PolarHBondContact O-N 3.15Å
203	T	70.8	Confident	68.9	Low	107 Å²	107	112.3 Å²	112.3	66%	0.656	62%	0.615	S	S	*	*	H	α-helix	trans	-90	-28.8	-180	52.1	0	0	0	0	114.2	Q199 C200	Q199-T203 PolarHBondContact O-N 3.02Å; Q199-T203 PolarHBondContact O-OG1 3.03Å; C200-T203 PolarHBondContact O-N 2.83Å; C200-T203 PolarHBondContact O-OG1 3.13Å; C200-T203 VanDerWaalsContact O-OG1 3.09Å
204	L	63.4	Low	67.4	Low	135 Å²	135	113.8 Å²	113.8	71%	0.707	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	2.2	-176.3	-79.4	168.4	0	0	0	115.8	C200	C200-L204 PolarHBondContact O-N 2.99Å
205	G	55.7	Low	65.9	Low	61 Å²	61	117 Å²	117	63%	0.629	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.5	62	161.4	0	0	0	0	0	116.4
206	R	61.1	Low	64.6	Low	218 Å²	218	120.3 Å²	120.3	82%	0.823	66%	0.655	S	S	*	*			trans	43.9	71.9	161.1	-162	-172	-175	-175	0.4	115.8
207	S	47.7	Very low	62.8	Low	95 Å²	95	120.2 Å²	120.2	66%	0.664	65%	0.652	S	S	*	*			trans	-93.5	140.9	151.1	-166.4	0	0	0	0	109.3	L209	S207-L209 PolarHBondContact O-N 2.76Å
208	E	53.4	Low	61.6	Low	170 Å²	170	120.3 Å²	120.3	79%	0.794	66%	0.66	S	S	*	*			trans	-78.4	112.7	-179.7	-66.8	-173.6	140.9	0	0	110.7
209	L	57.4	Low	60.4	Low	134 Å²	134	117.5 Å²	117.5	70%	0.702	65%	0.65	S	S	*	*			trans	-118.5	151.4	167	-75.8	168.8	0	0	0	109.3	S207	S207-L209 PolarHBondContact O-N 2.76Å
210	P	59.5	Low	58.8	Low	101 Å²	101	116 Å²	116	66%	0.656	65%	0.651	S	S	*	*			trans	-60.1	151.3	-176.2	-22.5	33.8	0	0	0	112.3	V212	P210-V212 PolarHBondContact O-N 2.94Å
211	P	57.2	Low	57.4	Low	128 Å²	128	119.3 Å²	119.3	83%	0.831	66%	0.66	S	S	*	*			trans	-62.9	107.3	175.5	26.8	-34	0	0	0	110
212	V	60.5	Low	56.4	Low	128 Å²	128	120.5 Å²	120.5	78%	0.776	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-62.5	129.9	169.7	-176.1	0	0	0	0	107.3	P210	P210-V212 PolarHBondContact O-N 2.94Å
213	P	56.5	Low	55	Low	103 Å²	103	117 Å²	117	67%	0.669	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.1	145.2	177.4	26	-34.3	0	0	0	110	L215	P213-L215 PolarHBondContact O-N 2.84Å
214	P	55.3	Low	53.5	Low	117 Å²	117	117.1 Å²	117.1	76%	0.76	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-58.4	138.5	-177.1	24.8	-34.5	0	0	0	110.9	V216	P214-V216 PolarHBondContact O-N 3.04Å
215	L	51.6	Low	52.7	Low	111 Å²	111	118.5 Å²	118.5	58%	0.581	67%	0.673	S	S	*	*			trans	-57.9	106.4	175.6	-74.7	168.2	0	0	0	109.6	A194 P213	A194-L215 HydrophobicContact CB-CD1 4.42Å; P213-L215 PolarHBondContact O-N 2.84Å
216	V	55.4	Low	51.8	Low	123 Å²	123	120.3 Å²	120.3	75%	0.745	67%	0.668	S	S	*	*			trans	-62.9	138	178.4	-179.5	0	0	0	0	109.1	P214 V218	P214-V216 PolarHBondContact O-N 3.04Å; V216-V218 PolarHBondContact O-N 3.05Å
217	Q	47.2	Very low	50.8	Low	94 Å²	94	117.1 Å²	117.1	44%	0.439	67%	0.667	S	S	.	*			trans	-53.5	110.4	170.6	-80	-170.9	-34.9	0	0	109.3	V219 E221	Q217-V219 PolarHBondContact O-N 2.81Å; Q217-E221 PolarHBondContact NE2-OE2 2.94Å
218	V	55.4	Low	50.2	Low	112 Å²	112	121.4 Å²	121.4	68%	0.679	67%	0.669	S	S	*	*	S	Bend	trans	-67.3	-21.8	-172.1	-173.7	0	0	0	0	111.8	V216	V216-V218 PolarHBondContact O-N 3.05Å
219	V	53.9	Low	49.4	Very low	47 Å²	47	123 Å²	123	29%	0.285	67%	0.673	S	S	.	*	S	Bend	trans	-135.3	132.7	171.1	-175.8	0	0	0	0	108	A183 Q217 E221	A183-V219 HydrophobicContact CB-CB 4.09Å; A183-V219 HydrophobicContact CB-CG1 4.07Å; A183-V219 HydrophobicContact CB-CG2 4.01Å; Q217-V219 PolarHBondContact O-N 2.81Å; V219-E221 PolarHBondContact O-N 2.81Å
220	P	48.4	Very low	48.3	Very low	93 Å²	93	120.6 Å²	120.6	60%	0.604	67%	0.665	S	S	*	*			trans	-60.4	129.4	173.7	-23.6	34.3	0	0	0	111.7	N222	P220-N222 PolarHBondContact O-N 3.28Å; P220-N222 VanDerWaalsContact O-N 3.08Å
221	E	49.3	Very low	47.4	Very low	133 Å²	133	122.2 Å²	122.2	62%	0.621	67%	0.668	S	S	*	*	S	Bend	trans	-68.5	-9.3	-174.6	-161.3	157	-148	0	0	113.9	Q217 V219	Q217-E221 PolarHBondContact NE2-OE2 2.94Å; V219-E221 PolarHBondContact O-N 2.81Å
222	N	50.9	Low	46.3	Very low	137 Å²	137	123.5 Å²	123.5	73%	0.733	66%	0.662	S	S	*	*			trans	-132	103.8	165.8	-72.1	-92.6	0	0	0	109.9	P220	P220-N222 PolarHBondContact O-N 3.28Å; P220-N222 VanDerWaalsContact O-N 3.08Å
223	I	45.2	Very low	45.3	Very low	109 Å²	109	125.7 Å²	125.7	56%	0.559	67%	0.668	S	S	*	*			trans	-65.1	129.3	149.4	-60.4	174.8	0	0	0	105.8	L225	I223-L225 PolarHBondContact O-N 3.21Å; I223-L225 VanDerWaalsContact O-N 3.15Å
224	P	39.6	Very low	44.7	Very low	110 Å²	110	126.4 Å²	126.4	71%	0.714	67%	0.67	S	S	*	*			trans	-58.4	123.2	178.1	-24.7	34.3	0	0	0	110.9	D226	P224-D226 PolarHBondContact O-N 3.14Å
225	L	46.4	Very low	43.8	Very low	164 Å²	164	130.9 Å²	130.9	86%	0.859	67%	0.672	S	S	*	*			trans	-70	64.6	161.2	-83.6	166.3	0	0	0	109.1	I223 N227	I223-L225 PolarHBondContact O-N 3.21Å; I223-L225 VanDerWaalsContact O-N 3.15Å; L225-N227 PolarHBondContact O-N 2.97Å
226	D	35.2	Very low	42.9	Very low	99 Å²	99	132.9 Å²	132.9	53%	0.529	68%	0.683	S	S	.	*			trans	-70.8	97	171.3	-166.9	-1.7	0	0	0	107.8	P224 R228	P224-D226 PolarHBondContact O-N 3.14Å; D226-R228 PolarHBondContact O-N 2.88Å; D226-R228 VanDerWaalsContact OD1-CB 3.29Å; D226-R228 WeakPolarHBondContact OD1-CB 3.45Å; D226-R228 WeakPolarHBondContact OD1-CD 3.37Å; D226-R228 WeakPolarHBondContact OD1-CG 3.48Å; D226-R228 PolarHBondContact OD1-N 3.39Å; D226-R228 WeakPolarHBondContact OD2-CD 3.22Å
227	N	40.2	Very low	42	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	69%	0.689	S	S	*	*			trans	-63.7	12	175.7	-90.9	-37.9	0	0	0	113.3	L225 F229	L225-N227 PolarHBondContact O-N 2.97Å; N227-F229 PolarHBondContact O-N 3.44Å
228	R	36.6	Very low	41.6	Very low	186 Å²	186	141.7 Å²	141.7	70%	0.702	71%	0.711	S	S	*	*			trans	-71.1	46.1	163	-70.1	177.1	178.2	-170.3	1.1	114.4	D226 T230	D226-R228 PolarHBondContact O-N 2.88Å; D226-R228 VanDerWaalsContact OD1-CB 3.29Å; D226-R228 WeakPolarHBondContact OD1-CB 3.45Å; D226-R228 WeakPolarHBondContact OD1-CD 3.37Å; D226-R228 WeakPolarHBondContact OD1-CG 3.48Å; D226-R228 PolarHBondContact OD1-N 3.39Å; D226-R228 WeakPolarHBondContact OD2-CD 3.22Å; R228-T230 HydrophobicContact CG-CG2 4.36Å; R228-T230 PolarHBondContact O-N 2.98Å
229	F	36.4	Very low	40.5	Very low	203 Å²	203	140.4 Å²	140.4	89%	0.89	71%	0.713	S	S	*	*			trans	-80.2	59.8	130.2	-85.4	-79	0	0	0	109.1	N227	N227-F229 PolarHBondContact O-N 3.44Å
230	T	33.8	Very low	39.4	Very low	84 Å²	84	148.6 Å²	148.6	52%	0.515	75%	0.745	S	S	.	*			trans	-62	140.4	163.8	37.6	0	0	0	0	108.9	R228 E232	R228-T230 HydrophobicContact CG-CG2 4.36Å; R228-T230 PolarHBondContact O-N 2.98Å; T230-E232 VanDerWaalsContact C-N 3.33Å; T230-E232 WeakPolarHBondContact O-CG 3.39Å; T230-E232 PolarHBondContact O-N 2.98Å
231	N	41.1	Very low	38.7	Very low	135 Å²	135	151.7 Å²	151.7	72%	0.722	76%	0.755	S	S	*	*			trans	-65	84.1	-178.9	-66.4	-47.5	0	0	0	112.3	I233 V234	N231-I233 PolarHBondContact O-N 3.35Å; N231-V234 HydrophobicContact CB-CG2 4.3Å; N231-V234 PolarHBondContact O-N 3Å
232	E	32.8	Very low	37.8	Very low	154 Å²	154	156.4 Å²	156.4	72%	0.72	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	4.5	-177.2	-65.3	-135.2	121.1	0	0	114.6	T230 V234	T230-E232 VanDerWaalsContact C-N 3.33Å; T230-E232 WeakPolarHBondContact O-CG 3.39Å; T230-E232 PolarHBondContact O-N 2.98Å; E232-V234 PolarHBondContact O-N 3.3Å
233	I	41.1	Very low	36.8	Very low	174 Å²	174	156.5 Å²	156.5	89%	0.892	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-15.2	165	-63.3	178.4	0	0	0	111.4	N231	N231-I233 PolarHBondContact O-N 3.35Å
234	V	44.1	Very low	36.1	Very low	119 Å²	119	157 Å²	157	72%	0.721	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-6.5	-171.6	-170.7	0	0	0	0	114.3	N231 E232	N231-V234 HydrophobicContact CB-CG2 4.3Å; N231-V234 PolarHBondContact O-N 3Å; E232-V234 PolarHBondContact O-N 3.3Å
235	R	36	Very low	36	Very low	210 Å²	210	162.9 Å²	162.9	79%	0.792	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-25.6	-172.5	-90.8	-172.9	171.6	-170.3	-2.5	118.2	N237	R235-N237 VanDerWaalsContact C-N 3.27Å; R235-N237 PolarHBondContact O-N 2.84Å
236	N	31.9	Very low	35.2	Very low	153 Å²	153	164.1 Å²	164.1	82%	0.818	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	54	-178.6	-85.2	-8.6	0	0	0	114.3
237	N	35.8	Very low	35	Very low	161 Å²	161	168.4 Å²	168.4	86%	0.861	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.1	22.3	168.6	-116.8	-14.7	0	0	0	113.5	R235	R235-N237 VanDerWaalsContact C-N 3.27Å; R235-N237 PolarHBondContact O-N 2.84Å
238	R	38.9	Very low	34.6	Very low	241 Å²	241	165.4 Å²	165.4	91%	0.909	81%	0.806	S	S	*	*	S	Bend	trans	-136.7	51.5	175	-74.4	-169.2	171.7	177.9	-1.7	112.9
239	A	33.3	Very low	34.6	Very low	86 Å²	86	162.6 Å²	162.6	71%	0.711	81%	0.812	S	S	*	*	S	Bend	trans	-135.3	12.9	173.8	0	0	0	0	0	114.5
240	F	30.1	Very low	34.6	Very low	219 Å²	219	159.5 Å²	159.5	96%	0.961	81%	0.809	S	S	*	*			trans	-119.3	104.3	162.8	-75.4	-75.8	0	0	0	108.2
241	L	33.8	Very low	34.7	Very low	157 Å²	157	160.3 Å²	160.3	82%	0.822	83%	0.825	S	S	*	*			trans	-144	126.2	-176.2	-148	168.8	0	0	0	108.5
242	R	30.2	Very low	34.6	Very low	233 Å²	233	164.6 Å²	164.6	88%	0.879	83%	0.831	S	S	*	*			trans	90.5	128.8	-161.6	-63.8	-176.7	168.9	-167.1	-4.8	113.4
243	D	29.7	Very low	35	Very low	139 Å²	139	163.1 Å²	163.1	74%	0.743	83%	0.834	S	S	*	*			cis	-148.5	137.7	-5.9	-157.1	-0.8	0	0	0	113
244	S	31.4	Very low	35.1	Very low	118 Å²	118	164 Å²	164	83%	0.825	83%	0.832	S	S	*	*			trans	170.2	113.6	159.7	-81.3	0	0	0	0	109.1
245	R	36.7	Very low	34.8	Very low	234 Å²	234	165.8 Å²	165.8	88%	0.883	84%	0.837	S	S	*	*			trans	-74.6	134.2	168	-72.6	172.7	167.8	169.3	-7.4	110.3
246	M	31.2	Very low	35.1	Very low	191 Å²	191	161 Å²	161	94%	0.941	83%	0.834	S	S	*	*			trans	-145.8	134	140.9	-117.3	162.3	66.8	0	0	108.4
247	E	30.5	Very low	35.5	Very low	188 Å²	188	159.1 Å²	159.1	88%	0.879	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-82.6	135.2	-166.8	-66.6	171.1	125.1	0	0	111.4
248	A	31.7	Very low	35.5	Very low	89 Å²	89	156.6 Å²	156.6	74%	0.736	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-80.6	136	167.3	0	0	0	0	0	109.4
249	P	37	Very low	35.6	Very low	127 Å²	127	150.5 Å²	150.5	83%	0.825	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-66	136.1	178.9	27.2	-33.9	0	0	0	111	A251	P249-A251 PolarHBondContact O-N 2.8Å
250	T	36.8	Very low	36	Very low	137 Å²	137	154.9 Å²	154.9	84%	0.84	82%	0.82	S	S	*	*			trans	-68.2	115.2	-177.8	21.3	0	0	0	0	112.2
251	A	34.1	Very low	36.4	Very low	101 Å²	101	147 Å²	147	84%	0.835	80%	0.8	S	S	*	*			trans	-62.5	139.8	162.5	0	0	0	0	0	110	P249	P249-A251 PolarHBondContact O-N 2.8Å
252	R	39.3	Very low	36.6	Very low	226 Å²	226	143.2 Å²	143.2	85%	0.853	78%	0.784	S	S	*	*			trans	-89.5	146.9	-178.7	-63.4	179.3	-178.6	177.9	-0	110.3	F254	R252-F254 PolarHBondContact O-N 3.14Å
253	P	41.6	Very low	37.3	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	78%	0.78	S	S	*	*	S	Bend	trans	-82.6	56.6	-173.7	35.5	-38.1	0	0	0	113.2
254	F	43.9	Very low	37.9	Very low	194 Å²	194	135.7 Å²	135.7	85%	0.851	76%	0.762	S	S	*	*			trans	-149.5	65.8	174.5	-81.9	-68.2	0	0	0	112.3	R252	R252-F254 PolarHBondContact O-N 3.14Å
255	D	36.6	Very low	38.6	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	76%	0.759	S	S	*	*			trans	-143.4	136.2	159.9	-89.3	-53.8	0	0	0	108.8
256	P	43.3	Very low	39.5	Very low	111 Å²	111	128.8 Å²	128.8	72%	0.721	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-72.3	152	174.3	31.1	-34.1	0	0	0	111
257	P	38.9	Very low	40.9	Very low	112 Å²	112	121.8 Å²	121.8	73%	0.727	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-64.6	148.1	178.8	27.9	-34.9	0	0	0	111.6
258	P	37.6	Very low	42.9	Very low	109 Å²	109	116.4 Å²	116.4	71%	0.708	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-61.2	146.4	174.8	27.2	-34.9	0	0	0	110.7	Q260	P258-Q260 PolarHBondContact O-N 3.3Å
259	P	40.8	Very low	45.6	Very low	113 Å²	113	113.1 Å²	113.1	73%	0.734	67%	0.669	S	S	*	*			trans	-64.5	110	-174.2	25.7	-34	0	0	0	110.9	G261	P259-G261 PolarHBondContact O-N 2.93Å
260	Q	40.2	Very low	48.2	Very low	177 Å²	177	109.2 Å²	109.2	83%	0.827	64%	0.639	S	S	*	*			trans	-64.7	123.9	167.3	-65.7	-178.6	-7.5	0	0	108.1	P258 T262	P258-Q260 PolarHBondContact O-N 3.3Å; Q260-T262 PolarHBondContact O-N 3.45Å; Q260-T262 VanDerWaalsContact O-N 3.12Å
261	G	39	Very low	51	Low	53 Å²	53	102.7 Å²	102.7	55%	0.546	60%	0.599	S	S	.	*			trans	-58.5	117.3	-179.2	0	0	0	0	0	110.6	P259 I263	P259-G261 PolarHBondContact O-N 2.93Å; G261-I263 PolarHBondContact O-N 2.83Å
262	T	38.4	Very low	53.9	Low	79 Å²	79	97.9 Å²	97.9	49%	0.485	56%	0.559	S	S	.	*			trans	-75.2	89	-175.5	50.7	0	0	0	0	110.4	Q260 T264	Q260-T262 PolarHBondContact O-N 3.45Å; Q260-T262 VanDerWaalsContact O-N 3.12Å; T262-T264 PolarHBondContact O-N 2.99Å
263	I	44	Very low	56.5	Low	155 Å²	155	89.4 Å²	89.4	80%	0.795	53%	0.527	S	S	*	.			trans	-73.6	82.4	164.2	-55.1	174.8	0	0	0	107	G261	G261-I263 PolarHBondContact O-N 2.83Å
264	T	42.1	Very low	59	Low	59 Å²	59	87.3 Å²	87.3	36%	0.362	51%	0.507	S	S	.	.			trans	-79.8	160.9	175.6	35.4	0	0	0	0	111.6	T262 D266 H280	T262-T264 PolarHBondContact O-N 2.99Å; T264-D266 PolarHBondContact O-N 2.88Å; T264-H280 PolarHBondContact OG1-NE2 2.75Å
265	S	47.7	Very low	61.3	Low	111 Å²	111	78 Å²	78	78%	0.776	47%	0.467	S	S	*	.	S	Bend	trans	-69.7	-14.5	-175.4	40.1	0	0	0	0	115.1	G267	S265-G267 PolarHBondContact O-N 2.91Å
266	D	54.7	Low	64	Low	96 Å²	96	73.7 Å²	73.7	51%	0.513	44%	0.438	S	S	.	.	S	Bend	trans	-93.7	40.7	-151.6	-56	-16.1	0	0	0	113	T264 F269	T264-D266 PolarHBondContact O-N 2.88Å; D266-F269 HydrophobicContact CB-CZ 4.4Å
267	G	59.7	Low	66.4	Low	44 Å²	44	77.4 Å²	77.4	45%	0.454	44%	0.438	S	S	.	.			trans	77.2	170.9	175	0	0	0	0	0	115.1	S265	S265-G267 PolarHBondContact O-N 2.91Å
268	P	73.7	Confident	68.8	Low	75 Å²	75	74.8 Å²	74.8	49%	0.487	43%	0.426	S	S	.	.			trans	-84.7	114.4	170.4	33.8	-30.9	0	0	0	109.9	K289 L296	P268-K289 HydrophobicContact CB-CB 3.67Å; P268-K289 HydrophobicContact CG-CB 4.02Å; P268-K289 HydrophobicContact CG-CD 4.34Å; P268-L296 HydrophobicContact CB-CD2 3.88Å
269	F	89.1	Confident	71.4	Confident	19 Å²	19	72.3 Å²	72.3	8%	0.083	42%	0.42	C	S	.	.	B	Isolated β-bridge	trans	-70.8	151.2	177.4	-51.3	-78	0	0	0	111.3	D266 Q274 V275 A278 H280 L288 K289	D266-F269 HydrophobicContact CB-CZ 4.4Å; F269-Q274 HydrophobicContact CB-CB 4.1Å; F269-Q274 HydrophobicContact CD1-CB 4.26Å; F269-V275 HydrophobicContact CB-CG2 3.66Å; F269-V275 HydrophobicContact CD2-CB 4.34Å; F269-V275 HydrophobicContact CD2-CG2 3.51Å; F269-V275 HydrophobicContact CE2-CG2 4.3Å; F269-V275 HydrophobicContact CG-CB 4.34Å; F269-V275 HydrophobicContact CG-CG2 3.63Å; F269-A278 HydrophobicContact CD1-CB 4.48Å; F269-A278 HydrophobicContact CE1-CB 3.52Å; F269-A278 HydrophobicContact CZ-CB 4.04Å; F269-H280 AromaticContact CE2-CD2 3.97Å; F269-H280 AromaticContact CZ-CD2 3.75Å; F269-H280 AromaticContact CZ-NE2 3.68Å; F269-L288 HydrophobicContact CB-CD2 3.98Å; F269-L288 CarbonylContact O-C 3.4Å; F269-L288 WeakPolarHBondContact O-CA 3.36Å; F269-L288 WeakPolarHBondContact O-CB 3.41Å; F269-L288 WeakPolarHBondContact O-CD2 3.38Å; F269-K289 PolarHBondContact O-N 2.89Å
270	K	91.5	Very high	73.7	Confident	45 Å²	45	68.6 Å²	68.6	20%	0.196	39%	0.393	C	S	.	.	S	Bend	trans	-79.6	-28.7	177.7	88.6	-178.5	-168.5	159	0	114.2	Q274 K289 D291 Q354	K270-Q274 HydrophobicContact CG-CG 4.21Å; K270-K289 WeakPolarHBondContact CA-O 3.41Å; K270-D291 WeakPolarHBondContact CD-OD2 3.48Å; K270-D291 IonicContact NZ-OD2 2.81Å; K270-D291 PolarHBondContact NZ-OD2 3.5Å; K270-Q354 HydrophobicContact CD-CG 4.42Å; K270-Q354 PolarHBondContact NZ-O 3.14Å; K270-Q354 PolarHBondContact O-NE2 2.95Å
271	D	94.2	Very high	76.1	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	38%	0.382	C	S	.	.	S	Bend	trans	-154.4	166	-176.6	59.3	52.5	0	0	0	111.2	Y273 Q274 V275 Y357 P481	D271-Y273 PolarHBondContact O-N 3.49Å; D271-Y273 VanDerWaalsContact O-N 3.16Å; D271-Y273 VanDerWaalsContact OD1-CA 3.31Å; D271-Y273 WeakPolarHBondContact OD1-CA 3.37Å; D271-Y273 VanDerWaalsContact OD1-CB 3.26Å; D271-Y273 WeakPolarHBondContact OD1-CB 3.31Å; D271-Y273 PolarHBondContact OD1-N 3.34Å; D271-Q274 PolarHBondContact O-N 2.7Å; D271-Q274 PolarHBondContact OD1-N 3.37Å; D271-V275 WeakPolarHBondContact O-CG2 3.45Å; D271-V275 PolarHBondContact O-N 3.03Å; D271-V275 VanDerWaalsContact O-N 3.17Å; D271-Y357 HydrophobicContact CB-CE1 4.47Å; D271-Y357 PolarHBondContact OD2-OH 2.91Å; D271-P481 WeakPolarHBondContact OD2-CG 3.22Å
272	C	95.1	Very high	78.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-66.4	-9.1	177.2	-68.5	0	0	0	0	114.7	R276 C301 H303 G309 T311	C272-R276 PolarHBondContact O-N 2.82Å; C272-C301 HydrophobicContact CB-CB 3.6Å; C272-C301 WeakPolarHBondContact CB-SG 3.42Å; C272-C301 WeakPolarHBondContact SG-CA 3.25Å; C272-C301 WeakPolarHBondContact SG-CB 3.36Å; C272-C301 CovalentContact SG-SG 2.03Å; C272-C301 PolarHBondContact SG-SG 2.99Å; C272-H303 PolarHBondContact O-CE1 3.14Å; C272-H303 VanDerWaalsContact O-CE1 3.3Å; C272-G309 CarbonylContact C-O 3.54Å; C272-G309 WeakPolarHBondContact O-CA 3.46Å; C272-T311 WeakPolarHBondContact CB-OG1 3.27Å; C272-T311 PolarHBondContact N-OG1 2.83Å; C272-T311 PolarHBondContact SG-OG1 2.97Å
273	Y	94.7	Very high	81.2	Confident	47 Å²	47	64.9 Å²	64.9	18%	0.184	37%	0.374	C	S	.	.	H	α-helix	trans	-86.2	-35.3	175.7	176.2	-93.6	0	0	0	110.8	D271 R276 R277 G309 R480 P481 D483	D271-Y273 PolarHBondContact O-N 3.49Å; D271-Y273 VanDerWaalsContact O-N 3.16Å; D271-Y273 VanDerWaalsContact OD1-CA 3.31Å; D271-Y273 WeakPolarHBondContact OD1-CA 3.37Å; D271-Y273 VanDerWaalsContact OD1-CB 3.26Å; D271-Y273 WeakPolarHBondContact OD1-CB 3.31Å; D271-Y273 PolarHBondContact OD1-N 3.34Å; Y273-R276 WeakPolarHBondContact O-CB 3.35Å; Y273-R276 PolarHBondContact O-N 3.11Å; Y273-R277 VanDerWaalsContact CE1-CD 3.44Å; Y273-R277 HydrophobicContact CE1-CG 4.34Å; Y273-R277 WeakPolarHBondContact O-CG 3.31Å; Y273-R277 PolarHBondContact O-N 2.93Å; Y273-G309 PolarHBondContact N-O 2.96Å; Y273-R480 HydrophobicContact CD2-CG 3.92Å; Y273-R480 HydrophobicContact CG-CG 4.37Å; Y273-P481 HydrophobicContact CD1-CG 4.25Å; Y273-P481 HydrophobicContact CG-CG 4.38Å; Y273-D483 WeakPolarHBondContact CE2-OD1 3.48Å; Y273-D483 PolarHBondContact OH-OD1 3.16Å
274	Q	93.4	Very high	83.5	Confident	78 Å²	78	58 Å²	58	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-65.6	-44	165.6	-78	-165.8	-15.6	0	0	112.6	F269 K270 D271 R276 R277 A278	F269-Q274 HydrophobicContact CB-CB 4.1Å; F269-Q274 HydrophobicContact CD1-CB 4.26Å; K270-Q274 HydrophobicContact CG-CG 4.21Å; D271-Q274 PolarHBondContact O-N 2.7Å; D271-Q274 PolarHBondContact OD1-N 3.37Å; Q274-R276 PolarHBondContact O-N 2.83Å; Q274-R277 PolarHBondContact O-N 3.1Å; Q274-A278 PolarHBondContact O-N 3.47Å
275	V	93.1	Very high	85.9	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-46.7	-47.7	171.2	168.9	0	0	0	0	109.9	F269 D271 H280 Y286 L288	F269-V275 HydrophobicContact CB-CG2 3.66Å; F269-V275 HydrophobicContact CD2-CB 4.34Å; F269-V275 HydrophobicContact CD2-CG2 3.51Å; F269-V275 HydrophobicContact CE2-CG2 4.3Å; F269-V275 HydrophobicContact CG-CB 4.34Å; F269-V275 HydrophobicContact CG-CG2 3.63Å; D271-V275 WeakPolarHBondContact O-CG2 3.45Å; D271-V275 PolarHBondContact O-N 3.03Å; D271-V275 VanDerWaalsContact O-N 3.17Å; V275-H280 HydrophobicContact CG1-CB 3.74Å; V275-H280 WeakPolarHBondContact O-CB 3.47Å; V275-H280 PolarHBondContact O-CD2 2.65Å; V275-H280 PolarHBondContact O-N 2.77Å; V275-Y286 HydrophobicContact CG1-CD1 3.63Å; V275-Y286 HydrophobicContact CG1-CD2 4.2Å; V275-Y286 HydrophobicContact CG1-CE1 3.6Å; V275-Y286 HydrophobicContact CG1-CE2 4.16Å; V275-Y286 HydrophobicContact CG1-CG 3.96Å; V275-Y286 HydrophobicContact CG2-CD1 4.26Å; V275-Y286 HydrophobicContact CG2-CG 4.32Å; V275-L288 HydrophobicContact CG2-CD2 3.9Å
276	R	93	Very high	87.9	Confident	63 Å²	63	53.5 Å²	53.5	24%	0.238	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-48.5	174	154.8	164.5	-69	-174.3	-4.1	114	C272 Y273 Q274 A278 G279 H280 H303 N307 G308	C272-R276 PolarHBondContact O-N 2.82Å; Y273-R276 WeakPolarHBondContact O-CB 3.35Å; Y273-R276 PolarHBondContact O-N 3.11Å; Q274-R276 PolarHBondContact O-N 2.83Å; R276-A278 PolarHBondContact O-N 2.89Å; R276-G279 WeakPolarHBondContact O-CA 3.5Å; R276-G279 PolarHBondContact O-N 2.85Å; R276-H280 WeakPolarHBondContact CA-O 3.18Å; R276-H303 PolarHBondContact NH2-O 2.95Å; R276-N307 PolarHBondContact NH1-O 3.06Å; R276-N307 PolarHBondContact NH2-O 2.99Å; R276-G308 PolarHBondContact NH1-O 2.95Å
277	R	92.5	Very high	89.7	Confident	190 Å²	190	52.5 Å²	52.5	72%	0.717	30%	0.298	S	S	*	.	H	α-helix	trans	-66.2	-18.5	-173.6	-76.6	-176.3	61.1	168.8	-2.7	112.7	Y273 Q274 G279	Y273-R277 VanDerWaalsContact CE1-CD 3.44Å; Y273-R277 HydrophobicContact CE1-CG 4.34Å; Y273-R277 WeakPolarHBondContact O-CG 3.31Å; Y273-R277 PolarHBondContact O-N 2.93Å; Q274-R277 PolarHBondContact O-N 3.1Å; R277-G279 VanDerWaalsContact C-N 3.31Å
278	A	91.1	Very high	91.2	Very high	56 Å²	56	50.4 Å²	50.4	46%	0.463	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.5	166.9	0	0	0	0	0	114.6	F269 Q274 R276	F269-A278 HydrophobicContact CD1-CB 4.48Å; F269-A278 HydrophobicContact CE1-CB 3.52Å; F269-A278 HydrophobicContact CZ-CB 4.04Å; Q274-A278 PolarHBondContact O-N 3.47Å; R276-A278 PolarHBondContact O-N 2.89Å
279	G	90.8	Very high	92	Very high	58 Å²	58	49.7 Å²	49.7	60%	0.598	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.4	-4.7	176.3	0	0	0	0	0	115.3	R276 R277 S281	R276-G279 WeakPolarHBondContact O-CA 3.5Å; R276-G279 PolarHBondContact O-N 2.85Å; R277-G279 VanDerWaalsContact C-N 3.31Å; G279-S281 PolarHBondContact O-N 3.39Å
280	H	90.6	Very high	91.9	Very high	35 Å²	35	48.8 Å²	48.8	16%	0.162	26%	0.262	C	S	.	.			trans	-76.3	116.1	-179.8	-56.3	-49.9	0	0	0	111.6	T264 F269 V275 R276 Y286	T264-H280 PolarHBondContact OG1-NE2 2.75Å; F269-H280 AromaticContact CE2-CD2 3.97Å; F269-H280 AromaticContact CZ-CD2 3.75Å; F269-H280 AromaticContact CZ-NE2 3.68Å; V275-H280 HydrophobicContact CG1-CB 3.74Å; V275-H280 WeakPolarHBondContact O-CB 3.47Å; V275-H280 PolarHBondContact O-CD2 2.65Å; V275-H280 PolarHBondContact O-N 2.77Å; R276-H280 WeakPolarHBondContact CA-O 3.18Å; H280-Y286 HydrophobicContact CB-CE1 4.19Å
281	S	89.8	Confident	91.5	Very high	84 Å²	84	51.6 Å²	51.6	59%	0.587	28%	0.279	S	S	*	.			trans	-112.1	-3.9	-177.5	56.4	0	0	0	0	114.5	G279 H303	G279-S281 PolarHBondContact O-N 3.39Å; S281-H303 VanDerWaalsContact O-CB 3.28Å; S281-H303 WeakPolarHBondContact O-CB 3.28Å
282	T	91.8	Very high	90.5	Very high	96 Å²	96	56.3 Å²	56.3	59%	0.589	30%	0.304	S	S	*	.			trans	-83.2	124.5	-174.5	-51.1	0	0	0	0	111.5	G284 Y286 H303	T282-G284 PolarHBondContact O-N 3.34Å; T282-Y286 WeakPolarHBondContact O-CE2 3.4Å; T282-Y286 PolarHBondContact O-OH 3.45Å; T282-H303 PolarHBondContact O-CD2 3.2Å
283	N	93.2	Very high	89.6	Confident	51 Å²	51	58 Å²	58	27%	0.273	32%	0.316	S	S	.	.			trans	-59	128.1	168.9	-77	15.6	0	0	0	110.8	W300 E302 H303 S304	N283-W300 HydrophobicContact CB-CZ2 4.22Å; N283-E302 PolarHBondContact ND2-OE1 2.94Å; N283-E302 PolarHBondContact ND2-OE2 3.01Å; N283-E302 PolarHBondContact OD1-OE1 2.81Å; N283-H303 WeakPolarHBondContact OD1-CA 3.49Å; N283-H303 WeakPolarHBondContact OD1-CB 3.45Å; N283-H303 PolarHBondContact OD1-N 3.38Å; N283-S304 PolarHBondContact ND2-OG 3.03Å; N283-S304 PolarHBondContact OD1-N 2.84Å; N283-S304 PolarHBondContact OD1-OG 3.01Å
284	G	91.8	Very high	88.6	Confident	11 Å²	11	63.3 Å²	63.3	11%	0.113	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.2	-167.7	-178.4	0	0	0	0	0	114.6	T282 W300 C301	T282-G284 PolarHBondContact O-N 3.34Å; G284-W300 WeakPolarHBondContact O-CA 3.16Å; G284-C301 PolarHBondContact N-O 2.88Å; G284-C301 PolarHBondContact O-N 2.88Å
285	M	92.6	Very high	88.1	Confident	58 Å²	58	62.2 Å²	62.2	29%	0.286	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	128.4	178.8	-61.9	-172.6	-70.5	0	0	111.3	Q298 V299 W300 I337 D338	M285-Q298 PolarHBondContact SD-NE2 2.85Å; M285-V299 VanDerWaalsContact CA-O 3.3Å; M285-V299 WeakPolarHBondContact CA-O 3.49Å; M285-W300 HydrophobicContact CG-CE3 3.93Å; M285-W300 HydrophobicContact CG-CZ3 4.25Å; M285-I337 HydrophobicContact CG-CB 4.33Å; M285-I337 HydrophobicContact CG-CG2 3.88Å; M285-I337 HydrophobicContact SD-CB 3.95Å; M285-I337 HydrophobicContact SD-CG2 4.16Å; M285-D338 HydrophobicContact SD-CB 4.25Å
286	Y	90.6	Very high	87.8	Confident	16 Å²	16	67.1 Å²	67.1	6%	0.063	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	158	177.9	-71.5	-91.8	0	0	0	110.9	V275 H280 T282 Q298 V299 C301	V275-Y286 HydrophobicContact CG1-CD1 3.63Å; V275-Y286 HydrophobicContact CG1-CD2 4.2Å; V275-Y286 HydrophobicContact CG1-CE1 3.6Å; V275-Y286 HydrophobicContact CG1-CE2 4.16Å; V275-Y286 HydrophobicContact CG1-CG 3.96Å; V275-Y286 HydrophobicContact CG2-CD1 4.26Å; V275-Y286 HydrophobicContact CG2-CG 4.32Å; H280-Y286 HydrophobicContact CB-CE1 4.19Å; T282-Y286 WeakPolarHBondContact O-CE2 3.4Å; T282-Y286 PolarHBondContact O-OH 3.45Å; Y286-Q298 WeakPolarHBondContact O-CA 3.38Å; Y286-V299 PolarHBondContact N-O 3.48Å; Y286-V299 PolarHBondContact O-N 3.3Å; Y286-C301 HydrophobicContact CD2-CB 3.65Å; Y286-C301 VanDerWaalsContact CD2-SG 3.57Å; Y286-C301 HydrophobicContact CE2-CB 4.1Å
287	L	91.4	Very high	87.7	Confident	76 Å²	76	64.5 Å²	64.5	40%	0.398	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.1	171.8	-70.5	166.8	0	0	0	109.3	L296 I297 Q298	L287-L296 HydrophobicContact CD2-CB 4.48Å; L287-I297 WeakPolarHBondContact CA-O 3.49Å; L287-Q298 HydrophobicContact CD2-CB 4.08Å; L287-Q298 HydrophobicContact CD2-CG 4.5Å
288	L	91.4	Very high	87.7	Confident	0 Å²	0	60 Å²	60	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	152.8	175.5	-57.2	-178	0	0	0	111.4	F269 V275 L296 I297 V299 T311 L351	F269-L288 HydrophobicContact CB-CD2 3.98Å; F269-L288 CarbonylContact O-C 3.4Å; F269-L288 WeakPolarHBondContact O-CA 3.36Å; F269-L288 WeakPolarHBondContact O-CB 3.41Å; F269-L288 WeakPolarHBondContact O-CD2 3.38Å; V275-L288 HydrophobicContact CG2-CD2 3.9Å; L288-L296 CarbonylContact O-C 3.49Å; L288-L296 VanDerWaalsContact O-CA 3.3Å; L288-L296 WeakPolarHBondContact O-CA 3.31Å; L288-I297 PolarHBondContact N-O 3Å; L288-I297 PolarHBondContact O-N 3.06Å; L288-V299 HydrophobicContact CD1-CB 4.37Å; L288-V299 HydrophobicContact CD1-CG1 3.88Å; L288-V299 HydrophobicContact CD1-CG2 3.61Å; L288-V299 HydrophobicContact CD2-CG2 4.42Å; L288-V299 HydrophobicContact CG-CG1 4.36Å; L288-V299 HydrophobicContact CG-CG2 3.71Å; L288-T311 HydrophobicContact CD1-CG2 4.16Å; L288-L351 HydrophobicContact CD1-CD2 3.95Å
289	K	90.6	Very high	87.9	Confident	59 Å²	59	57.4 Å²	57.4	26%	0.257	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	111.4	161.9	-178.3	177.2	168	173.2	0	108.9	P268 F269 K270 S293 E294 L296	P268-K289 HydrophobicContact CB-CB 3.67Å; P268-K289 HydrophobicContact CG-CB 4.02Å; P268-K289 HydrophobicContact CG-CD 4.34Å; F269-K289 PolarHBondContact O-N 2.89Å; K270-K289 WeakPolarHBondContact CA-O 3.41Å; K289-S293 VanDerWaalsContact CE-O 3.23Å; K289-S293 WeakPolarHBondContact CE-O 3.39Å; K289-S293 WeakPolarHBondContact CG-O 3.37Å; K289-E294 WeakPolarHBondContact CE-OE1 3.39Å; K289-E294 IonicContact NZ-OE1 2.87Å; K289-E294 PolarHBondContact NZ-OE1 3.45Å; K289-E294 IonicContact NZ-OE2 3.94Å; K289-E294 PolarHBondContact NZ-OE2 2.96Å; K289-L296 HydrophobicContact CB-CD2 3.99Å
290	T	87.4	Confident	88.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.303	C	S	.	.			trans	-70.4	145.2	176	52.5	0	0	0	0	111.5	N292 S293 I297 L351	T290-N292 PolarHBondContact O-N 3.43Å; T290-S293 PolarHBondContact O-N 3.01Å; T290-S293 VanDerWaalsContact O-O 3.09Å; T290-S293 WeakPolarHBondContact OG1-CB 3.13Å; T290-I297 HydrophobicContact CG2-CD1 3.89Å; T290-L351 HydrophobicContact CG2-CB 4.5Å; T290-L351 HydrophobicContact CG2-CD2 3.71Å; T290-L351 HydrophobicContact CG2-CG 3.81Å
291	D	82.1	Confident	88.4	Confident	104 Å²	104	54.7 Å²	54.7	56%	0.556	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-24.3	-175.9	-61.5	-37.1	0	0	0	113.5	K270 Q354	K270-D291 WeakPolarHBondContact CD-OD2 3.48Å; K270-D291 IonicContact NZ-OD2 2.81Å; K270-D291 PolarHBondContact NZ-OD2 3.5Å; D291-Q354 HydrophobicContact CB-CB 4.1Å
292	N	74.1	Confident	88.7	Confident	100 Å²	100	51 Å²	51	54%	0.535	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	6.5	-178.6	-66.2	-81	0	0	0	115	T290	T290-N292 PolarHBondContact O-N 3.43Å
293	S	75.7	Confident	88.8	Confident	36 Å²	36	46.8 Å²	46.8	25%	0.252	24%	0.243	S	C	.	.			trans	-144.6	142.5	-179.7	-169.1	0	0	0	0	113.9	K289 T290 S295	K289-S293 VanDerWaalsContact CE-O 3.23Å; K289-S293 WeakPolarHBondContact CE-O 3.39Å; K289-S293 WeakPolarHBondContact CG-O 3.37Å; T290-S293 PolarHBondContact O-N 3.01Å; T290-S293 VanDerWaalsContact O-O 3.09Å; T290-S293 WeakPolarHBondContact OG1-CB 3.13Å; S293-S295 VanDerWaalsContact C-N 3.28Å; S293-S295 PolarHBondContact OG-N 3.24Å; S293-S295 VanDerWaalsContact OG-N 3.13Å; S293-S295 PolarHBondContact OG-OG 2.98Å
294	E	74.4	Confident	88.7	Confident	159 Å²	159	48.7 Å²	48.7	74%	0.743	26%	0.26	S	S	*	.	S	Bend	trans	-78.7	-9	169.1	-70.3	-57.9	132.4	0	0	113.4	K289	K289-E294 WeakPolarHBondContact CE-OE1 3.39Å; K289-E294 IonicContact NZ-OE1 2.87Å; K289-E294 PolarHBondContact NZ-OE1 3.45Å; K289-E294 IonicContact NZ-OE2 3.94Å; K289-E294 PolarHBondContact NZ-OE2 2.96Å
295	S	81.3	Confident	88.6	Confident	55 Å²	55	50.5 Å²	50.5	39%	0.385	27%	0.266	S	S	.	.	S	Bend	trans	-78.3	128.4	177.6	63.2	0	0	0	0	112.3	S293	S293-S295 VanDerWaalsContact C-N 3.28Å; S293-S295 PolarHBondContact OG-N 3.24Å; S293-S295 VanDerWaalsContact OG-N 3.13Å; S293-S295 PolarHBondContact OG-OG 2.98Å
296	L	88.3	Confident	88.3	Confident	102 Å²	102	51.3 Å²	51.3	53%	0.534	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.3	165.2	-64.8	176.2	0	0	0	110.8	P268 L287 L288 K289	P268-L296 HydrophobicContact CB-CD2 3.88Å; L287-L296 HydrophobicContact CD2-CB 4.48Å; L288-L296 CarbonylContact O-C 3.49Å; L288-L296 VanDerWaalsContact O-CA 3.3Å; L288-L296 WeakPolarHBondContact O-CA 3.31Å; K289-L296 HydrophobicContact CB-CD2 3.99Å
297	I	91.1	Very high	88	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.5	179	-52.5	175.3	0	0	0	108.4	L287 L288 T290 V299 L343 N347	L287-I297 WeakPolarHBondContact CA-O 3.49Å; L288-I297 PolarHBondContact N-O 3Å; L288-I297 PolarHBondContact O-N 3.06Å; T290-I297 HydrophobicContact CG2-CD1 3.89Å; I297-V299 HydrophobicContact CG2-CG1 3.9Å; I297-L343 HydrophobicContact CG2-CD1 3.97Å; I297-N347 HydrophobicContact CD1-CB 4.03Å; I297-N347 WeakPolarHBondContact CD1-OD1 3.45Å; I297-N347 HydrophobicContact CG2-CB 4.21Å
298	Q	91.6	Very high	88	Confident	97 Å²	97	53.6 Å²	53.6	45%	0.453	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.2	172.3	-170.2	-179.9	6.3	0	0	109.9	M285 Y286 L287 I337	M285-Q298 PolarHBondContact SD-NE2 2.85Å; Y286-Q298 WeakPolarHBondContact O-CA 3.38Å; L287-Q298 HydrophobicContact CD2-CB 4.08Å; L287-Q298 HydrophobicContact CD2-CG 4.5Å; Q298-I337 HydrophobicContact CG-CG1 4.27Å
299	V	95.3	Very high	88.2	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	162.8	-177.9	-56.8	0	0	0	0	111.5	M285 Y286 L288 I297 T311 L343	M285-V299 VanDerWaalsContact CA-O 3.3Å; M285-V299 WeakPolarHBondContact CA-O 3.49Å; Y286-V299 PolarHBondContact N-O 3.48Å; Y286-V299 PolarHBondContact O-N 3.3Å; L288-V299 HydrophobicContact CD1-CB 4.37Å; L288-V299 HydrophobicContact CD1-CG1 3.88Å; L288-V299 HydrophobicContact CD1-CG2 3.61Å; L288-V299 HydrophobicContact CD2-CG2 4.42Å; L288-V299 HydrophobicContact CG-CG1 4.36Å; L288-V299 HydrophobicContact CG-CG2 3.71Å; I297-V299 HydrophobicContact CG2-CG1 3.9Å; V299-T311 HydrophobicContact CB-CG2 4.02Å; V299-T311 HydrophobicContact CG1-CG2 3.97Å; V299-T311 HydrophobicContact CG2-CG2 4.17Å; V299-L343 HydrophobicContact CG1-CD1 4.01Å; V299-L343 HydrophobicContact CG1-CD2 4.06Å
300	W	95.9	Very high	88.5	Confident	36 Å²	36	50.8 Å²	50.8	14%	0.136	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.6	164.7	-175.5	-79.1	0	0	0	109.4	N283 G284 M285 V312 I337 D338	N283-W300 HydrophobicContact CB-CZ2 4.22Å; G284-W300 WeakPolarHBondContact O-CA 3.16Å; M285-W300 HydrophobicContact CG-CE3 3.93Å; M285-W300 HydrophobicContact CG-CZ3 4.25Å; W300-V312 HydrophobicContact CB-CB 4.18Å; W300-V312 HydrophobicContact CB-CG2 4.36Å; W300-V312 HydrophobicContact CG-CG2 4.42Å; W300-V312 PolarHBondContact O-N 2.77Å; W300-I337 HydrophobicContact CB-CG2 3.82Å; W300-I337 VanDerWaalsContact N-CG2 3.27Å; W300-D338 HydrophobicContact CE3-CB 4.4Å; W300-D338 HydrophobicContact CZ3-CB 3.99Å; W300-D338 VanDerWaalsContact CZ3-OD1 3.23Å; W300-D338 WeakPolarHBondContact CZ3-OD1 2.95Å
301	C	96	Very high	89	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.7	172.4	-61.7	0	0	0	0	111	C272 G284 Y286 H303 W310	C272-C301 HydrophobicContact CB-CB 3.6Å; C272-C301 WeakPolarHBondContact CB-SG 3.42Å; C272-C301 WeakPolarHBondContact SG-CA 3.25Å; C272-C301 WeakPolarHBondContact SG-CB 3.36Å; C272-C301 CovalentContact SG-SG 2.03Å; C272-C301 PolarHBondContact SG-SG 2.99Å; G284-C301 PolarHBondContact N-O 2.88Å; G284-C301 PolarHBondContact O-N 2.88Å; Y286-C301 HydrophobicContact CD2-CB 3.65Å; Y286-C301 VanDerWaalsContact CD2-SG 3.57Å; Y286-C301 HydrophobicContact CE2-CB 4.1Å; C301-H303 WeakPolarHBondContact CB-NE2 3.18Å; C301-W310 WeakPolarHBondContact CA-O 3.3Å
302	E	96.4	Very high	89.7	Confident	7 Å²	7	45.9 Å²	45.9	3%	0.033	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	111.5	178.4	172.7	56.8	-99.5	0	0	109.9	N283 S304 L305 G309 W310 V312 R476 M478	N283-E302 PolarHBondContact ND2-OE1 2.94Å; N283-E302 PolarHBondContact ND2-OE2 3.01Å; N283-E302 PolarHBondContact OD1-OE1 2.81Å; E302-S304 WeakPolarHBondContact OE1-CA 3.38Å; E302-S304 VanDerWaalsContact OE1-CB 3.24Å; E302-S304 WeakPolarHBondContact OE1-CB 3.47Å; E302-S304 PolarHBondContact OE1-N 3.11Å; E302-L305 HydrophobicContact CG-CB 4.34Å; E302-L305 HydrophobicContact CG-CD1 3.57Å; E302-L305 HydrophobicContact CG-CG 4.04Å; E302-G309 PolarHBondContact O-N 3.22Å; E302-W310 HydrophobicContact CB-CB 4.21Å; E302-W310 PolarHBondContact N-O 2.92Å; E302-W310 PolarHBondContact O-N 3.49Å; E302-V312 HydrophobicContact CB-CG2 4.18Å; E302-R476 IonicContact OE2-CZ 3.79Å; E302-R476 IonicContact OE2-NH1 3.53Å; E302-R476 PolarHBondContact OE2-NH1 2.85Å; E302-M478 HydrophobicContact CG-SD 4.29Å
303	H	94.3	Very high	90.9	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.037	22%	0.222	C	C	.	.			trans	-110.9	1	-172.2	-64.8	-73.3	0	0	0	113.5	C272 R276 S281 T282 N283 C301 N307	C272-H303 PolarHBondContact O-CE1 3.14Å; C272-H303 VanDerWaalsContact O-CE1 3.3Å; R276-H303 PolarHBondContact NH2-O 2.95Å; S281-H303 VanDerWaalsContact O-CB 3.28Å; S281-H303 WeakPolarHBondContact O-CB 3.28Å; T282-H303 PolarHBondContact O-CD2 3.2Å; N283-H303 WeakPolarHBondContact OD1-CA 3.49Å; N283-H303 WeakPolarHBondContact OD1-CB 3.45Å; N283-H303 PolarHBondContact OD1-N 3.38Å; C301-H303 WeakPolarHBondContact CB-NE2 3.18Å; H303-N307 VanDerWaalsContact O-O 3.07Å
304	S	91.4	Very high	92	Very high	90 Å²	90	39.4 Å²	39.4	63%	0.629	21%	0.21	S	C	*	.	S	Bend	trans	-101.8	0	-175.3	-53	0	0	0	0	115	N283 E302	N283-S304 PolarHBondContact ND2-OG 3.03Å; N283-S304 PolarHBondContact OD1-N 2.84Å; N283-S304 PolarHBondContact OD1-OG 3.01Å; E302-S304 WeakPolarHBondContact OE1-CA 3.38Å; E302-S304 VanDerWaalsContact OE1-CB 3.24Å; E302-S304 WeakPolarHBondContact OE1-CB 3.47Å; E302-S304 PolarHBondContact OE1-N 3.11Å
305	L	88.8	Confident	93.1	Very high	49 Å²	49	32.9 Å²	32.9	26%	0.257	18%	0.179	S	C	.	.	S	Bend	trans	-127.5	132.7	-169.2	-64.5	171.7	0	0	0	113.5	E302 N307 G308 W310 R476 M478	E302-L305 HydrophobicContact CG-CB 4.34Å; E302-L305 HydrophobicContact CG-CD1 3.57Å; E302-L305 HydrophobicContact CG-CG 4.04Å; L305-N307 CarbonylContact O-C 3.56Å; L305-G308 WeakPolarHBondContact O-CA 3.5Å; L305-G308 PolarHBondContact O-N 3.42Å; L305-W310 VanDerWaalsContact O-CD1 3.28Å; L305-W310 PolarHBondContact O-NE1 3.11Å; L305-R476 VanDerWaalsContact CD1-NH2 3.29Å; L305-M478 HydrophobicContact CD1-CE 3.83Å; L305-M478 HydrophobicContact CD1-SD 4.45Å
306	D	85.5	Confident	93.9	Very high	76 Å²	76	30.5 Å²	30.5	41%	0.406	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	63	-177.2	179.2	44.7	0	0	0	112	G308 W310 K358 R480	D306-G308 PolarHBondContact O-N 3.08Å; D306-W310 HydrophobicContact CB-CZ2 4.06Å; D306-W310 WeakPolarHBondContact OD2-CZ2 3.24Å; D306-K358 IonicContact OD2-NZ 3.46Å; D306-K358 PolarHBondContact OD2-NZ 3.21Å; D306-R480 PolarHBondContact O-NH1 3.27Å; D306-R480 IonicContact OD2-CZ 2.98Å; D306-R480 IonicContact OD2-NH1 3.15Å; D306-R480 PolarHBondContact OD2-NH1 3.49Å; D306-R480 IonicContact OD2-NH2 2.69Å
307	N	85.8	Confident	94.2	Very high	138 Å²	138	29.3 Å²	29.3	74%	0.738	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	-53.9	-157	-58	-67.3	0	0	0	113.3	R276 H303 L305	R276-N307 PolarHBondContact NH1-O 3.06Å; R276-N307 PolarHBondContact NH2-O 2.99Å; H303-N307 VanDerWaalsContact O-O 3.07Å; L305-N307 CarbonylContact O-C 3.56Å
308	G	91	Very high	94.4	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.01	17%	0.167	C	C	.	.			trans	123.9	-164.1	178.9	0	0	0	0	0	114.1	R276 L305 D306 R480	R276-G308 PolarHBondContact NH1-O 2.95Å; L305-G308 WeakPolarHBondContact O-CA 3.5Å; L305-G308 PolarHBondContact O-N 3.42Å; D306-G308 PolarHBondContact O-N 3.08Å; G308-R480 WeakPolarHBondContact O-CD 3.42Å
309	G	94.9	Very high	94.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.			trans	88.7	23.4	-179.1	0	0	0	0	0	113.3	C272 Y273 E302	C272-G309 CarbonylContact C-O 3.54Å; C272-G309 WeakPolarHBondContact O-CA 3.46Å; Y273-G309 PolarHBondContact N-O 2.96Å; E302-G309 PolarHBondContact O-N 3.22Å
310	W	97.3	Very high	94.5	Very high	1 Å²	1	32.7 Å²	32.7	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	131.7	-176.5	-62.6	95.7	0	0	0	111.5	C301 E302 L305 D306 K358 M360 E374 M478 I479 R480	C301-W310 WeakPolarHBondContact CA-O 3.3Å; E302-W310 HydrophobicContact CB-CB 4.21Å; E302-W310 PolarHBondContact N-O 2.92Å; E302-W310 PolarHBondContact O-N 3.49Å; L305-W310 VanDerWaalsContact O-CD1 3.28Å; L305-W310 PolarHBondContact O-NE1 3.11Å; D306-W310 HydrophobicContact CB-CZ2 4.06Å; D306-W310 WeakPolarHBondContact OD2-CZ2 3.24Å; W310-K358 HydrophobicContact CH2-CD 4.05Å; W310-K358 VanDerWaalsContact CH2-CE 3.43Å; W310-K358 HydrophobicContact CH2-CG 4.12Å; W310-K358 HydrophobicContact CZ3-CG 4.26Å; W310-M360 HydrophobicContact CE3-CB 3.95Å; W310-M360 HydrophobicContact CH2-CB 3.55Å; W310-M360 HydrophobicContact CH2-CE 4.28Å; W310-M360 HydrophobicContact CH2-CG 4.42Å; W310-M360 HydrophobicContact CZ2-CB 4.15Å; W310-M360 HydrophobicContact CZ2-CE 4.23Å; W310-M360 HydrophobicContact CZ3-CB 3.45Å; W310-M360 VanDerWaalsContact CZ3-CB 3.45Å; W310-E374 WeakPolarHBondContact CH2-OE2 3.41Å; W310-M478 HydrophobicContact CB-CB 4.07Å; W310-M478 HydrophobicContact CB-CG 3.96Å; W310-M478 HydrophobicContact CB-SD 3.97Å; W310-M478 HydrophobicContact CD2-CG 4.17Å; W310-M478 HydrophobicContact CE3-CG 3.96Å; W310-M478 HydrophobicContact CG-CG 4.19Å; W310-M478 HydrophobicContact CG-SD 4.18Å; W310-I479 WeakPolarHBondContact CA-O 3.44Å; W310-I479 VanDerWaalsContact CE3-C 3.5Å; W310-R480 HydrophobicContact CD2-CB 3.96Å; W310-R480 HydrophobicContact CE3-CB 3.57Å; W310-R480 HydrophobicContact CH2-CB 4.24Å; W310-R480 HydrophobicContact CZ3-CB 3.71Å
311	T	97.4	Very high	94.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.2	170.4	-49.6	0	0	0	0	108.7	C272 L288 V299 L313 L351 M478 I479	C272-T311 WeakPolarHBondContact CB-OG1 3.27Å; C272-T311 PolarHBondContact N-OG1 2.83Å; C272-T311 PolarHBondContact SG-OG1 2.97Å; L288-T311 HydrophobicContact CD1-CG2 4.16Å; V299-T311 HydrophobicContact CB-CG2 4.02Å; V299-T311 HydrophobicContact CG1-CG2 3.97Å; V299-T311 HydrophobicContact CG2-CG2 4.17Å; T311-L313 HydrophobicContact CG2-CD2 4.46Å; T311-L351 HydrophobicContact CG2-CD1 4.05Å; T311-M478 CarbonylContact O-C 3.6Å; T311-M478 VanDerWaalsContact O-CA 3.22Å; T311-M478 WeakPolarHBondContact O-CA 3.44Å; T311-M478 WeakPolarHBondContact O-CB 3.47Å; T311-I479 PolarHBondContact N-O 2.71Å; T311-I479 PolarHBondContact O-N 3Å
312	V	98.1	Very high	94.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.1	179.1	-177.5	0	0	0	0	110.2	W300 E302 Q314 K315 M478	W300-V312 HydrophobicContact CB-CB 4.18Å; W300-V312 HydrophobicContact CB-CG2 4.36Å; W300-V312 HydrophobicContact CG-CG2 4.42Å; W300-V312 PolarHBondContact O-N 2.77Å; E302-V312 HydrophobicContact CB-CG2 4.18Å; V312-Q314 WeakPolarHBondContact CG1-O 3.4Å; V312-K315 HydrophobicContact CG1-CB 4.19Å; V312-M478 HydrophobicContact CB-CB 4.47Å; V312-M478 HydrophobicContact CG2-CB 4.13Å
313	L	98.3	Very high	94.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-32.7	-179.8	-52.3	-174.8	0	0	0	112.2	T311 L343 I348 L351 F378 L477 I479	T311-L313 HydrophobicContact CG2-CD2 4.46Å; L313-L343 HydrophobicContact CD2-CD2 3.72Å; L313-L343 VanDerWaalsContact O-CB 3.31Å; L313-L343 WeakPolarHBondContact O-CB 3.27Å; L313-L343 PolarHBondContact O-N 3.05Å; L313-I348 HydrophobicContact CB-CD1 4.38Å; L313-I348 HydrophobicContact CB-CG1 4.27Å; L313-I348 HydrophobicContact CD1-CG1 4.34Å; L313-I348 HydrophobicContact CD1-CG2 3.85Å; L313-I348 HydrophobicContact CD2-CG1 4.16Å; L313-I348 HydrophobicContact CG-CG1 4.49Å; L313-L351 HydrophobicContact CD2-CD1 4.22Å; L313-F378 HydrophobicContact CD1-CE1 3.97Å; L313-F378 HydrophobicContact CD1-CZ 4.15Å; L313-L477 HydrophobicContact CB-CD2 4.49Å; L313-L477 PolarHBondContact N-O 3.08Å; L313-I479 HydrophobicContact CD1-CB 4.47Å; L313-I479 HydrophobicContact CD1-CD1 4.16Å; L313-I479 HydrophobicContact CD1-CG1 4.13Å; L313-I479 HydrophobicContact CD1-CG2 3.65Å; L313-I479 HydrophobicContact CD2-CD1 3.94Å; L313-I479 HydrophobicContact CD2-CG1 3.93Å; L313-I479 HydrophobicContact CG-CD1 4.47Å; L313-I479 HydrophobicContact CG-CG1 4.17Å; L313-I479 HydrophobicContact CG-CG2 4.39Å
314	Q	98.5	Very high	94.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	142.7	178	-173.2	-98.9	41.2	0	0	110.3	V312 F323 H341 W342 L442 N443 R476 L477	V312-Q314 WeakPolarHBondContact CG1-O 3.4Å; Q314-F323 HydrophobicContact CG-CE1 3.99Å; Q314-F323 HydrophobicContact CG-CZ 4.47Å; Q314-H341 WeakPolarHBondContact CA-O 3.31Å; Q314-W342 HydrophobicContact CB-CE3 3.8Å; Q314-W342 HydrophobicContact CB-CZ3 4.05Å; Q314-W342 HydrophobicContact CG-CE3 3.77Å; Q314-W342 HydrophobicContact CG-CZ3 4.21Å; Q314-L442 PolarHBondContact NE2-O 3.47Å; Q314-N443 WeakPolarHBondContact CG-OD1 3.43Å; Q314-N443 PolarHBondContact NE2-OD1 3.24Å; Q314-R476 WeakPolarHBondContact O-CA 3.31Å; Q314-L477 HydrophobicContact CB-CB 3.75Å; Q314-L477 HydrophobicContact CB-CD2 4.15Å; Q314-L477 PolarHBondContact N-O 3.11Å; Q314-L477 PolarHBondContact O-N 3.2Å
315	K	98.3	Very high	95.1	Very high	23 Å²	23	39.1 Å²	39.1	10%	0.1	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	123.4	-178.1	-172.7	171.3	171.8	-166.4	0	109.4	V312 D338 G339 E340 H341 V475 R476	V312-K315 HydrophobicContact CG1-CB 4.19Å; K315-D338 PolarHBondContact NZ-O 2.91Å; K315-G339 VanDerWaalsContact CD-O 3.23Å; K315-G339 WeakPolarHBondContact CD-O 3.2Å; K315-G339 WeakPolarHBondContact CE-O 3.48Å; K315-E340 WeakPolarHBondContact O-CA 3.45Å; K315-E340 VanDerWaalsContact O-CB 3.31Å; K315-E340 WeakPolarHBondContact O-CB 3.11Å; K315-H341 PolarHBondContact N-O 3.5Å; K315-H341 VanDerWaalsContact N-O 3.09Å; K315-H341 PolarHBondContact O-N 2.79Å; K315-H341 VanDerWaalsContact O-N 3.15Å; K315-V475 WeakPolarHBondContact CA-O 3.28Å; K315-R476 HydrophobicContact CG-CG 4.46Å
316	R	98.1	Very high	95.6	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.7	170.4	-48.3	-57.9	-62.7	-85	10.2	108.7	F323 E340 L442 G444 I460 S474 V475	R316-F323 VanDerWaalsContact CD-CE2 3.44Å; R316-E340 WeakPolarHBondContact CA-OE1 3.45Å; R316-E340 IonicContact NE-OE1 2.68Å; R316-E340 IonicContact NE-OE2 3.7Å; R316-L442 PolarHBondContact NH1-O 2.98Å; R316-G444 PolarHBondContact NH1-O 3.08Å; R316-G444 PolarHBondContact NH2-O 3.45Å; R316-I460 HydrophobicContact CB-CD1 4.07Å; R316-I460 HydrophobicContact CG-CD1 4.07Å; R316-S474 CarbonylContact O-C 3.58Å; R316-S474 VanDerWaalsContact O-CA 3.27Å; R316-S474 WeakPolarHBondContact O-CA 3.38Å; R316-S474 PolarHBondContact O-OG 3.43Å; R316-V475 HydrophobicContact CB-CB 4.18Å; R316-V475 HydrophobicContact CG-CB 4.26Å; R316-V475 PolarHBondContact N-O 3.31Å; R316-V475 PolarHBondContact O-N 2.9Å
317	K	95.2	Very high	96.2	Very high	77 Å²	77	36.3 Å²	36.3	34%	0.335	19%	0.193	S	C	.	.	S	Bend	trans	-157.8	-26.3	-179.8	72.4	-172.3	-172.7	-178.9	0	115.3	D338 E340 K473	K317-D338 PolarHBondContact NZ-O 3.46Å; K317-D338 VanDerWaalsContact NZ-O 3.12Å; K317-E340 HydrophobicContact CG-CG 4.11Å; K317-E340 PolarHBondContact N-OE1 3.35Å; K317-K473 CarbonylContact C-O 3.22Å
318	D	94.2	Very high	96.8	Very high	68 Å²	68	33.6 Å²	33.6	36%	0.364	18%	0.175	S	C	.	.	S	Bend	trans	-151	-5.2	-165.6	57.2	26.4	0	0	0	115.2	S320 E340	D318-S320 PolarHBondContact O-N 2.88Å; D318-S320 WeakPolarHBondContact OD1-CB 3.38Å; D318-S320 PolarHBondContact OD1-N 3.33Å; D318-S320 PolarHBondContact OD1-OG 3.04Å; D318-E340 PolarHBondContact N-OE1 3.31Å; D318-E340 WeakPolarHBondContact OD1-CG 3.23Å
319	G	94.3	Very high	97.1	Very high	32 Å²	32	36.6 Å²	36.6	33%	0.33	19%	0.191	S	C	.	.	S	Bend	trans	70.2	12.6	-176.9	0	0	0	0	0	114.9	V321 E340	G319-V321 PolarHBondContact O-N 3.03Å; G319-E340 PolarHBondContact N-OE1 3.39Å
320	S	95.1	Very high	97.3	Very high	77 Å²	77	36.6 Å²	36.6	54%	0.538	19%	0.191	S	C	.	.			trans	-62.4	-22.1	179.2	57.7	0	0	0	0	113.9	D318	D318-S320 PolarHBondContact O-N 2.88Å; D318-S320 WeakPolarHBondContact OD1-CB 3.38Å; D318-S320 PolarHBondContact OD1-N 3.33Å; D318-S320 PolarHBondContact OD1-OG 3.04Å
321	V	97.1	Very high	97.3	Very high	23 Å²	23	38.5 Å²	38.5	14%	0.139	20%	0.2	C	C	.	.	S	Bend	trans	-114.3	128.8	179.9	175.2	0	0	0	0	110.6	G319 F323 F334 E340	G319-V321 PolarHBondContact O-N 3.03Å; V321-F323 HydrophobicContact CB-CD2 4.39Å; V321-F323 HydrophobicContact CB-CE2 3.99Å; V321-F323 HydrophobicContact CG1-CD2 4.09Å; V321-F323 HydrophobicContact CG1-CE2 3.84Å; V321-F323 WeakPolarHBondContact O-CD2 3.38Å; V321-F323 PolarHBondContact O-N 2.63Å; V321-F334 HydrophobicContact CG1-CD2 3.71Å; V321-F334 HydrophobicContact CG1-CE2 3.96Å; V321-E340 HydrophobicContact CB-CB 3.93Å; V321-E340 HydrophobicContact CG2-CB 3.92Å; V321-E340 WeakPolarHBondContact CG2-O 3.39Å; V321-E340 PolarHBondContact N-OE2 2.89Å
322	N	96.7	Very high	97.3	Very high	84 Å²	84	44.9 Å²	44.9	45%	0.449	23%	0.227	S	C	.	.			trans	-72.9	120	169.6	173.6	30.7	0	0	0	110.5	F324 R325	N322-F324 PolarHBondContact ND2-O 3.49Å; N322-F324 VanDerWaalsContact ND2-O 3.17Å; N322-F324 WeakPolarHBondContact OD1-CB 3.16Å; N322-F324 PolarHBondContact OD1-N 2.67Å; N322-R325 PolarHBondContact O-NE 2.78Å; N322-R325 PolarHBondContact O-NH2 3.4Å
323	F	98.1	Very high	97.3	Very high	3 Å²	3	45.9 Å²	45.9	1%	0.013	24%	0.237	C	C	.	.			trans	-94.6	-6.8	174.4	-81.2	-111.6	0	0	0	113.9	Q314 R316 V321 R325 Y330 F334 E340 W342 N443	Q314-F323 HydrophobicContact CG-CE1 3.99Å; Q314-F323 HydrophobicContact CG-CZ 4.47Å; R316-F323 VanDerWaalsContact CD-CE2 3.44Å; V321-F323 HydrophobicContact CB-CD2 4.39Å; V321-F323 HydrophobicContact CB-CE2 3.99Å; V321-F323 HydrophobicContact CG1-CD2 4.09Å; V321-F323 HydrophobicContact CG1-CE2 3.84Å; V321-F323 WeakPolarHBondContact O-CD2 3.38Å; V321-F323 PolarHBondContact O-N 2.63Å; F323-R325 VanDerWaalsContact C-N 3.3Å; F323-R325 PolarHBondContact O-N 3.17Å; F323-Y330 WeakPolarHBondContact O-CE2 3.21Å; F323-Y330 PolarHBondContact O-OH 2.88Å; F323-F334 HydrophobicContact CB-CE2 4.41Å; F323-F334 HydrophobicContact CB-CZ 4.39Å; F323-F334 AromaticContact CD1-CE2 3.7Å; F323-F334 HydrophobicContact CD1-CE2 3.7Å; F323-F334 AromaticContact CD1-CZ 3.64Å; F323-F334 HydrophobicContact CD1-CZ 3.64Å; F323-F334 AromaticContact CD2-CE2 3.98Å; F323-F334 HydrophobicContact CD2-CE2 3.98Å; F323-F334 AromaticContact CE1-CE2 3.85Å; F323-F334 HydrophobicContact CE1-CE2 3.85Å; F323-F334 HydrophobicContact CE1-CZ 4.02Å; F323-F334 HydrophobicContact CE2-CE2 4.11Å; F323-F334 AromaticContact CG-CE2 3.76Å; F323-F334 HydrophobicContact CG-CE2 3.76Å; F323-F334 AromaticContact CG-CZ 3.98Å; F323-F334 HydrophobicContact CG-CZ 3.98Å; F323-F334 HydrophobicContact CZ-CE2 4.05Å; F323-E340 HydrophobicContact CE2-CB 4.25Å; F323-W342 HydrophobicContact CE1-CB 4.03Å; F323-N443 WeakPolarHBondContact CB-O 3.48Å; F323-N443 HydrophobicContact CD1-CB 4.02Å
324	F	97.8	Very high	97.3	Very high	77 Å²	77	47 Å²	47	34%	0.338	24%	0.242	S	C	.	.			trans	-75.1	86.9	169.8	-170	-129.8	0	0	0	109.3	N322 L413 K429	N322-F324 PolarHBondContact ND2-O 3.49Å; N322-F324 VanDerWaalsContact ND2-O 3.17Å; N322-F324 WeakPolarHBondContact OD1-CB 3.16Å; N322-F324 PolarHBondContact OD1-N 2.67Å; F324-L413 HydrophobicContact CD1-CD2 4.3Å; F324-L413 HydrophobicContact CD2-CD2 3.84Å; F324-L413 HydrophobicContact CE1-CD2 4.11Å; F324-L413 HydrophobicContact CE2-CB 3.7Å; F324-L413 HydrophobicContact CE2-CD2 3.63Å; F324-L413 HydrophobicContact CE2-CG 4.31Å; F324-L413 HydrophobicContact CG-CD2 4.19Å; F324-L413 HydrophobicContact CZ-CB 3.99Å; F324-L413 HydrophobicContact CZ-CD2 3.77Å; F324-L413 HydrophobicContact CZ-CG 4.45Å; F324-K429 VanDerWaalsContact CA-O 3.23Å; F324-K429 WeakPolarHBondContact CA-O 3.48Å; F324-K429 VanDerWaalsContact CB-O 3.28Å; F324-K429 WeakPolarHBondContact CB-O 3.25Å; F324-K429 HydrophobicContact CD2-CB 4.1Å; F324-K429 HydrophobicContact CD2-CD 4.34Å; F324-K429 VanDerWaalsContact CD2-O 3.31Å; F324-K429 WeakPolarHBondContact CD2-O 3.24Å; F324-K429 HydrophobicContact CE2-CD 4.18Å; F324-K429 HydrophobicContact CG-CB 4.43Å; F324-K429 HydrophobicContact CZ-CD 4.43Å; F324-K429 PolarHBondContact N-O 3.41Å
325	R	97.6	Very high	97.2	Very high	88 Å²	88	49.3 Å²	49.3	33%	0.332	27%	0.267	S	S	.	.			trans	-130.5	160.8	-172.4	-58.6	-62.7	-177.4	163.3	6.6	111.4	N322 F323 N329 Y330 F334 L413	N322-R325 PolarHBondContact O-NE 2.78Å; N322-R325 PolarHBondContact O-NH2 3.4Å; F323-R325 VanDerWaalsContact C-N 3.3Å; F323-R325 PolarHBondContact O-N 3.17Å; R325-N329 HydrophobicContact CB-CB 3.96Å; R325-N329 HydrophobicContact CG-CB 4.43Å; R325-Y330 HydrophobicContact CB-CD2 3.9Å; R325-Y330 HydrophobicContact CB-CE2 3.72Å; R325-F334 HydrophobicContact CB-CE1 4.22Å; R325-F334 HydrophobicContact CG-CD1 4.27Å; R325-F334 HydrophobicContact CG-CE1 3.98Å; R325-F334 HydrophobicContact CG-CE2 4.29Å; R325-F334 HydrophobicContact CG-CZ 4Å; R325-L413 WeakPolarHBondContact O-CD2 3.43Å
326	N	97.9	Very high	97	Very high	54 Å²	54	52.5 Å²	52.5	29%	0.289	29%	0.285	S	S	.	.			trans	-85.7	173.5	178.5	82.4	-46.4	0	0	0	111.6	E328 N329 Y330 D414	N326-E328 PolarHBondContact O-N 3.06Å; N326-N329 PolarHBondContact O-N 3.2Å; N326-N329 PolarHBondContact OD1-ND2 3.32Å; N326-Y330 PolarHBondContact O-N 3.33Å; N326-D414 WeakPolarHBondContact CA-OD1 3.47Å; N326-D414 HydrophobicContact CB-CB 4.41Å; N326-D414 WeakPolarHBondContact CB-OD2 3.42Å
327	W	98.3	Very high	96.7	Very high	13 Å²	13	53.5 Å²	53.5	5%	0.049	29%	0.29	C	S	.	.	H	α-helix	trans	-53.4	-49.4	-175	-176.5	-97.9	0	0	0	112.9	N329 Y330 K331 E383 F387 F410 T412 D414 R415	W327-N329 VanDerWaalsContact C-N 3.32Å; W327-N329 PolarHBondContact O-N 3.31Å; W327-Y330 CarbonylContact O-C 3.58Å; W327-Y330 PolarHBondContact O-N 3.48Å; W327-K331 WeakPolarHBondContact O-CB 3.35Å; W327-K331 PolarHBondContact O-N 3.19Å; W327-E383 HydrophobicContact CZ2-CG 4.23Å; W327-E383 PolarHBondContact NE1-OE1 2.88Å; W327-F387 AromaticContact CH2-CD2 3.79Å; W327-F387 HydrophobicContact CH2-CD2 3.79Å; W327-F387 HydrophobicContact CH2-CE2 4.37Å; W327-F387 AromaticContact CZ2-CD2 3.56Å; W327-F387 HydrophobicContact CZ2-CD2 3.56Å; W327-F387 AromaticContact CZ2-CE2 3.67Å; W327-F387 HydrophobicContact CZ2-CE2 3.67Å; W327-F410 HydrophobicContact CE3-CD1 4.36Å; W327-F410 HydrophobicContact CH2-CB 4.15Å; W327-F410 HydrophobicContact CZ3-CB 4Å; W327-F410 AromaticContact CZ3-CD1 3.86Å; W327-F410 HydrophobicContact CZ3-CD1 3.86Å; W327-F410 HydrophobicContact CZ3-CG 4.41Å; W327-F410 WeakPolarHBondContact CZ3-O 3.38Å; W327-T412 HydrophobicContact CE3-CG2 4.09Å; W327-T412 PolarHBondContact N-OG1 3.26Å; W327-D414 WeakPolarHBondContact CB-OD2 3.45Å; W327-D414 VanDerWaalsContact N-CG 3.3Å; W327-D414 PolarHBondContact N-OD1 3.43Å; W327-D414 PolarHBondContact N-OD2 2.89Å; W327-R415 HydrophobicContact CB-CB 4.33Å; W327-R415 HydrophobicContact CD2-CB 4.37Å; W327-R415 VanDerWaalsContact CD2-CD 3.41Å; W327-R415 HydrophobicContact CE3-CB 3.95Å; W327-R415 VanDerWaalsContact CE3-CD 3.46Å; W327-R415 HydrophobicContact CE3-CG 4.21Å
328	E	98.3	Very high	96.4	Very high	81 Å²	81	53.4 Å²	53.4	38%	0.379	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-36.5	-173.7	-175.6	65	-178.6	0	0	113	N326 K332	N326-E328 PolarHBondContact O-N 3.06Å; E328-K332 HydrophobicContact CG-CD 4.47Å; E328-K332 PolarHBondContact O-N 2.66Å; E328-K332 VanDerWaalsContact O-N 3.1Å; E328-K332 WeakPolarHBondContact OE1-CE 3.2Å; E328-K332 IonicContact OE1-NZ 2.67Å; E328-K332 PolarHBondContact OE1-NZ 2.96Å
329	N	98.3	Very high	96.4	Very high	64 Å²	64	50.6 Å²	50.6	34%	0.342	28%	0.28	S	S	.	.	H	α-helix	trans	-70.3	-42.5	173.1	-80.7	-72.3	0	0	0	111.3	R325 N326 W327 K331 K332 G333 F334	R325-N329 HydrophobicContact CB-CB 3.96Å; R325-N329 HydrophobicContact CG-CB 4.43Å; N326-N329 PolarHBondContact O-N 3.2Å; N326-N329 PolarHBondContact OD1-ND2 3.32Å; W327-N329 VanDerWaalsContact C-N 3.32Å; W327-N329 PolarHBondContact O-N 3.31Å; N329-K331 VanDerWaalsContact C-N 3.26Å; N329-K331 PolarHBondContact O-N 2.82Å; N329-K332 PolarHBondContact O-N 3.09Å; N329-G333 CarbonylContact O-C 3.54Å; N329-G333 WeakPolarHBondContact O-CA 3.45Å; N329-G333 PolarHBondContact O-N 2.91Å; N329-F334 HydrophobicContact CB-CD1 4.15Å; N329-F334 WeakPolarHBondContact O-CD1 3.33Å
330	Y	98.6	Very high	96.6	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-30.6	175.3	-92.3	-72.8	0	0	0	113.1	F323 R325 N326 W327 F334 W342 G344 L345 F410 T412 G431 N443	F323-Y330 WeakPolarHBondContact O-CE2 3.21Å; F323-Y330 PolarHBondContact O-OH 2.88Å; R325-Y330 HydrophobicContact CB-CD2 3.9Å; R325-Y330 HydrophobicContact CB-CE2 3.72Å; N326-Y330 PolarHBondContact O-N 3.33Å; W327-Y330 CarbonylContact O-C 3.58Å; W327-Y330 PolarHBondContact O-N 3.48Å; Y330-F334 AromaticContact CD1-CE1 3.86Å; Y330-F334 HydrophobicContact CD1-CE1 3.86Å; Y330-F334 HydrophobicContact CD1-CZ 4.38Å; Y330-F334 HydrophobicContact CD2-CE1 4.2Å; Y330-F334 AromaticContact CE1-CE1 3.75Å; Y330-F334 HydrophobicContact CE1-CE1 3.75Å; Y330-F334 AromaticContact CE1-CZ 3.8Å; Y330-F334 HydrophobicContact CE1-CZ 3.8Å; Y330-F334 HydrophobicContact CE2-CE1 4.11Å; Y330-F334 HydrophobicContact CE2-CZ 4.26Å; Y330-F334 HydrophobicContact CG-CE1 4.07Å; Y330-F334 AromaticContact CZ-CE1 3.87Å; Y330-F334 AromaticContact CZ-CZ 3.72Å; Y330-W342 AromaticContact CD1-CD1 3.72Å; Y330-W342 HydrophobicContact CD1-CD2 4.07Å; Y330-W342 AromaticContact CD1-CE2 3.77Å; Y330-W342 HydrophobicContact CD1-CG 4.06Å; Y330-W342 HydrophobicContact CD1-CZ2 4.34Å; Y330-W342 AromaticContact CD1-NE1 3.55Å; Y330-W342 HydrophobicContact CE1-CD2 4.09Å; Y330-W342 HydrophobicContact CE1-CG 4.14Å; Y330-W342 PolarHBondContact O-NE1 3.25Å; Y330-G344 WeakPolarHBondContact O-CA 3.43Å; Y330-L345 WeakPolarHBondContact O-CG 3.42Å; Y330-L345 PolarHBondContact O-N 3.44Å; Y330-F410 AromaticContact CD1-CE1 3.7Å; Y330-F410 HydrophobicContact CD1-CE1 3.7Å; Y330-F410 AromaticContact CD1-CZ 3.45Å; Y330-F410 HydrophobicContact CD1-CZ 3.45Å; Y330-F410 VanDerWaalsContact CD1-CZ 3.45Å; Y330-F410 HydrophobicContact CD2-CE1 4.32Å; Y330-F410 HydrophobicContact CE1-CE1 4.39Å; Y330-F410 AromaticContact CE1-CZ 3.89Å; Y330-F410 HydrophobicContact CE1-CZ 3.89Å; Y330-F410 AromaticContact CG-CE1 3.67Å; Y330-F410 HydrophobicContact CG-CE1 3.67Å; Y330-F410 AromaticContact CG-CZ 3.95Å; Y330-F410 HydrophobicContact CG-CZ 3.95Å; Y330-T412 HydrophobicContact CD2-CG2 3.65Å; Y330-T412 HydrophobicContact CE2-CG2 4.41Å; Y330-T412 HydrophobicContact CG-CG2 4.08Å; Y330-G431 PolarHBondContact OH-N 2.91Å; Y330-N443 WeakPolarHBondContact CE1-ND2 3.44Å
331	K	98	Very high	96.8	Very high	41 Å²	41	45.4 Å²	45.4	18%	0.178	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-52.4	174.5	-179	174.6	174	178.6	0	112	W327 N329 G344 L345 D346 E383 F387	W327-K331 WeakPolarHBondContact O-CB 3.35Å; W327-K331 PolarHBondContact O-N 3.19Å; N329-K331 VanDerWaalsContact C-N 3.26Å; N329-K331 PolarHBondContact O-N 2.82Å; K331-G344 CarbonylContact O-C 3.55Å; K331-G344 VanDerWaalsContact O-C 3.28Å; K331-G344 WeakPolarHBondContact O-CA 3.35Å; K331-L345 PolarHBondContact O-N 2.96Å; K331-D346 VanDerWaalsContact CE-CG 3.4Å; K331-D346 WeakPolarHBondContact CE-OD1 3.42Å; K331-D346 WeakPolarHBondContact CE-OD2 3.48Å; K331-D346 WeakPolarHBondContact CG-OD1 3.29Å; K331-D346 VanDerWaalsContact CG-OD2 3.28Å; K331-D346 WeakPolarHBondContact CG-OD2 3.38Å; K331-D346 PolarHBondContact O-N 3.13Å; K331-D346 VanDerWaalsContact O-N 3.11Å; K331-E383 WeakPolarHBondContact CE-OE2 3.34Å; K331-E383 IonicContact NZ-OE1 2.74Å; K331-E383 IonicContact NZ-OE2 3.17Å; K331-E383 PolarHBondContact NZ-OE2 3.33Å; K331-F387 HydrophobicContact CG-CE2 4.48Å; K331-F387 HydrophobicContact CG-CZ 4.47Å
332	K	96.6	Very high	96.8	Very high	133 Å²	133	44.4 Å²	44.4	58%	0.578	23%	0.233	S	C	*	.	H	α-helix	trans	-79.5	-26	-175.9	-77.3	172.5	166.3	162	0	115.6	E328 N329	E328-K332 HydrophobicContact CG-CD 4.47Å; E328-K332 PolarHBondContact O-N 2.66Å; E328-K332 VanDerWaalsContact O-N 3.1Å; E328-K332 WeakPolarHBondContact OE1-CE 3.2Å; E328-K332 IonicContact OE1-NZ 2.67Å; E328-K332 PolarHBondContact OE1-NZ 2.96Å; N329-K332 PolarHBondContact O-N 3.09Å
333	G	97.6	Very high	96.9	Very high	21 Å²	21	40.8 Å²	40.8	22%	0.216	21%	0.213	C	C	.	.			trans	97.4	157.1	-171.4	0	0	0	0	0	112.8	N329 W342 G344	N329-G333 CarbonylContact O-C 3.54Å; N329-G333 WeakPolarHBondContact O-CA 3.45Å; N329-G333 PolarHBondContact O-N 2.91Å; G333-W342 CarbonylContact C-O 3.55Å; G333-W342 WeakPolarHBondContact CA-O 3.47Å; G333-G344 VanDerWaalsContact CA-CA 3.45Å; G333-G344 VanDerWaalsContact N-CA 3.31Å
334	F	98.3	Very high	96.9	Very high	23 Å²	23	40.6 Å²	40.6	10%	0.101	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	160.3	-179.6	59.6	-97.4	0	0	0	112.5	V321 F323 R325 N329 Y330 H341 W342	V321-F334 HydrophobicContact CG1-CD2 3.71Å; V321-F334 HydrophobicContact CG1-CE2 3.96Å; F323-F334 HydrophobicContact CB-CE2 4.41Å; F323-F334 HydrophobicContact CB-CZ 4.39Å; F323-F334 AromaticContact CD1-CE2 3.7Å; F323-F334 HydrophobicContact CD1-CE2 3.7Å; F323-F334 AromaticContact CD1-CZ 3.64Å; F323-F334 HydrophobicContact CD1-CZ 3.64Å; F323-F334 AromaticContact CD2-CE2 3.98Å; F323-F334 HydrophobicContact CD2-CE2 3.98Å; F323-F334 AromaticContact CE1-CE2 3.85Å; F323-F334 HydrophobicContact CE1-CE2 3.85Å; F323-F334 HydrophobicContact CE1-CZ 4.02Å; F323-F334 HydrophobicContact CE2-CE2 4.11Å; F323-F334 AromaticContact CG-CE2 3.76Å; F323-F334 HydrophobicContact CG-CE2 3.76Å; F323-F334 AromaticContact CG-CZ 3.98Å; F323-F334 HydrophobicContact CG-CZ 3.98Å; F323-F334 HydrophobicContact CZ-CE2 4.05Å; R325-F334 HydrophobicContact CB-CE1 4.22Å; R325-F334 HydrophobicContact CG-CD1 4.27Å; R325-F334 HydrophobicContact CG-CE1 3.98Å; R325-F334 HydrophobicContact CG-CE2 4.29Å; R325-F334 HydrophobicContact CG-CZ 4Å; N329-F334 HydrophobicContact CB-CD1 4.15Å; N329-F334 WeakPolarHBondContact O-CD1 3.33Å; Y330-F334 AromaticContact CD1-CE1 3.86Å; Y330-F334 HydrophobicContact CD1-CE1 3.86Å; Y330-F334 HydrophobicContact CD1-CZ 4.38Å; Y330-F334 HydrophobicContact CD2-CE1 4.2Å; Y330-F334 AromaticContact CE1-CE1 3.75Å; Y330-F334 HydrophobicContact CE1-CE1 3.75Å; Y330-F334 AromaticContact CE1-CZ 3.8Å; Y330-F334 HydrophobicContact CE1-CZ 3.8Å; Y330-F334 HydrophobicContact CE2-CE1 4.11Å; Y330-F334 HydrophobicContact CE2-CZ 4.26Å; Y330-F334 HydrophobicContact CG-CE1 4.07Å; Y330-F334 AromaticContact CZ-CE1 3.87Å; Y330-F334 AromaticContact CZ-CZ 3.72Å; F334-H341 CarbonylContact O-C 3.28Å; F334-H341 VanDerWaalsContact O-CA 3.28Å; F334-H341 WeakPolarHBondContact O-CA 3.16Å; F334-H341 WeakPolarHBondContact O-CB 3.26Å; F334-W342 HydrophobicContact CD1-CB 4.1Å; F334-W342 HydrophobicContact CD2-CB 4.34Å; F334-W342 HydrophobicContact CE1-CB 3.73Å; F334-W342 AromaticContact CE1-CD1 3.93Å; F334-W342 HydrophobicContact CE1-CG 4.01Å; F334-W342 HydrophobicContact CE2-CB 3.97Å; F334-W342 HydrophobicContact CG-CB 4.4Å; F334-W342 HydrophobicContact CZ-CB 3.66Å; F334-W342 HydrophobicContact CZ-CG 4.26Å; F334-W342 PolarHBondContact N-O 3.26Å; F334-W342 PolarHBondContact O-N 2.57Å
335	G	96.6	Very high	96.9	Very high	50 Å²	50	37 Å²	37	52%	0.515	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	102.9	-151.3	179.6	0	0	0	0	0	112.4	E340	G335-E340 CarbonylContact C-O 3.48Å; G335-E340 WeakPolarHBondContact CA-O 3.49Å
336	N	93.8	Very high	96.8	Very high	89 Å²	89	35.3 Å²	35.3	48%	0.476	19%	0.194	S	C	.	.			trans	-129.3	130.2	176.2	176.3	-4.2	0	0	0	109.1	D338 G339 E340 H341	N336-D338 PolarHBondContact O-N 3.31Å; N336-D338 PolarHBondContact OD1-N 3.26Å; N336-G339 CarbonylContact O-C 3.39Å; N336-G339 VanDerWaalsContact O-C 3.22Å; N336-G339 VanDerWaalsContact O-CA 3.29Å; N336-G339 WeakPolarHBondContact O-CA 3.28Å; N336-G339 PolarHBondContact O-N 3Å; N336-E340 PolarHBondContact N-O 3.38Å; N336-E340 CarbonylContact O-C 3.45Å; N336-H341 WeakPolarHBondContact O-CB 3.5Å; N336-H341 PolarHBondContact O-ND1 3.44Å
337	I	92.8	Very high	96.7	Very high	26 Å²	26	34.4 Å²	34.4	13%	0.133	19%	0.189	C	C	.	.	S	Bend	trans	-58.6	-34.3	-177.8	-56.1	-56.1	0	0	0	112.2	M285 Q298 W300 H341 L343	M285-I337 HydrophobicContact CG-CB 4.33Å; M285-I337 HydrophobicContact CG-CG2 3.88Å; M285-I337 HydrophobicContact SD-CB 3.95Å; M285-I337 HydrophobicContact SD-CG2 4.16Å; Q298-I337 HydrophobicContact CG-CG1 4.27Å; W300-I337 HydrophobicContact CB-CG2 3.82Å; W300-I337 VanDerWaalsContact N-CG2 3.27Å; I337-H341 WeakPolarHBondContact CA-ND1 3.35Å; I337-H341 PolarHBondContact O-CE1 2.92Å; I337-H341 PolarHBondContact O-ND1 3.46Å; I337-L343 HydrophobicContact CD1-CD1 4.43Å
338	D	89.3	Confident	96.6	Very high	75 Å²	75	33.8 Å²	33.8	40%	0.401	19%	0.187	S	C	.	.	S	Bend	trans	-81.4	-31.4	170.5	-177.5	29.6	0	0	0	112.9	M285 W300 K315 K317 N336	M285-D338 HydrophobicContact SD-CB 4.25Å; W300-D338 HydrophobicContact CE3-CB 4.4Å; W300-D338 HydrophobicContact CZ3-CB 3.99Å; W300-D338 VanDerWaalsContact CZ3-OD1 3.23Å; W300-D338 WeakPolarHBondContact CZ3-OD1 2.95Å; K315-D338 PolarHBondContact NZ-O 2.91Å; K317-D338 PolarHBondContact NZ-O 3.46Å; K317-D338 VanDerWaalsContact NZ-O 3.12Å; N336-D338 PolarHBondContact O-N 3.31Å; N336-D338 PolarHBondContact OD1-N 3.26Å
339	G	94.1	Very high	96.5	Very high	8 Å²	8	32 Å²	32	8%	0.082	18%	0.177	C	C	.	.	S	Bend	trans	-77.8	-147.4	175.7	0	0	0	0	0	114.6	K315 N336	K315-G339 VanDerWaalsContact CD-O 3.23Å; K315-G339 WeakPolarHBondContact CD-O 3.2Å; K315-G339 WeakPolarHBondContact CE-O 3.48Å; N336-G339 CarbonylContact O-C 3.39Å; N336-G339 VanDerWaalsContact O-C 3.22Å; N336-G339 VanDerWaalsContact O-CA 3.29Å; N336-G339 WeakPolarHBondContact O-CA 3.28Å; N336-G339 PolarHBondContact O-N 3Å
340	E	97.8	Very high	96.3	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-79.8	143.4	158.1	-63.3	-165.5	151	0	0	110.2	K315 R316 K317 D318 G319 V321 F323 G335 N336	K315-E340 WeakPolarHBondContact O-CA 3.45Å; K315-E340 VanDerWaalsContact O-CB 3.31Å; K315-E340 WeakPolarHBondContact O-CB 3.11Å; R316-E340 WeakPolarHBondContact CA-OE1 3.45Å; R316-E340 IonicContact NE-OE1 2.68Å; R316-E340 IonicContact NE-OE2 3.7Å; K317-E340 HydrophobicContact CG-CG 4.11Å; K317-E340 PolarHBondContact N-OE1 3.35Å; D318-E340 PolarHBondContact N-OE1 3.31Å; D318-E340 WeakPolarHBondContact OD1-CG 3.23Å; G319-E340 PolarHBondContact N-OE1 3.39Å; V321-E340 HydrophobicContact CB-CB 3.93Å; V321-E340 HydrophobicContact CG2-CB 3.92Å; V321-E340 WeakPolarHBondContact CG2-O 3.39Å; V321-E340 PolarHBondContact N-OE2 2.89Å; F323-E340 HydrophobicContact CE2-CB 4.25Å; G335-E340 CarbonylContact C-O 3.48Å; G335-E340 WeakPolarHBondContact CA-O 3.49Å; N336-E340 PolarHBondContact N-O 3.38Å; N336-E340 CarbonylContact O-C 3.45Å
341	H	98.3	Very high	96.1	Very high	1 Å²	1	30 Å²	30	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	163	176.1	57.8	-92.3	0	0	0	113.6	Q314 K315 F334 N336 I337	Q314-H341 WeakPolarHBondContact CA-O 3.31Å; K315-H341 PolarHBondContact N-O 3.5Å; K315-H341 VanDerWaalsContact N-O 3.09Å; K315-H341 PolarHBondContact O-N 2.79Å; K315-H341 VanDerWaalsContact O-N 3.15Å; F334-H341 CarbonylContact O-C 3.28Å; F334-H341 VanDerWaalsContact O-CA 3.28Å; F334-H341 WeakPolarHBondContact O-CA 3.16Å; F334-H341 WeakPolarHBondContact O-CB 3.26Å; N336-H341 WeakPolarHBondContact O-CB 3.5Å; N336-H341 PolarHBondContact O-ND1 3.44Å; I337-H341 WeakPolarHBondContact CA-ND1 3.35Å; I337-H341 PolarHBondContact O-CE1 2.92Å; I337-H341 PolarHBondContact O-ND1 3.46Å
342	W	98.6	Very high	95.9	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.008	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124.1	159.5	176.1	-104.4	0	0	0	108	Q314 F323 Y330 G333 F334 G344 L345 I348 F410 W432 W433 N443 L477	Q314-W342 HydrophobicContact CB-CE3 3.8Å; Q314-W342 HydrophobicContact CB-CZ3 4.05Å; Q314-W342 HydrophobicContact CG-CE3 3.77Å; Q314-W342 HydrophobicContact CG-CZ3 4.21Å; F323-W342 HydrophobicContact CE1-CB 4.03Å; Y330-W342 AromaticContact CD1-CD1 3.72Å; Y330-W342 HydrophobicContact CD1-CD2 4.07Å; Y330-W342 AromaticContact CD1-CE2 3.77Å; Y330-W342 HydrophobicContact CD1-CG 4.06Å; Y330-W342 HydrophobicContact CD1-CZ2 4.34Å; Y330-W342 AromaticContact CD1-NE1 3.55Å; Y330-W342 HydrophobicContact CE1-CD2 4.09Å; Y330-W342 HydrophobicContact CE1-CG 4.14Å; Y330-W342 PolarHBondContact O-NE1 3.25Å; G333-W342 CarbonylContact C-O 3.55Å; G333-W342 WeakPolarHBondContact CA-O 3.47Å; F334-W342 HydrophobicContact CD1-CB 4.1Å; F334-W342 HydrophobicContact CD2-CB 4.34Å; F334-W342 HydrophobicContact CE1-CB 3.73Å; F334-W342 AromaticContact CE1-CD1 3.93Å; F334-W342 HydrophobicContact CE1-CG 4.01Å; F334-W342 HydrophobicContact CE2-CB 3.97Å; F334-W342 HydrophobicContact CG-CB 4.4Å; F334-W342 HydrophobicContact CZ-CB 3.66Å; F334-W342 HydrophobicContact CZ-CG 4.26Å; F334-W342 PolarHBondContact N-O 3.26Å; F334-W342 PolarHBondContact O-N 2.57Å; W342-G344 VanDerWaalsContact C-N 3.25Å; W342-G344 VanDerWaalsContact CD1-N 3.33Å; W342-G344 PolarHBondContact O-N 2.92Å; W342-L345 HydrophobicContact CZ2-CD2 3.76Å; W342-L345 HydrophobicContact CZ2-CG 4.06Å; W342-I348 HydrophobicContact CD2-CD1 4.43Å; W342-I348 HydrophobicContact CH2-CD1 3.86Å; W342-I348 HydrophobicContact CZ2-CD1 3.51Å; W342-I348 HydrophobicContact CZ3-CD1 4.43Å; W342-F410 HydrophobicContact CH2-CE2 4.15Å; W342-F410 HydrophobicContact CZ2-CE2 4.04Å; W342-F410 HydrophobicContact CZ2-CZ 4.14Å; W342-W432 HydrophobicContact CZ3-CZ3 4.35Å; W342-W433 AromaticContact CH2-CH2 3.8Å; W342-W433 HydrophobicContact CH2-CH2 3.8Å; W342-W433 HydrophobicContact CH2-CZ3 4.2Å; W342-N443 WeakPolarHBondContact CZ3-ND2 3.44Å; W342-L477 HydrophobicContact CZ3-CD2 4.34Å
343	L	97.9	Very high	95.7	Very high	7 Å²	7	26.2 Å²	26.2	4%	0.037	15%	0.152	C	C	.	.			trans	-68.6	-21.2	-173.2	-175	60.9	0	0	0	113.8	I297 V299 L313 I337 N347 I348 L351	I297-L343 HydrophobicContact CG2-CD1 3.97Å; V299-L343 HydrophobicContact CG1-CD1 4.01Å; V299-L343 HydrophobicContact CG1-CD2 4.06Å; L313-L343 HydrophobicContact CD2-CD2 3.72Å; L313-L343 VanDerWaalsContact O-CB 3.31Å; L313-L343 WeakPolarHBondContact O-CB 3.27Å; L313-L343 PolarHBondContact O-N 3.05Å; I337-L343 HydrophobicContact CD1-CD1 4.43Å; L343-N347 HydrophobicContact CD2-CB 4.44Å; L343-N347 HydrophobicContact CG-CB 3.95Å; L343-N347 PolarHBondContact O-ND2 2.94Å; L343-I348 HydrophobicContact CB-CG1 4.22Å; L343-I348 HydrophobicContact CD2-CG1 4.49Å; L343-L351 HydrophobicContact CD2-CD1 3.7Å
344	G	97.8	Very high	95.4	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.			trans	101.6	133.5	-178.2	0	0	0	0	0	112.7	Y330 K331 G333 W342 D346 N347 I348	Y330-G344 WeakPolarHBondContact O-CA 3.43Å; K331-G344 CarbonylContact O-C 3.55Å; K331-G344 VanDerWaalsContact O-C 3.28Å; K331-G344 WeakPolarHBondContact O-CA 3.35Å; G333-G344 VanDerWaalsContact CA-CA 3.45Å; G333-G344 VanDerWaalsContact N-CA 3.31Å; W342-G344 VanDerWaalsContact C-N 3.25Å; W342-G344 VanDerWaalsContact CD1-N 3.33Å; W342-G344 PolarHBondContact O-N 2.92Å; G344-D346 VanDerWaalsContact C-N 3.29Å; G344-D346 PolarHBondContact O-N 2.78Å; G344-N347 PolarHBondContact O-N 2.89Å; G344-N347 VanDerWaalsContact O-N 3.14Å; G344-I348 WeakPolarHBondContact O-CD1 3.43Å; G344-I348 WeakPolarHBondContact O-CG1 3.37Å; G344-I348 PolarHBondContact O-N 3.45Å
345	L	98.2	Very high	95.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61	-34.8	-177.5	-66.1	157.8	0	0	0	112.8	Y330 K331 W342 N347 I348 Y349 L380 F387 F410 W433	Y330-L345 WeakPolarHBondContact O-CG 3.42Å; Y330-L345 PolarHBondContact O-N 3.44Å; K331-L345 PolarHBondContact O-N 2.96Å; W342-L345 HydrophobicContact CZ2-CD2 3.76Å; W342-L345 HydrophobicContact CZ2-CG 4.06Å; L345-N347 VanDerWaalsContact C-N 3.34Å; L345-N347 PolarHBondContact O-N 3.15Å; L345-I348 PolarHBondContact O-N 2.82Å; L345-Y349 WeakPolarHBondContact O-CB 3.22Å; L345-Y349 PolarHBondContact O-N 2.89Å; L345-L380 HydrophobicContact CD2-CD1 4.25Å; L345-F387 HydrophobicContact CB-CB 4.49Å; L345-F387 HydrophobicContact CB-CD1 3.9Å; L345-F387 HydrophobicContact CB-CD2 3.71Å; L345-F387 HydrophobicContact CB-CE1 3.92Å; L345-F387 HydrophobicContact CB-CE2 3.72Å; L345-F387 HydrophobicContact CB-CG 3.78Å; L345-F387 HydrophobicContact CB-CZ 3.82Å; L345-F387 HydrophobicContact CD1-CD2 3.68Å; L345-F387 HydrophobicContact CD1-CE2 4.11Å; L345-F387 HydrophobicContact CD1-CG 4.24Å; L345-F387 HydrophobicContact CD2-CB 3.92Å; L345-F387 HydrophobicContact CD2-CD2 4.42Å; L345-F387 HydrophobicContact CD2-CG 4.14Å; L345-F387 HydrophobicContact CG-CD2 4.13Å; L345-F387 HydrophobicContact CG-CG 4.27Å; L345-F410 HydrophobicContact CD1-CB 4.43Å; L345-F410 HydrophobicContact CD1-CD1 3.65Å; L345-F410 HydrophobicContact CD1-CD2 4.36Å; L345-F410 HydrophobicContact CD1-CE1 3.87Å; L345-F410 HydrophobicContact CD1-CG 3.9Å; L345-F410 HydrophobicContact CD1-CZ 4.3Å; L345-F410 HydrophobicContact CD2-CD2 3.86Å; L345-F410 HydrophobicContact CD2-CE2 4.03Å; L345-F410 HydrophobicContact CD2-CG 4.14Å; L345-F410 HydrophobicContact CD2-CZ 4.47Å; L345-W433 HydrophobicContact CD2-CZ2 4.15Å
346	D	95.8	Very high	95	Very high	53 Å²	53	30 Å²	30	28%	0.283	17%	0.165	S	C	.	.	H	α-helix	trans	-61.9	-43.3	175.3	-74.9	-19.9	0	0	0	111.4	K331 G344 S350 F387	K331-D346 VanDerWaalsContact CE-CG 3.4Å; K331-D346 WeakPolarHBondContact CE-OD1 3.42Å; K331-D346 WeakPolarHBondContact CE-OD2 3.48Å; K331-D346 WeakPolarHBondContact CG-OD1 3.29Å; K331-D346 VanDerWaalsContact CG-OD2 3.28Å; K331-D346 WeakPolarHBondContact CG-OD2 3.38Å; K331-D346 PolarHBondContact O-N 3.13Å; K331-D346 VanDerWaalsContact O-N 3.11Å; G344-D346 VanDerWaalsContact C-N 3.29Å; G344-D346 PolarHBondContact O-N 2.78Å; D346-S350 WeakPolarHBondContact O-CB 3.43Å; D346-S350 PolarHBondContact O-N 2.92Å; D346-S350 PolarHBondContact O-OG 2.77Å; D346-F387 WeakPolarHBondContact OD1-CZ 3.31Å
347	N	95.4	Very high	95.2	Very high	35 Å²	35	25.8 Å²	25.8	19%	0.187	14%	0.142	C	C	.	.	H	α-helix	trans	-71.2	-43.2	-179.7	-66.9	-30.9	0	0	0	111.3	I297 L343 G344 L345 S350 L351	I297-N347 HydrophobicContact CD1-CB 4.03Å; I297-N347 WeakPolarHBondContact CD1-OD1 3.45Å; I297-N347 HydrophobicContact CG2-CB 4.21Å; L343-N347 HydrophobicContact CD2-CB 4.44Å; L343-N347 HydrophobicContact CG-CB 3.95Å; L343-N347 PolarHBondContact O-ND2 2.94Å; G344-N347 PolarHBondContact O-N 2.89Å; G344-N347 VanDerWaalsContact O-N 3.14Å; L345-N347 VanDerWaalsContact C-N 3.34Å; L345-N347 PolarHBondContact O-N 3.15Å; N347-S350 PolarHBondContact O-N 2.91Å; N347-L351 WeakPolarHBondContact O-CB 3.4Å; N347-L351 WeakPolarHBondContact O-CG 3.42Å; N347-L351 PolarHBondContact O-N 3.27Å
348	I	97	Very high	95.4	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-64.2	-43.1	177.2	-62.2	161.4	0	0	0	110.7	L313 W342 L343 G344 L345 A352 F378 L380	L313-I348 HydrophobicContact CB-CD1 4.38Å; L313-I348 HydrophobicContact CB-CG1 4.27Å; L313-I348 HydrophobicContact CD1-CG1 4.34Å; L313-I348 HydrophobicContact CD1-CG2 3.85Å; L313-I348 HydrophobicContact CD2-CG1 4.16Å; L313-I348 HydrophobicContact CG-CG1 4.49Å; W342-I348 HydrophobicContact CD2-CD1 4.43Å; W342-I348 HydrophobicContact CH2-CD1 3.86Å; W342-I348 HydrophobicContact CZ2-CD1 3.51Å; W342-I348 HydrophobicContact CZ3-CD1 4.43Å; L343-I348 HydrophobicContact CB-CG1 4.22Å; L343-I348 HydrophobicContact CD2-CG1 4.49Å; G344-I348 WeakPolarHBondContact O-CD1 3.43Å; G344-I348 WeakPolarHBondContact O-CG1 3.37Å; G344-I348 PolarHBondContact O-N 3.45Å; L345-I348 PolarHBondContact O-N 2.82Å; I348-A352 VanDerWaalsContact O-CB 3.23Å; I348-A352 WeakPolarHBondContact O-CB 3.46Å; I348-A352 PolarHBondContact O-N 3.38Å; I348-F378 HydrophobicContact CG2-CE1 3.81Å; I348-F378 HydrophobicContact CG2-CZ 3.79Å; I348-L380 HydrophobicContact CB-CD1 4.13Å; I348-L380 HydrophobicContact CG2-CD1 3.56Å; I348-L380 HydrophobicContact CG2-CG 4.3Å
349	Y	96.2	Very high	95.8	Very high	42 Å²	42	22.1 Å²	22.1	17%	0.165	12%	0.122	C	C	.	.	H	α-helix	trans	-62	-45.7	174.2	165.7	-110.7	0	0	0	111.7	L345 L351 A352 K353 L380 P382 F387	L345-Y349 WeakPolarHBondContact O-CB 3.22Å; L345-Y349 PolarHBondContact O-N 2.89Å; Y349-L351 VanDerWaalsContact C-N 3.35Å; Y349-L351 PolarHBondContact O-N 3Å; Y349-A352 PolarHBondContact O-N 2.98Å; Y349-K353 HydrophobicContact CE1-CD 4.38Å; Y349-K353 HydrophobicContact CE2-CD 3.83Å; Y349-K353 WeakPolarHBondContact O-CB 3.42Å; Y349-K353 PolarHBondContact O-N 2.66Å; Y349-K353 WeakPolarHBondContact OH-CD 3.36Å; Y349-K353 PolarHBondContact OH-NZ 3.26Å; Y349-L380 VanDerWaalsContact CD2-O 3.28Å; Y349-L380 WeakPolarHBondContact CD2-O 3.34Å; Y349-P382 HydrophobicContact CE2-CB 4.21Å; Y349-F387 HydrophobicContact CG-CE1 4.4Å
350	S	94.5	Very high	96	Very high	23 Å²	23	22.5 Å²	22.5	16%	0.161	12%	0.122	C	C	.	.	H	α-helix	trans	-63	-39.8	179.9	-57.7	0	0	0	0	112.5	D346 N347	D346-S350 WeakPolarHBondContact O-CB 3.43Å; D346-S350 PolarHBondContact O-N 2.92Å; D346-S350 PolarHBondContact O-OG 2.77Å; N347-S350 PolarHBondContact O-N 2.91Å
351	L	94.4	Very high	96	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-55.3	172.1	-75.8	162.3	0	0	0	111.6	L288 T290 T311 L313 L343 N347 Y349 K353 Q354 Y357 I479	L288-L351 HydrophobicContact CD1-CD2 3.95Å; T290-L351 HydrophobicContact CG2-CB 4.5Å; T290-L351 HydrophobicContact CG2-CD2 3.71Å; T290-L351 HydrophobicContact CG2-CG 3.81Å; T311-L351 HydrophobicContact CG2-CD1 4.05Å; L313-L351 HydrophobicContact CD2-CD1 4.22Å; L343-L351 HydrophobicContact CD2-CD1 3.7Å; N347-L351 WeakPolarHBondContact O-CB 3.4Å; N347-L351 WeakPolarHBondContact O-CG 3.42Å; N347-L351 PolarHBondContact O-N 3.27Å; Y349-L351 VanDerWaalsContact C-N 3.35Å; Y349-L351 PolarHBondContact O-N 3Å; L351-K353 PolarHBondContact O-N 3.42Å; L351-K353 VanDerWaalsContact O-N 3.14Å; L351-Q354 WeakPolarHBondContact O-CG 3.44Å; L351-Q354 PolarHBondContact O-N 3.36Å; L351-Y357 WeakPolarHBondContact O-CE2 3.28Å; L351-I479 HydrophobicContact CB-CD1 4.12Å
352	A	93.4	Very high	96	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-15.9	-174.3	0	0	0	0	0	113.8	I348 Y349 F378 Y379	I348-A352 VanDerWaalsContact O-CB 3.23Å; I348-A352 WeakPolarHBondContact O-CB 3.46Å; I348-A352 PolarHBondContact O-N 3.38Å; Y349-A352 PolarHBondContact O-N 2.98Å; A352-F378 HydrophobicContact CB-CD1 4.12Å; A352-F378 HydrophobicContact CB-CE1 4.01Å; A352-Y379 WeakPolarHBondContact O-CD2 3.36Å
353	K	92.7	Very high	95.9	Very high	93 Å²	93	23.1 Å²	23.1	40%	0.404	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-16.3	177.3	-176.7	169.2	-178.5	-179.8	0	114.5	Y349 L351 G355 Y379	Y349-K353 HydrophobicContact CE1-CD 4.38Å; Y349-K353 HydrophobicContact CE2-CD 3.83Å; Y349-K353 WeakPolarHBondContact O-CB 3.42Å; Y349-K353 PolarHBondContact O-N 2.66Å; Y349-K353 WeakPolarHBondContact OH-CD 3.36Å; Y349-K353 PolarHBondContact OH-NZ 3.26Å; L351-K353 PolarHBondContact O-N 3.42Å; L351-K353 VanDerWaalsContact O-N 3.14Å; K353-G355 PolarHBondContact O-N 2.87Å; K353-Y379 HydrophobicContact CB-CE2 4.21Å; K353-Y379 HydrophobicContact CG-CE2 4.37Å
354	Q	91.3	Very high	95.9	Very high	16 Å²	16	24.1 Å²	24.1	8%	0.075	13%	0.129	C	C	.	.	S	Bend	trans	-85.9	13.9	-173.1	84	-163.8	-8.6	0	0	114.9	K270 D291 L351 Y357	K270-Q354 HydrophobicContact CD-CG 4.42Å; K270-Q354 PolarHBondContact NZ-O 3.14Å; K270-Q354 PolarHBondContact O-NE2 2.95Å; D291-Q354 HydrophobicContact CB-CB 4.1Å; L351-Q354 WeakPolarHBondContact O-CG 3.44Å; L351-Q354 PolarHBondContact O-N 3.36Å; Q354-Y357 HydrophobicContact CG-CE2 4.14Å; Q354-Y357 WeakPolarHBondContact CG-OH 3.47Å; Q354-Y357 PolarHBondContact NE2-OH 3.24Å
355	G	91.6	Very high	95.9	Very high	38 Å²	38	24.6 Å²	24.6	39%	0.392	13%	0.132	S	C	.	.	S	Bend	trans	154	-179.4	-179.1	0	0	0	0	0	110.7	K353 Y357	K353-G355 PolarHBondContact O-N 2.87Å; G355-Y357 WeakPolarHBondContact O-CD2 3.42Å; G355-Y357 WeakPolarHBondContact O-CE2 3.46Å
356	D	94.9	Very high	95.7	Very high	119 Å²	119	28.2 Å²	28.2	64%	0.636	15%	0.145	S	C	*	.			trans	-82.1	127.1	175.6	-62.1	-73.7	0	0	0	111.3	P481 I482	D356-P481 WeakPolarHBondContact O-CA 3.42Å; D356-I482 HydrophobicContact CB-CD1 3.82Å; D356-I482 HydrophobicContact CB-CG1 4.27Å; D356-I482 PolarHBondContact O-N 3.42Å
357	Y	97	Very high	95.7	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.008	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141.2	178.7	-71.4	-100.2	0	0	0	111.1	D271 L351 Q354 G355 S377 F378 I479 R480 P481	D271-Y357 HydrophobicContact CB-CE1 4.47Å; D271-Y357 PolarHBondContact OD2-OH 2.91Å; L351-Y357 WeakPolarHBondContact O-CE2 3.28Å; Q354-Y357 HydrophobicContact CG-CE2 4.14Å; Q354-Y357 WeakPolarHBondContact CG-OH 3.47Å; Q354-Y357 PolarHBondContact NE2-OH 3.24Å; G355-Y357 WeakPolarHBondContact O-CD2 3.42Å; G355-Y357 WeakPolarHBondContact O-CE2 3.46Å; Y357-S377 CarbonylContact O-C 3.55Å; Y357-S377 VanDerWaalsContact O-CA 3.3Å; Y357-S377 WeakPolarHBondContact O-CA 3.47Å; Y357-F378 PolarHBondContact O-N 2.76Å; Y357-I479 HydrophobicContact CD1-CB 4.07Å; Y357-I479 HydrophobicContact CD1-CD1 3.8Å; Y357-I479 HydrophobicContact CD1-CG1 4.04Å; Y357-I479 HydrophobicContact CE1-CD1 4.26Å; Y357-I479 HydrophobicContact CG-CD1 4.2Å; Y357-R480 CarbonylContact C-O 3.56Å; Y357-R480 VanDerWaalsContact CA-O 3.31Å; Y357-R480 WeakPolarHBondContact CA-O 3.28Å; Y357-R480 VanDerWaalsContact CD1-C 3.41Å; Y357-P481 HydrophobicContact CD1-CG 4.25Å; Y357-P481 HydrophobicContact CE1-CG 3.7Å
358	K	96.8	Very high	95.7	Very high	23 Å²	23	31.5 Å²	31.5	10%	0.1	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	147.9	160.3	64	168.4	-172.1	152	0	110.7	D306 W310 E374 Y375 I479 R480 I482	D306-K358 IonicContact OD2-NZ 3.46Å; D306-K358 PolarHBondContact OD2-NZ 3.21Å; W310-K358 HydrophobicContact CH2-CD 4.05Å; W310-K358 VanDerWaalsContact CH2-CE 3.43Å; W310-K358 HydrophobicContact CH2-CG 4.12Å; W310-K358 HydrophobicContact CZ3-CG 4.26Å; K358-E374 HydrophobicContact CD-CG 4.35Å; K358-E374 WeakPolarHBondContact CD-OE1 3.5Å; K358-E374 IonicContact NZ-OE1 3.94Å; K358-E374 PolarHBondContact NZ-OE1 3.16Å; K358-E374 IonicContact NZ-OE2 2.91Å; K358-E374 PolarHBondContact NZ-OE2 3.01Å; K358-Y375 WeakPolarHBondContact CA-O 3.1Å; K358-Y375 WeakPolarHBondContact CB-O 3.45Å; K358-I479 WeakPolarHBondContact O-CA 3.43Å; K358-R480 PolarHBondContact N-O 3.28Å; K358-R480 PolarHBondContact O-N 3.08Å; K358-R480 VanDerWaalsContact O-N 3.11Å; K358-I482 HydrophobicContact CB-CG1 4.33Å
359	L	97.8	Very high	95.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.9	177.4	171.4	74.3	0	0	0	110.5	V361 E374 Y375 F378 L391 F402 L477 I479	L359-V361 HydrophobicContact CD2-CG2 4.33Å; L359-V361 HydrophobicContact CG-CG2 4.45Å; L359-E374 CarbonylContact O-C 3.57Å; L359-E374 VanDerWaalsContact O-CA 3.24Å; L359-E374 WeakPolarHBondContact O-CA 3.39Å; L359-Y375 HydrophobicContact CD2-CD2 4.09Å; L359-Y375 PolarHBondContact N-O 2.85Å; L359-Y375 PolarHBondContact O-N 2.87Å; L359-F378 HydrophobicContact CB-CB 3.6Å; L359-F378 HydrophobicContact CB-CD2 4.18Å; L359-F378 HydrophobicContact CB-CG 3.97Å; L359-F378 HydrophobicContact CD1-CD2 4.39Å; L359-F378 HydrophobicContact CD2-CD2 3.81Å; L359-F378 HydrophobicContact CD2-CE2 4.32Å; L359-F378 HydrophobicContact CD2-CG 4.45Å; L359-F378 HydrophobicContact CG-CD2 4.35Å; L359-L391 HydrophobicContact CD2-CD2 3.9Å; L359-F402 HydrophobicContact CD2-CD1 4.09Å; L359-F402 HydrophobicContact CD2-CE1 3.73Å; L359-L477 HydrophobicContact CD1-CD1 3.75Å; L359-L477 HydrophobicContact CD1-CG 3.9Å; L359-L477 HydrophobicContact CD2-CD1 4.17Å; L359-L477 HydrophobicContact CG-CD1 4.37Å; L359-I479 HydrophobicContact CB-CG2 4.28Å; L359-I479 HydrophobicContact CD1-CG2 3.73Å
360	M	97.7	Very high	95.7	Very high	17 Å²	17	39.3 Å²	39.3	8%	0.084	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133	167.9	-178.4	64.6	81.1	0	0	110.6	W310 Y372 E374 M478	W310-M360 HydrophobicContact CE3-CB 3.95Å; W310-M360 HydrophobicContact CH2-CB 3.55Å; W310-M360 HydrophobicContact CH2-CE 4.28Å; W310-M360 HydrophobicContact CH2-CG 4.42Å; W310-M360 HydrophobicContact CZ2-CB 4.15Å; W310-M360 HydrophobicContact CZ2-CE 4.23Å; W310-M360 HydrophobicContact CZ3-CB 3.45Å; W310-M360 VanDerWaalsContact CZ3-CB 3.45Å; M360-Y372 HydrophobicContact CE-CD2 3.9Å; M360-Y372 HydrophobicContact CE-CE2 4.4Å; M360-Y372 HydrophobicContact SD-CD2 3.6Å; M360-Y372 HydrophobicContact SD-CG 4.03Å; M360-E374 HydrophobicContact CE-CB 4.06Å; M360-E374 HydrophobicContact CE-CG 4.45Å; M360-E374 WeakPolarHBondContact CE-OE2 3.43Å; M360-E374 HydrophobicContact SD-CB 4.15Å; M360-M478 HydrophobicContact CB-CE 4.1Å; M360-M478 HydrophobicContact CB-CG 4.03Å; M360-M478 HydrophobicContact CG-CE 3.54Å; M360-M478 HydrophobicContact CG-CG 4.47Å; M360-M478 PolarHBondContact N-O 3.45Å; M360-M478 PolarHBondContact O-N 3.17Å
361	V	98.2	Very high	95.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	113.1	167.5	-158.1	0	0	0	0	108.1	L359 L363 Y372 A373 Y375 L442 W462 R476 L477	L359-V361 HydrophobicContact CD2-CG2 4.33Å; L359-V361 HydrophobicContact CG-CG2 4.45Å; V361-L363 HydrophobicContact CG1-CD2 3.66Å; V361-Y372 CarbonylContact O-C 3.58Å; V361-Y372 WeakPolarHBondContact O-CA 3.4Å; V361-A373 HydrophobicContact CB-CB 4.28Å; V361-A373 HydrophobicContact CG2-CB 4.35Å; V361-A373 PolarHBondContact N-O 2.99Å; V361-A373 PolarHBondContact O-N 3.42Å; V361-Y375 HydrophobicContact CG2-CE2 4.17Å; V361-L442 HydrophobicContact CG1-CD1 3.56Å; V361-W462 HydrophobicContact CB-CZ3 4.43Å; V361-W462 HydrophobicContact CG1-CZ3 4.11Å; V361-W462 HydrophobicContact CG2-CH2 4.17Å; V361-W462 HydrophobicContact CG2-CZ3 4.25Å; V361-R476 CarbonylContact C-O 3.57Å; V361-R476 WeakPolarHBondContact CA-O 3.27Å; V361-L477 HydrophobicContact CG1-CD1 4.25Å; V361-L477 HydrophobicContact CG2-CD1 3.9Å
362	E	97.7	Very high	96	Very high	15 Å²	15	42.8 Å²	42.8	7%	0.07	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.2	169.2	-169.9	-154.6	-133	0	0	109.1	K370 V475 R476 M478	E362-K370 IonicContact OE1-NZ 2.66Å; E362-K370 PolarHBondContact OE1-NZ 2.88Å; E362-K370 IonicContact OE2-NZ 3.77Å; E362-K370 PolarHBondContact OE2-NZ 3.14Å; E362-V475 WeakPolarHBondContact O-CA 3.47Å; E362-R476 HydrophobicContact CB-CB 4.38Å; E362-R476 PolarHBondContact N-O 3.22Å; E362-R476 PolarHBondContact O-N 3.01Å; E362-R476 IonicContact OE1-CZ 2.65Å; E362-R476 IonicContact OE1-NH2 2.67Å; E362-R476 PolarHBondContact OE1-NH2 3.39Å; E362-R476 IonicContact OE2-CZ 3.83Å; E362-R476 IonicContact OE2-NE 2.67Å; E362-R476 PolarHBondContact OE2-NE 2.93Å; E362-R476 IonicContact OE2-NH2 2.64Å; E362-R476 PolarHBondContact OE2-NH2 3.03Å; E362-M478 HydrophobicContact CB-CE 4.21Å
363	L	98.1	Very high	96.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.5	177.7	-44.6	177.1	0	0	0	109.5	V361 K370 V371 A398 L442 W462 L472 V475	V361-L363 HydrophobicContact CG1-CD2 3.66Å; L363-K370 VanDerWaalsContact O-CA 3.32Å; L363-K370 WeakPolarHBondContact O-CA 3.17Å; L363-V371 HydrophobicContact CB-CG2 3.93Å; L363-V371 HydrophobicContact CD1-CG2 4.15Å; L363-V371 HydrophobicContact CG-CG2 4.42Å; L363-V371 PolarHBondContact N-O 2.8Å; L363-V371 PolarHBondContact O-N 2.6Å; L363-A398 HydrophobicContact CD1-CB 3.93Å; L363-L442 HydrophobicContact CD2-CD2 4.1Å; L363-W462 HydrophobicContact CD1-CB 3.8Å; L363-W462 HydrophobicContact CD1-CD2 3.84Å; L363-W462 HydrophobicContact CD1-CE3 4.22Å; L363-W462 HydrophobicContact CD1-CG 3.66Å; L363-W462 HydrophobicContact CD2-CE3 4.49Å; L363-L472 HydrophobicContact CB-CD1 4.05Å; L363-L472 HydrophobicContact CB-CD2 4.43Å; L363-L472 HydrophobicContact CD1-CD1 4.04Å; L363-L472 HydrophobicContact CD2-CD1 3.83Å; L363-L472 HydrophobicContact CG-CD1 4.19Å; L363-V475 HydrophobicContact CD2-CG1 4.11Å; L363-V475 HydrophobicContact CD2-CG2 3.97Å
364	E	97.8	Very high	96.5	Very high	28 Å²	28	39.9 Å²	39.9	13%	0.131	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.3	171.7	-165.6	-175.2	126.5	0	0	110.3	K369 K370 K473 S474	E364-K369 WeakPolarHBondContact CA-O 3.48Å; E364-K370 HydrophobicContact CB-CG 4.16Å; E364-K370 HydrophobicContact CG-CG 3.9Å; E364-K370 WeakPolarHBondContact OE2-CE 3.37Å; E364-K370 IonicContact OE2-NZ 2.88Å; E364-K473 WeakPolarHBondContact O-CB 3.41Å; E364-K473 PolarHBondContact O-N 3.15Å; E364-K473 WeakPolarHBondContact OE1-CD 3.45Å; E364-K473 WeakPolarHBondContact OE1-CE 3.44Å; E364-K473 IonicContact OE1-NZ 3.62Å; E364-K473 PolarHBondContact OE1-NZ 3.43Å; E364-S474 PolarHBondContact N-O 3.45Å; E364-S474 PolarHBondContact O-N 2.76Å
365	D	96.4	Very high	96.8	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.053	21%	0.206	C	C	.	.			trans	-97.1	177.2	175.8	69.3	44	0	0	0	113.7	T367 G368 K369 Y465 Y470 K473	D365-T367 PolarHBondContact O-N 3.13Å; D365-T367 WeakPolarHBondContact OD1-CA 3.17Å; D365-T367 WeakPolarHBondContact OD1-CB 3.21Å; D365-T367 PolarHBondContact OD1-N 3.05Å; D365-T367 PolarHBondContact OD1-OG1 2.98Å; D365-G368 PolarHBondContact O-N 2.78Å; D365-G368 PolarHBondContact OD1-N 2.62Å; D365-K369 PolarHBondContact N-O 3.41Å; D365-K369 PolarHBondContact OD1-N 2.73Å; D365-K369 WeakPolarHBondContact OD2-CB 3.27Å; D365-Y465 HydrophobicContact CB-CE1 4.14Å; D365-Y465 PolarHBondContact OD2-OH 2.84Å; D365-Y470 HydrophobicContact CB-CE1 3.95Å; D365-K473 WeakPolarHBondContact O-CD 3.48Å
366	W	96	Very high	97	Very high	76 Å²	76	39.8 Å²	39.8	29%	0.288	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-6.6	-176.3	-67.2	84.7	0	0	0	114.4	W446 Y447 Y470 S471 K473	W366-W446 AromaticContact CH2-CH2 3.63Å; W366-W446 HydrophobicContact CH2-CH2 3.63Å; W366-W446 AromaticContact CH2-CZ2 3.45Å; W366-W446 HydrophobicContact CH2-CZ2 3.45Å; W366-W446 VanDerWaalsContact CH2-CZ2 3.45Å; W366-W446 HydrophobicContact CZ2-CH2 4.21Å; W366-W446 AromaticContact CZ2-CZ2 3.74Å; W366-W446 HydrophobicContact CZ2-CZ2 3.74Å; W366-Y447 WeakPolarHBondContact CZ2-O 3.4Å; W366-Y470 WeakPolarHBondContact CB-OH 3.37Å; W366-Y470 AromaticContact CD1-CZ 3.79Å; W366-Y470 PolarHBondContact N-OH 3.29Å; W366-Y470 VanDerWaalsContact N-OH 3.14Å; W366-S471 PolarHBondContact NE1-O 2.97Å; W366-K473 HydrophobicContact CD2-CB 3.9Å; W366-K473 HydrophobicContact CD2-CG 4.13Å; W366-K473 HydrophobicContact CE3-CB 4.49Å; W366-K473 HydrophobicContact CE3-CD 4.43Å; W366-K473 HydrophobicContact CE3-CG 4.22Å; W366-K473 HydrophobicContact CG-CB 4.13Å; W366-K473 HydrophobicContact CH2-CG 4.22Å; W366-K473 HydrophobicContact CZ2-CB 4.04Å; W366-K473 HydrophobicContact CZ2-CG 4.13Å; W366-K473 HydrophobicContact CZ3-CG 4.28Å
367	T	95.4	Very high	97.1	Very high	119 Å²	119	35.9 Å²	35.9	73%	0.73	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	-3.4	167.9	73.1	0	0	0	0	112.6	D365 K369	D365-T367 PolarHBondContact O-N 3.13Å; D365-T367 WeakPolarHBondContact OD1-CA 3.17Å; D365-T367 WeakPolarHBondContact OD1-CB 3.21Å; D365-T367 PolarHBondContact OD1-N 3.05Å; D365-T367 PolarHBondContact OD1-OG1 2.98Å; T367-K369 VanDerWaalsContact C-N 3.28Å
368	G	94.9	Very high	97.1	Very high	39 Å²	39	35.9 Å²	35.9	40%	0.402	19%	0.187	S	C	.	.	S	Bend	trans	80.8	5.4	-176.4	0	0	0	0	0	113.8	D365	D365-G368 PolarHBondContact O-N 2.78Å; D365-G368 PolarHBondContact OD1-N 2.62Å
369	K	96.5	Very high	97.1	Very high	112 Å²	112	38.1 Å²	38.1	49%	0.487	20%	0.195	S	C	.	.			trans	-73.6	137.6	173.2	172.1	-178.9	166.5	-153.5	0	109.5	E364 D365 T367 Y465	E364-K369 WeakPolarHBondContact CA-O 3.48Å; D365-K369 PolarHBondContact N-O 3.41Å; D365-K369 PolarHBondContact OD1-N 2.73Å; D365-K369 WeakPolarHBondContact OD2-CB 3.27Å; T367-K369 VanDerWaalsContact C-N 3.28Å; K369-Y465 VanDerWaalsContact CD-OH 3.22Å; K369-Y465 WeakPolarHBondContact CD-OH 3.47Å; K369-Y465 WeakPolarHBondContact CE-OH 3.29Å; K369-Y465 PolarHBondContact NZ-OH 3.01Å; K369-Y465 VanDerWaalsContact NZ-OH 3.15Å
370	K	96.5	Very high	97	Very high	95 Å²	95	38.2 Å²	38.2	41%	0.413	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	140.9	177.9	-68.4	-172.9	164.7	-152.8	0	111.6	E362 L363 E364	E362-K370 IonicContact OE1-NZ 2.66Å; E362-K370 PolarHBondContact OE1-NZ 2.88Å; E362-K370 IonicContact OE2-NZ 3.77Å; E362-K370 PolarHBondContact OE2-NZ 3.14Å; L363-K370 VanDerWaalsContact O-CA 3.32Å; L363-K370 WeakPolarHBondContact O-CA 3.17Å; E364-K370 HydrophobicContact CB-CG 4.16Å; E364-K370 HydrophobicContact CG-CG 3.9Å; E364-K370 WeakPolarHBondContact OE2-CE 3.37Å; E364-K370 IonicContact OE2-NZ 2.88Å
371	V	97.6	Very high	97	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.03	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	163.3	171.8	-65.3	0	0	0	0	109.8	L363 N397 A398 Y465	L363-V371 HydrophobicContact CB-CG2 3.93Å; L363-V371 HydrophobicContact CD1-CG2 4.15Å; L363-V371 HydrophobicContact CG-CG2 4.42Å; L363-V371 PolarHBondContact N-O 2.8Å; L363-V371 PolarHBondContact O-N 2.6Å; V371-N397 VanDerWaalsContact CA-OD1 3.25Å; V371-N397 WeakPolarHBondContact CA-OD1 3.25Å; V371-N397 VanDerWaalsContact CB-OD1 3.31Å; V371-N397 WeakPolarHBondContact CB-OD1 3.47Å; V371-A398 HydrophobicContact CB-CB 4.05Å; V371-A398 HydrophobicContact CG2-CB 3.72Å; V371-Y465 HydrophobicContact CB-CD2 4.48Å; V371-Y465 HydrophobicContact CB-CE2 4.28Å; V371-Y465 HydrophobicContact CG1-CD2 4.11Å; V371-Y465 HydrophobicContact CG1-CE2 3.51Å; V371-Y465 HydrophobicContact CG2-CD1 3.72Å; V371-Y465 HydrophobicContact CG2-CD2 3.79Å; V371-Y465 HydrophobicContact CG2-CE1 3.75Å; V371-Y465 HydrophobicContact CG2-CE2 3.82Å; V371-Y465 HydrophobicContact CG2-CG 3.75Å
372	Y	97.8	Very high	96.9	Very high	91 Å²	91	40.1 Å²	40.1	36%	0.357	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.6	-177.9	75.1	-86	0	0	0	113.8	M360 V361 G396 N397 A398	M360-Y372 HydrophobicContact CE-CD2 3.9Å; M360-Y372 HydrophobicContact CE-CE2 4.4Å; M360-Y372 HydrophobicContact SD-CD2 3.6Å; M360-Y372 HydrophobicContact SD-CG 4.03Å; V361-Y372 CarbonylContact O-C 3.58Å; V361-Y372 WeakPolarHBondContact O-CA 3.4Å; Y372-G396 WeakPolarHBondContact O-CA 3.24Å; Y372-N397 WeakPolarHBondContact CD1-OD1 3.33Å; Y372-N397 PolarHBondContact N-OD1 2.77Å; Y372-N397 PolarHBondContact O-N 3.38Å; Y372-A398 WeakPolarHBondContact O-CB 3.33Å; Y372-A398 PolarHBondContact O-N 3.06Å
373	A	98.1	Very high	96.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	114.8	169.2	0	0	0	0	0	109	V361 Y375 Y394 A398 W462	V361-A373 HydrophobicContact CB-CB 4.28Å; V361-A373 HydrophobicContact CG2-CB 4.35Å; V361-A373 PolarHBondContact N-O 2.99Å; V361-A373 PolarHBondContact O-N 3.42Å; A373-Y375 HydrophobicContact CB-CE2 3.89Å; A373-Y394 HydrophobicContact CB-CD2 4.22Å; A373-Y394 HydrophobicContact CB-CE2 3.65Å; A373-A398 HydrophobicContact CB-CB 4.38Å; A373-W462 HydrophobicContact CB-CH2 3.65Å; A373-W462 HydrophobicContact CB-CZ2 3.46Å; A373-W462 VanDerWaalsContact CB-CZ2 3.46Å
374	E	97.7	Very high	96.8	Very high	32 Å²	32	46.8 Å²	46.8	15%	0.15	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	144.5	170.6	-176.3	158.9	113	0	0	110.2	W310 K358 L359 M360 Y394 Q395	W310-E374 WeakPolarHBondContact CH2-OE2 3.41Å; K358-E374 HydrophobicContact CD-CG 4.35Å; K358-E374 WeakPolarHBondContact CD-OE1 3.5Å; K358-E374 IonicContact NZ-OE1 3.94Å; K358-E374 PolarHBondContact NZ-OE1 3.16Å; K358-E374 IonicContact NZ-OE2 2.91Å; K358-E374 PolarHBondContact NZ-OE2 3.01Å; L359-E374 CarbonylContact O-C 3.57Å; L359-E374 VanDerWaalsContact O-CA 3.24Å; L359-E374 WeakPolarHBondContact O-CA 3.39Å; M360-E374 HydrophobicContact CE-CB 4.06Å; M360-E374 HydrophobicContact CE-CG 4.45Å; M360-E374 WeakPolarHBondContact CE-OE2 3.43Å; M360-E374 HydrophobicContact SD-CB 4.15Å; E374-Y394 CarbonylContact O-C 3.52Å; E374-Y394 WeakPolarHBondContact O-CA 3.4Å; E374-Q395 WeakPolarHBondContact CA-O 3.45Å; E374-Q395 PolarHBondContact N-O 3.36Å; E374-Q395 PolarHBondContact O-N 3.47Å
375	Y	98.1	Very high	96.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.1	172.6	-61.2	-95.7	0	0	0	108.5	K358 L359 V361 A373 S377 L391 T393 Y394 D400 F402 W462	K358-Y375 WeakPolarHBondContact CA-O 3.1Å; K358-Y375 WeakPolarHBondContact CB-O 3.45Å; L359-Y375 HydrophobicContact CD2-CD2 4.09Å; L359-Y375 PolarHBondContact N-O 2.85Å; L359-Y375 PolarHBondContact O-N 2.87Å; V361-Y375 HydrophobicContact CG2-CE2 4.17Å; A373-Y375 HydrophobicContact CB-CE2 3.89Å; Y375-S377 PolarHBondContact O-N 2.93Å; Y375-L391 HydrophobicContact CD1-CB 4.17Å; Y375-L391 HydrophobicContact CD1-CD1 4.03Å; Y375-L391 HydrophobicContact CD1-CD2 4.32Å; Y375-L391 HydrophobicContact CD1-CG 4.41Å; Y375-L391 HydrophobicContact CD2-CD2 4.5Å; Y375-L391 HydrophobicContact CE1-CD1 4.09Å; Y375-L391 HydrophobicContact CG-CD1 4.48Å; Y375-L391 HydrophobicContact CG-CD2 4.05Å; Y375-T393 WeakPolarHBondContact CA-O 3.45Å; Y375-Y394 AromaticContact CE1-CD2 3.94Å; Y375-Y394 HydrophobicContact CE1-CD2 3.94Å; Y375-Y394 HydrophobicContact CE1-CG 4.4Å; Y375-Y394 HydrophobicContact CE2-CD2 4.4Å; Y375-Y394 AromaticContact CZ-CD2 3.74Å; Y375-D400 PolarHBondContact OH-OD1 2.89Å; Y375-D400 VanDerWaalsContact OH-OD1 3.14Å; Y375-F402 HydrophobicContact CE1-CB 4.43Å; Y375-F402 HydrophobicContact CE2-CB 4.23Å; Y375-F402 HydrophobicContact CE2-CD1 4.23Å; Y375-F402 WeakPolarHBondContact OH-CB 3.29Å; Y375-W462 HydrophobicContact CE2-CH2 4.2Å; Y375-W462 WeakPolarHBondContact OH-CH2 3.03Å; Y375-W462 WeakPolarHBondContact OH-CZ2 3.33Å
376	S	96.9	Very high	96.8	Very high	52 Å²	52	48.7 Å²	48.7	36%	0.364	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	-10.2	-171.6	62.1	0	0	0	0	115.3	T393 I482	S376-T393 WeakPolarHBondContact CB-OG1 3.13Å; S376-T393 PolarHBondContact N-O 2.03Å; S376-T393 PolarHBondContact OG-N 3.25Å; S376-T393 PolarHBondContact OG-O 3.41Å; S376-T393 PolarHBondContact OG-OG1 2.95Å; S376-I482 WeakPolarHBondContact O-CD1 3.37Å
377	S	96.6	Very high	96.9	Very high	37 Å²	37	45.1 Å²	45.1	26%	0.259	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	145	171.5	178.7	0	0	0	0	109.2	Y357 Y375 L391 G392	Y357-S377 CarbonylContact O-C 3.55Å; Y357-S377 VanDerWaalsContact O-CA 3.3Å; Y357-S377 WeakPolarHBondContact O-CA 3.47Å; Y375-S377 PolarHBondContact O-N 2.93Å; S377-L391 CarbonylContact O-C 3.59Å; S377-L391 WeakPolarHBondContact O-CA 3.31Å; S377-G392 PolarHBondContact O-N 3.38Å
378	F	97.5	Very high	97	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.009	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	122.9	172.9	169.4	-93	0	0	0	110	L313 I348 A352 Y357 L359 L380 L389 R390 L391 I479	L313-F378 HydrophobicContact CD1-CE1 3.97Å; L313-F378 HydrophobicContact CD1-CZ 4.15Å; I348-F378 HydrophobicContact CG2-CE1 3.81Å; I348-F378 HydrophobicContact CG2-CZ 3.79Å; A352-F378 HydrophobicContact CB-CD1 4.12Å; A352-F378 HydrophobicContact CB-CE1 4.01Å; Y357-F378 PolarHBondContact O-N 2.76Å; L359-F378 HydrophobicContact CB-CB 3.6Å; L359-F378 HydrophobicContact CB-CD2 4.18Å; L359-F378 HydrophobicContact CB-CG 3.97Å; L359-F378 HydrophobicContact CD1-CD2 4.39Å; L359-F378 HydrophobicContact CD2-CD2 3.81Å; L359-F378 HydrophobicContact CD2-CE2 4.32Å; L359-F378 HydrophobicContact CD2-CG 4.45Å; L359-F378 HydrophobicContact CG-CD2 4.35Å; F378-L380 HydrophobicContact CE2-CD2 4.15Å; F378-L380 HydrophobicContact CZ-CD2 3.99Å; F378-L380 HydrophobicContact CZ-CG 4.12Å; F378-L389 HydrophobicContact CD2-CD1 3.83Å; F378-L389 HydrophobicContact CE2-CD1 3.57Å; F378-R390 WeakPolarHBondContact CA-O 3.28Å; F378-L391 HydrophobicContact CD2-CD2 3.98Å; F378-I479 HydrophobicContact CD1-CG2 3.65Å; F378-I479 HydrophobicContact CE1-CG2 4.02Å; F378-I479 HydrophobicContact CG-CG2 4.25Å
379	Y	95.3	Very high	97.2	Very high	71 Å²	71	39.5 Å²	39.5	28%	0.278	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	151.3	178.3	173.3	-94.3	0	0	0	110	A352 K353 E381 R390	A352-Y379 WeakPolarHBondContact O-CD2 3.36Å; K353-Y379 HydrophobicContact CB-CE2 4.21Å; K353-Y379 HydrophobicContact CG-CE2 4.37Å; Y379-E381 WeakPolarHBondContact CE1-OE2 3.36Å; Y379-R390 HydrophobicContact CD1-CB 4.41Å; Y379-R390 HydrophobicContact CD1-CG 3.95Å; Y379-R390 PolarHBondContact N-O 3.41Å; Y379-R390 VanDerWaalsContact N-O 3.11Å; Y379-R390 WeakPolarHBondContact O-CB 3.23Å; Y379-R390 PolarHBondContact O-N 3.03Å
380	L	97.3	Very high	97.2	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.4	173.4	-58.1	-173.5	0	0	0	110	L345 I348 Y349 F378 K388 L389 W433	L345-L380 HydrophobicContact CD2-CD1 4.25Å; I348-L380 HydrophobicContact CB-CD1 4.13Å; I348-L380 HydrophobicContact CG2-CD1 3.56Å; I348-L380 HydrophobicContact CG2-CG 4.3Å; Y349-L380 VanDerWaalsContact CD2-O 3.28Å; Y349-L380 WeakPolarHBondContact CD2-O 3.34Å; F378-L380 HydrophobicContact CE2-CD2 4.15Å; F378-L380 HydrophobicContact CZ-CD2 3.99Å; F378-L380 HydrophobicContact CZ-CG 4.12Å; L380-K388 WeakPolarHBondContact CA-O 3.21Å; L380-L389 HydrophobicContact CD2-CD1 3.86Å; L380-W433 HydrophobicContact CD1-CZ2 4.01Å; L380-W433 HydrophobicContact CD2-CH2 4.42Å; L380-W433 HydrophobicContact CD2-CZ2 3.5Å; L380-W433 HydrophobicContact CG-CZ2 4.43Å
381	E	97.4	Very high	97.2	Very high	25 Å²	25	35.2 Å²	35.2	12%	0.117	18%	0.178	C	C	.	.			trans	-67.5	163.1	166.8	-55.3	-62.9	-179.1	0	0	111.4	Y379 E385 F387 K388 R390	Y379-E381 WeakPolarHBondContact CE1-OE2 3.36Å; E381-E385 HydrophobicContact CB-CB 3.71Å; E381-E385 HydrophobicContact CG-CB 4.35Å; E381-F387 VanDerWaalsContact O-CA 3.28Å; E381-F387 WeakPolarHBondContact O-CA 3.39Å; E381-K388 HydrophobicContact CB-CB 4Å; E381-K388 HydrophobicContact CG-CB 3.72Å; E381-K388 HydrophobicContact CG-CD 4.06Å; E381-K388 HydrophobicContact CG-CG 4.32Å; E381-K388 PolarHBondContact N-O 3.19Å; E381-R390 IonicContact OE1-CZ 2.7Å; E381-R390 IonicContact OE1-NE 3.03Å; E381-R390 PolarHBondContact OE1-NE 2.83Å; E381-R390 IonicContact OE1-NH2 2.63Å; E381-R390 PolarHBondContact OE1-NH2 2.84Å
382	P	96.3	Very high	97.2	Very high	33 Å²	33	36.1 Å²	36.1	21%	0.214	19%	0.188	C	C	.	.			trans	-61.7	168.2	172.9	22.8	-35.1	0	0	0	114.8	Y349 S384 E385 G386 F387	Y349-P382 HydrophobicContact CE2-CB 4.21Å; P382-S384 WeakPolarHBondContact CG-OG 3.44Å; P382-S384 PolarHBondContact O-N 3.37Å; P382-S384 VanDerWaalsContact O-N 3.16Å; P382-E385 CarbonylContact O-C 3.57Å; P382-E385 PolarHBondContact O-N 3.16Å; P382-G386 PolarHBondContact O-N 3.43Å; P382-G386 VanDerWaalsContact O-N 3.17Å; P382-F387 PolarHBondContact O-N 3.29Å
383	E	96.3	Very high	97.2	Very high	57 Å²	57	36.8 Å²	36.8	27%	0.266	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-56.4	-31.4	177.3	178.5	168.2	-151.4	0	0	113.6	W327 K331 E385 G386 F387 R415	W327-E383 HydrophobicContact CZ2-CG 4.23Å; W327-E383 PolarHBondContact NE1-OE1 2.88Å; K331-E383 WeakPolarHBondContact CE-OE2 3.34Å; K331-E383 IonicContact NZ-OE1 2.74Å; K331-E383 IonicContact NZ-OE2 3.17Å; K331-E383 PolarHBondContact NZ-OE2 3.33Å; E383-E385 PolarHBondContact O-N 2.97Å; E383-G386 WeakPolarHBondContact O-CA 3.35Å; E383-G386 PolarHBondContact O-N 3.07Å; E383-F387 HydrophobicContact CB-CD2 4.43Å; E383-F387 HydrophobicContact CB-CE1 4.29Å; E383-F387 HydrophobicContact CB-CE2 3.73Å; E383-F387 HydrophobicContact CB-CZ 3.66Å; E383-F387 HydrophobicContact CG-CE2 3.95Å; E383-F387 HydrophobicContact CG-CZ 4.33Å; E383-R415 IonicContact OE1-NH1 2.67Å; E383-R415 PolarHBondContact OE1-NH1 2.89Å
384	S	96.8	Very high	97.2	Very high	97 Å²	97	39.8 Å²	39.8	68%	0.678	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-54.2	-41.2	174.7	44.6	0	0	0	0	111.7	P382	P382-S384 WeakPolarHBondContact CG-OG 3.44Å; P382-S384 PolarHBondContact O-N 3.37Å; P382-S384 VanDerWaalsContact O-N 3.16Å
385	E	96.8	Very high	97.1	Very high	79 Å²	79	44.3 Å²	44.3	37%	0.369	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-92	7.5	173.3	-66.4	-161.7	-137	0	0	113.6	E381 P382 E383 K388 Q409	E381-E385 HydrophobicContact CB-CB 3.71Å; E381-E385 HydrophobicContact CG-CB 4.35Å; P382-E385 CarbonylContact O-C 3.57Å; P382-E385 PolarHBondContact O-N 3.16Å; E383-E385 PolarHBondContact O-N 2.97Å; E385-K388 IonicContact OE2-NZ 2.91Å; E385-K388 PolarHBondContact OE2-NZ 2.69Å; E385-Q409 WeakPolarHBondContact O-CG 3.03Å
386	G	96.6	Very high	97	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	33.6	173.3	0	0	0	0	0	115.4	P382 E383 K388 F410	P382-G386 PolarHBondContact O-N 3.43Å; P382-G386 VanDerWaalsContact O-N 3.17Å; E383-G386 WeakPolarHBondContact O-CA 3.35Å; E383-G386 PolarHBondContact O-N 3.07Å; G386-K388 PolarHBondContact O-N 3.1Å; G386-F410 WeakPolarHBondContact O-CB 3.43Å; G386-F410 PolarHBondContact O-N 3.37Å
387	F	98.3	Very high	97.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	S	Bend	trans	54.9	36.5	-178	-59.1	-72.5	0	0	0	112.8	W327 K331 L345 D346 Y349 E381 P382 E383 L389 F410 W433	W327-F387 AromaticContact CH2-CD2 3.79Å; W327-F387 HydrophobicContact CH2-CD2 3.79Å; W327-F387 HydrophobicContact CH2-CE2 4.37Å; W327-F387 AromaticContact CZ2-CD2 3.56Å; W327-F387 HydrophobicContact CZ2-CD2 3.56Å; W327-F387 AromaticContact CZ2-CE2 3.67Å; W327-F387 HydrophobicContact CZ2-CE2 3.67Å; K331-F387 HydrophobicContact CG-CE2 4.48Å; K331-F387 HydrophobicContact CG-CZ 4.47Å; L345-F387 HydrophobicContact CB-CB 4.49Å; L345-F387 HydrophobicContact CB-CD1 3.9Å; L345-F387 HydrophobicContact CB-CD2 3.71Å; L345-F387 HydrophobicContact CB-CE1 3.92Å; L345-F387 HydrophobicContact CB-CE2 3.72Å; L345-F387 HydrophobicContact CB-CG 3.78Å; L345-F387 HydrophobicContact CB-CZ 3.82Å; L345-F387 HydrophobicContact CD1-CD2 3.68Å; L345-F387 HydrophobicContact CD1-CE2 4.11Å; L345-F387 HydrophobicContact CD1-CG 4.24Å; L345-F387 HydrophobicContact CD2-CB 3.92Å; L345-F387 HydrophobicContact CD2-CD2 4.42Å; L345-F387 HydrophobicContact CD2-CG 4.14Å; L345-F387 HydrophobicContact CG-CD2 4.13Å; L345-F387 HydrophobicContact CG-CG 4.27Å; D346-F387 WeakPolarHBondContact OD1-CZ 3.31Å; Y349-F387 HydrophobicContact CG-CE1 4.4Å; E381-F387 VanDerWaalsContact O-CA 3.28Å; E381-F387 WeakPolarHBondContact O-CA 3.39Å; P382-F387 PolarHBondContact O-N 3.29Å; E383-F387 HydrophobicContact CB-CD2 4.43Å; E383-F387 HydrophobicContact CB-CE1 4.29Å; E383-F387 HydrophobicContact CB-CE2 3.73Å; E383-F387 HydrophobicContact CB-CZ 3.66Å; E383-F387 HydrophobicContact CG-CE2 3.95Å; E383-F387 HydrophobicContact CG-CZ 4.33Å; F387-L389 PolarHBondContact O-N 2.75Å; F387-F410 HydrophobicContact CB-CB 4.35Å; F387-W433 PolarHBondContact O-NE1 3.23Å
388	K	98.1	Very high	97.1	Very high	40 Å²	40	45.9 Å²	45.9	17%	0.174	24%	0.243	C	C	.	.			trans	-56.1	130.4	-175.7	-179.9	-161.4	-59.6	161.7	0	111	L380 E381 E385 G386 G407 K408 Q409	L380-K388 WeakPolarHBondContact CA-O 3.21Å; E381-K388 HydrophobicContact CB-CB 4Å; E381-K388 HydrophobicContact CG-CB 3.72Å; E381-K388 HydrophobicContact CG-CD 4.06Å; E381-K388 HydrophobicContact CG-CG 4.32Å; E381-K388 PolarHBondContact N-O 3.19Å; E385-K388 IonicContact OE2-NZ 2.91Å; E385-K388 PolarHBondContact OE2-NZ 2.69Å; G386-K388 PolarHBondContact O-N 3.1Å; K388-G407 WeakPolarHBondContact CD-O 3.39Å; K388-G407 VanDerWaalsContact CG-O 3.25Å; K388-G407 WeakPolarHBondContact CG-O 3.44Å; K388-K408 VanDerWaalsContact CA-O 3.28Å; K388-K408 WeakPolarHBondContact CA-O 3.36Å; K388-K408 WeakPolarHBondContact CG-O 3.46Å; K388-Q409 HydrophobicContact CB-CG 4.37Å
389	L	97.9	Very high	97.1	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	135.3	-175.2	180	62.5	0	0	0	111.8	F378 L380 F387 L391 F402 N405 N406 G407 K408 W433	F378-L389 HydrophobicContact CD2-CD1 3.83Å; F378-L389 HydrophobicContact CE2-CD1 3.57Å; L380-L389 HydrophobicContact CD2-CD1 3.86Å; F387-L389 PolarHBondContact O-N 2.75Å; L389-L391 HydrophobicContact CD1-CD2 4.07Å; L389-L391 HydrophobicContact CD1-CG 4.15Å; L389-L391 HydrophobicContact CD2-CD1 3.96Å; L389-L391 HydrophobicContact CD2-CG 4.03Å; L389-L391 HydrophobicContact CG-CD1 4.46Å; L389-L391 HydrophobicContact CG-CD2 4.45Å; L389-L391 HydrophobicContact CG-CG 3.98Å; L389-F402 HydrophobicContact CD1-CZ 4.39Å; L389-F402 HydrophobicContact CD2-CD2 4.27Å; L389-F402 HydrophobicContact CD2-CE1 3.99Å; L389-F402 HydrophobicContact CD2-CE2 3.54Å; L389-F402 HydrophobicContact CD2-CZ 3.38Å; L389-N405 HydrophobicContact CD2-CB 4.28Å; L389-N406 PolarHBondContact O-OD1 3.46Å; L389-G407 VanDerWaalsContact O-CA 3.29Å; L389-G407 WeakPolarHBondContact O-CA 3.27Å; L389-G407 PolarHBondContact O-N 2.6Å; L389-K408 PolarHBondContact N-O 2.82Å; L389-W433 HydrophobicContact CB-CB 4.24Å; L389-W433 HydrophobicContact CB-CD2 4.04Å; L389-W433 HydrophobicContact CB-CG 3.7Å; L389-W433 HydrophobicContact CD1-CD2 4.47Å; L389-W433 HydrophobicContact CD2-CB 4.2Å; L389-W433 HydrophobicContact CD2-CD2 4.05Å; L389-W433 HydrophobicContact CD2-CE3 4.2Å; L389-W433 HydrophobicContact CD2-CG 4.08Å; L389-W433 HydrophobicContact CG-CD2 4.43Å; L389-W433 HydrophobicContact CG-CG 4.45Å
390	R	97.6	Very high	97.1	Very high	103 Å²	103	46.3 Å²	46.3	39%	0.389	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.9	163.5	-54.7	-59.4	-171	159	7.4	109	F378 Y379 E381 N406	F378-R390 WeakPolarHBondContact CA-O 3.28Å; Y379-R390 HydrophobicContact CD1-CB 4.41Å; Y379-R390 HydrophobicContact CD1-CG 3.95Å; Y379-R390 PolarHBondContact N-O 3.41Å; Y379-R390 VanDerWaalsContact N-O 3.11Å; Y379-R390 WeakPolarHBondContact O-CB 3.23Å; Y379-R390 PolarHBondContact O-N 3.03Å; E381-R390 IonicContact OE1-CZ 2.7Å; E381-R390 IonicContact OE1-NE 3.03Å; E381-R390 PolarHBondContact OE1-NE 2.83Å; E381-R390 IonicContact OE1-NH2 2.63Å; E381-R390 PolarHBondContact OE1-NH2 2.84Å; R390-N406 WeakPolarHBondContact CA-OD1 3.23Å
391	L	97.3	Very high	97.1	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.079	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.1	172.2	-65.1	173.2	0	0	0	111	L359 Y375 S377 F378 L389 F402 N406	L359-L391 HydrophobicContact CD2-CD2 3.9Å; Y375-L391 HydrophobicContact CD1-CB 4.17Å; Y375-L391 HydrophobicContact CD1-CD1 4.03Å; Y375-L391 HydrophobicContact CD1-CD2 4.32Å; Y375-L391 HydrophobicContact CD1-CG 4.41Å; Y375-L391 HydrophobicContact CD2-CD2 4.5Å; Y375-L391 HydrophobicContact CE1-CD1 4.09Å; Y375-L391 HydrophobicContact CG-CD1 4.48Å; Y375-L391 HydrophobicContact CG-CD2 4.05Å; S377-L391 CarbonylContact O-C 3.59Å; S377-L391 WeakPolarHBondContact O-CA 3.31Å; F378-L391 HydrophobicContact CD2-CD2 3.98Å; L389-L391 HydrophobicContact CD1-CD2 4.07Å; L389-L391 HydrophobicContact CD1-CG 4.15Å; L389-L391 HydrophobicContact CD2-CD1 3.96Å; L389-L391 HydrophobicContact CD2-CG 4.03Å; L389-L391 HydrophobicContact CG-CD1 4.46Å; L389-L391 HydrophobicContact CG-CD2 4.45Å; L389-L391 HydrophobicContact CG-CG 3.98Å; L391-F402 HydrophobicContact CD1-CB 4.22Å; L391-F402 HydrophobicContact CD1-CD1 3.62Å; L391-F402 HydrophobicContact CD1-CE1 4.09Å; L391-F402 HydrophobicContact CD1-CG 3.87Å; L391-F402 WeakPolarHBondContact CD1-O 3.34Å; L391-F402 HydrophobicContact CD2-CD1 4.21Å; L391-F402 HydrophobicContact CD2-CE1 4.14Å; L391-N406 HydrophobicContact CB-CB 4.41Å; L391-N406 PolarHBondContact N-OD1 3.4Å; L391-N406 PolarHBondContact O-ND2 3.3Å
392	G	96.4	Very high	97.1	Very high	24 Å²	24	45.1 Å²	45.1	25%	0.247	25%	0.251	C	S	.	.			trans	-81.2	-158.1	167.1	0	0	0	0	0	113.2	S377	S377-G392 PolarHBondContact O-N 3.38Å
393	T	97.3	Very high	97.1	Very high	104 Å²	104	45.5 Å²	45.5	64%	0.638	25%	0.254	S	S	*	.			trans	-72.8	135.2	179.7	56.5	0	0	0	0	112	Y375 S376	Y375-T393 WeakPolarHBondContact CA-O 3.45Å; S376-T393 WeakPolarHBondContact CB-OG1 3.13Å; S376-T393 PolarHBondContact N-O 2.03Å; S376-T393 PolarHBondContact OG-N 3.25Å; S376-T393 PolarHBondContact OG-O 3.41Å; S376-T393 PolarHBondContact OG-OG1 2.95Å
394	Y	97.9	Very high	97	Very high	63 Å²	63	44.3 Å²	44.3	25%	0.247	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	142.6	174.7	166.7	-90.8	0	0	0	113.2	A373 E374 Y375 G396 G399 D400	A373-Y394 HydrophobicContact CB-CD2 4.22Å; A373-Y394 HydrophobicContact CB-CE2 3.65Å; E374-Y394 CarbonylContact O-C 3.52Å; E374-Y394 WeakPolarHBondContact O-CA 3.4Å; Y375-Y394 AromaticContact CE1-CD2 3.94Å; Y375-Y394 HydrophobicContact CE1-CD2 3.94Å; Y375-Y394 HydrophobicContact CE1-CG 4.4Å; Y375-Y394 HydrophobicContact CE2-CD2 4.4Å; Y375-Y394 AromaticContact CZ-CD2 3.74Å; Y394-G396 WeakPolarHBondContact OH-CA 3.45Å; Y394-G396 PolarHBondContact OH-O 3.01Å; Y394-G399 WeakPolarHBondContact CE2-O 3.44Å; Y394-G399 VanDerWaalsContact CZ-C 3.42Å; Y394-G399 VanDerWaalsContact OH-C 3.28Å; Y394-G399 VanDerWaalsContact OH-CA 3.22Å; Y394-G399 WeakPolarHBondContact OH-CA 3.47Å; Y394-G399 PolarHBondContact OH-N 3.09Å; Y394-D400 WeakPolarHBondContact CB-OD2 3.49Å; Y394-D400 HydrophobicContact CD1-CB 4.03Å; Y394-D400 HydrophobicContact CD2-CB 3.86Å; Y394-D400 HydrophobicContact CE1-CB 4.38Å; Y394-D400 HydrophobicContact CE2-CB 4.17Å; Y394-D400 HydrophobicContact CG-CB 3.78Å
395	Q	96.9	Very high	96.9	Very high	128 Å²	128	39.7 Å²	39.7	60%	0.598	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	137.9	163.4	178.3	175.7	-10.4	0	0	109.9	E374	E374-Q395 WeakPolarHBondContact CA-O 3.45Å; E374-Q395 PolarHBondContact N-O 3.36Å; E374-Q395 PolarHBondContact O-N 3.47Å
396	G	96.5	Very high	96.9	Very high	28 Å²	28	38.6 Å²	38.6	29%	0.289	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	158.3	-171.4	173.5	0	0	0	0	0	114.7	Y372 Y394	Y372-G396 WeakPolarHBondContact O-CA 3.24Å; Y394-G396 WeakPolarHBondContact OH-CA 3.45Å; Y394-G396 PolarHBondContact OH-O 3.01Å
397	N	97.1	Very high	96.9	Very high	92 Å²	92	40 Å²	40	49%	0.492	23%	0.232	S	C	.	.	S	Bend	trans	-118.3	1.1	-179.4	69.9	-2.3	0	0	0	114.7	V371 Y372 G399	V371-N397 VanDerWaalsContact CA-OD1 3.25Å; V371-N397 WeakPolarHBondContact CA-OD1 3.25Å; V371-N397 VanDerWaalsContact CB-OD1 3.31Å; V371-N397 WeakPolarHBondContact CB-OD1 3.47Å; Y372-N397 WeakPolarHBondContact CD1-OD1 3.33Å; Y372-N397 PolarHBondContact N-OD1 2.77Å; Y372-N397 PolarHBondContact O-N 3.38Å; N397-G399 VanDerWaalsContact C-N 3.28Å
398	A	96.9	Very high	96.9	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.017	24%	0.238	C	C	.	.	S	Bend	trans	-79	-10	169.1	0	0	0	0	0	113.6	L363 V371 Y372 A373 W462 A464	L363-A398 HydrophobicContact CD1-CB 3.93Å; V371-A398 HydrophobicContact CB-CB 4.05Å; V371-A398 HydrophobicContact CG2-CB 3.72Å; Y372-A398 WeakPolarHBondContact O-CB 3.33Å; Y372-A398 PolarHBondContact O-N 3.06Å; A373-A398 HydrophobicContact CB-CB 4.38Å; A398-W462 PolarHBondContact O-NE1 2.87Å; A398-A464 WeakPolarHBondContact O-CB 3.34Å
399	G	97.3	Very high	96.9	Very high	26 Å²	26	42.8 Å²	42.8	27%	0.268	24%	0.244	S	C	.	.			trans	73.5	158.7	-163.8	0	0	0	0	0	111.7	Y394 N397 W462	Y394-G399 WeakPolarHBondContact CE2-O 3.44Å; Y394-G399 VanDerWaalsContact CZ-C 3.42Å; Y394-G399 VanDerWaalsContact OH-C 3.28Å; Y394-G399 VanDerWaalsContact OH-CA 3.22Å; Y394-G399 WeakPolarHBondContact OH-CA 3.47Å; Y394-G399 PolarHBondContact OH-N 3.09Å; N397-G399 VanDerWaalsContact C-N 3.28Å; G399-W462 WeakPolarHBondContact O-CZ2 3.29Å; G399-W462 PolarHBondContact O-NE1 3.27Å
400	D	97.1	Very high	96.9	Very high	55 Å²	55	42.8 Å²	42.8	29%	0.294	24%	0.244	S	C	.	.			trans	-77.7	143.6	172.5	-163.4	-19.1	0	0	0	110	Y375 Y394 F402 S403	Y375-D400 PolarHBondContact OH-OD1 2.89Å; Y375-D400 VanDerWaalsContact OH-OD1 3.14Å; Y394-D400 WeakPolarHBondContact CB-OD2 3.49Å; Y394-D400 HydrophobicContact CD1-CB 4.03Å; Y394-D400 HydrophobicContact CD2-CB 3.86Å; Y394-D400 HydrophobicContact CE1-CB 4.38Å; Y394-D400 HydrophobicContact CE2-CB 4.17Å; Y394-D400 HydrophobicContact CG-CB 3.78Å; D400-F402 PolarHBondContact OD1-N 3.24Å; D400-F402 VanDerWaalsContact OD1-N 3.13Å; D400-S403 VanDerWaalsContact CG-OG 3.3Å; D400-S403 WeakPolarHBondContact OD1-CB 3.38Å; D400-S403 PolarHBondContact OD1-N 3.43Å; D400-S403 PolarHBondContact OD1-OG 3.08Å; D400-S403 WeakPolarHBondContact OD2-CB 3.28Å; D400-S403 PolarHBondContact OD2-OG 2.91Å
401	S	96.8	Very high	97	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.007	23%	0.226	C	C	.	.			trans	-154	-18.1	169.4	-67.9	0	0	0	0	111	S404 Q439 T440 A463 A464	S401-S404 PolarHBondContact O-OG 3.41Å; S401-Q439 WeakPolarHBondContact O-CB 3.43Å; S401-T440 VanDerWaalsContact CB-CG2 3.48Å; S401-A463 PolarHBondContact OG-N 2.98Å; S401-A464 WeakPolarHBondContact OG-CB 3.47Å; S401-A464 PolarHBondContact OG-N 3.3Å
402	F	96.9	Very high	97	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	-89.6	-20.2	-177.1	-161.9	-150.1	0	0	0	112.8	L359 Y375 L389 L391 D400 S404 N405 W432 W433 T440 W462	L359-F402 HydrophobicContact CD2-CD1 4.09Å; L359-F402 HydrophobicContact CD2-CE1 3.73Å; Y375-F402 HydrophobicContact CE1-CB 4.43Å; Y375-F402 HydrophobicContact CE2-CB 4.23Å; Y375-F402 HydrophobicContact CE2-CD1 4.23Å; Y375-F402 WeakPolarHBondContact OH-CB 3.29Å; L389-F402 HydrophobicContact CD1-CZ 4.39Å; L389-F402 HydrophobicContact CD2-CD2 4.27Å; L389-F402 HydrophobicContact CD2-CE1 3.99Å; L389-F402 HydrophobicContact CD2-CE2 3.54Å; L389-F402 HydrophobicContact CD2-CZ 3.38Å; L391-F402 HydrophobicContact CD1-CB 4.22Å; L391-F402 HydrophobicContact CD1-CD1 3.62Å; L391-F402 HydrophobicContact CD1-CE1 4.09Å; L391-F402 HydrophobicContact CD1-CG 3.87Å; L391-F402 WeakPolarHBondContact CD1-O 3.34Å; L391-F402 HydrophobicContact CD2-CD1 4.21Å; L391-F402 HydrophobicContact CD2-CE1 4.14Å; D400-F402 PolarHBondContact OD1-N 3.24Å; D400-F402 VanDerWaalsContact OD1-N 3.13Å; F402-S404 PolarHBondContact O-N 3.07Å; F402-S404 VanDerWaalsContact O-N 3.15Å; F402-N405 HydrophobicContact CD2-CB 3.75Å; F402-N405 HydrophobicContact CE2-CB 3.92Å; F402-N405 WeakPolarHBondContact O-CA 3.34Å; F402-N405 WeakPolarHBondContact O-CB 3.38Å; F402-N405 PolarHBondContact O-N 3.24Å; F402-W432 AromaticContact CD2-CZ2 3.84Å; F402-W432 HydrophobicContact CD2-CZ2 3.84Å; F402-W432 AromaticContact CE2-CE2 3.62Å; F402-W432 HydrophobicContact CE2-CH2 4.04Å; F402-W432 AromaticContact CE2-CZ2 3.25Å; F402-W432 HydrophobicContact CE2-CZ2 3.25Å; F402-W432 AromaticContact CE2-NE1 3.83Å; F402-W432 AromaticContact CZ-CH2 3.97Å; F402-W432 HydrophobicContact CZ-CH2 3.97Å; F402-W432 AromaticContact CZ-CZ2 3.65Å; F402-W432 HydrophobicContact CZ-CZ2 3.65Å; F402-W433 AromaticContact CE2-CE3 3.9Å; F402-W433 HydrophobicContact CE2-CE3 3.9Å; F402-W433 HydrophobicContact CE2-CZ3 4.41Å; F402-W433 AromaticContact CZ-CE3 3.65Å; F402-W433 HydrophobicContact CZ-CE3 3.65Å; F402-W433 AromaticContact CZ-CZ3 3.77Å; F402-W433 HydrophobicContact CZ-CZ3 3.77Å; F402-T440 HydrophobicContact CB-CG2 4.15Å; F402-W462 HydrophobicContact CB-CH2 3.7Å; F402-W462 HydrophobicContact CB-CZ3 4.02Å
403	S	95.9	Very high	97	Very high	41 Å²	41	38.4 Å²	38.4	29%	0.287	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-58.9	-25.7	169	-66.5	0	0	0	0	112.7	D400 N405 N406	D400-S403 VanDerWaalsContact CG-OG 3.3Å; D400-S403 WeakPolarHBondContact OD1-CB 3.38Å; D400-S403 PolarHBondContact OD1-N 3.43Å; D400-S403 PolarHBondContact OD1-OG 3.08Å; D400-S403 WeakPolarHBondContact OD2-CB 3.28Å; D400-S403 PolarHBondContact OD2-OG 2.91Å; S403-N405 PolarHBondContact O-N 3.28Å; S403-N406 VanDerWaalsContact O-CB 3.25Å; S403-N406 WeakPolarHBondContact O-CB 3.47Å; S403-N406 PolarHBondContact O-N 3.08Å; S403-N406 VanDerWaalsContact O-N 3.1Å
404	S	94.3	Very high	97.1	Very high	32 Å²	32	37.4 Å²	37.4	22%	0.224	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-63.5	-17.5	172.5	77	0	0	0	0	114	S401 F402 N435 Q439	S401-S404 PolarHBondContact O-OG 3.41Å; F402-S404 PolarHBondContact O-N 3.07Å; F402-S404 VanDerWaalsContact O-N 3.15Å; S404-N435 PolarHBondContact O-ND2 3.5Å; S404-Q439 PolarHBondContact OG-N 2.97Å
405	N	95.4	Very high	97	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-101.5	-2.7	177.7	-58.4	98.2	0	0	0	112.6	L389 F402 S403 K408 W433 T440	L389-N405 HydrophobicContact CD2-CB 4.28Å; F402-N405 HydrophobicContact CD2-CB 3.75Å; F402-N405 HydrophobicContact CE2-CB 3.92Å; F402-N405 WeakPolarHBondContact O-CA 3.34Å; F402-N405 WeakPolarHBondContact O-CB 3.38Å; F402-N405 PolarHBondContact O-N 3.24Å; S403-N405 PolarHBondContact O-N 3.28Å; N405-K408 WeakPolarHBondContact O-CB 3.43Å; N405-K408 WeakPolarHBondContact O-CG 3.49Å; N405-K408 PolarHBondContact O-N 2.91Å; N405-W433 HydrophobicContact CB-CB 4.28Å; N405-W433 WeakPolarHBondContact CB-O 3.28Å; N405-W433 PolarHBondContact ND2-O 3.45Å; N405-T440 PolarHBondContact OD1-OG1 3.22Å
406	N	97	Very high	97.1	Very high	57 Å²	57	35.7 Å²	35.7	31%	0.305	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	138.2	179.1	-163.7	-0	0	0	0	110.8	L389 R390 L391 S403 K408	L389-N406 PolarHBondContact O-OD1 3.46Å; R390-N406 WeakPolarHBondContact CA-OD1 3.23Å; L391-N406 HydrophobicContact CB-CB 4.41Å; L391-N406 PolarHBondContact N-OD1 3.4Å; L391-N406 PolarHBondContact O-ND2 3.3Å; S403-N406 VanDerWaalsContact O-CB 3.25Å; S403-N406 WeakPolarHBondContact O-CB 3.47Å; S403-N406 PolarHBondContact O-N 3.08Å; S403-N406 VanDerWaalsContact O-N 3.1Å; N406-K408 PolarHBondContact O-N 2.95Å
407	G	96.8	Very high	97	Very high	30 Å²	30	37.5 Å²	37.5	31%	0.309	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-1	-176.2	0	0	0	0	0	115.8	K388 L389	K388-G407 WeakPolarHBondContact CD-O 3.39Å; K388-G407 VanDerWaalsContact CG-O 3.25Å; K388-G407 WeakPolarHBondContact CG-O 3.44Å; L389-G407 VanDerWaalsContact O-CA 3.29Å; L389-G407 WeakPolarHBondContact O-CA 3.27Å; L389-G407 PolarHBondContact O-N 2.6Å
408	K	97.7	Very high	97	Very high	33 Å²	33	34.1 Å²	34.1	14%	0.143	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-85.7	150	179.2	-50.5	-63.1	158.3	175.3	0	111.6	K388 L389 N405 N406 E419 W433 N435	K388-K408 VanDerWaalsContact CA-O 3.28Å; K388-K408 WeakPolarHBondContact CA-O 3.36Å; K388-K408 WeakPolarHBondContact CG-O 3.46Å; L389-K408 PolarHBondContact N-O 2.82Å; N405-K408 WeakPolarHBondContact O-CB 3.43Å; N405-K408 WeakPolarHBondContact O-CG 3.49Å; N405-K408 PolarHBondContact O-N 2.91Å; N406-K408 PolarHBondContact O-N 2.95Å; K408-E419 WeakPolarHBondContact CD-OE1 3.37Å; K408-E419 IonicContact NZ-OE1 3.37Å; K408-E419 PolarHBondContact NZ-OE1 2.73Å; K408-E419 IonicContact NZ-OE2 3.75Å; K408-E419 PolarHBondContact NZ-OE2 3.03Å; K408-W433 HydrophobicContact CB-CB 4.42Å; K408-N435 HydrophobicContact CD-CB 4.12Å; K408-N435 WeakPolarHBondContact CE-ND2 3.01Å; K408-N435 HydrophobicContact CG-CB 4.09Å
409	Q	98.1	Very high	96.9	Very high	64 Å²	64	39.8 Å²	39.8	30%	0.299	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-78.1	158.2	174.4	-63.2	-177.7	56	0	0	110.3	E385 K388 R417 W433	E385-Q409 WeakPolarHBondContact O-CG 3.03Å; K388-Q409 HydrophobicContact CB-CG 4.37Å; Q409-R417 HydrophobicContact CB-CB 3.81Å; Q409-W433 WeakPolarHBondContact O-CA 3.48Å
410	F	98.5	Very high	96.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-74.3	138	171.2	-157.7	-93.2	0	0	0	110.3	W327 Y330 W342 L345 G386 F387 T412 G431 W433	W327-F410 HydrophobicContact CE3-CD1 4.36Å; W327-F410 HydrophobicContact CH2-CB 4.15Å; W327-F410 HydrophobicContact CZ3-CB 4Å; W327-F410 AromaticContact CZ3-CD1 3.86Å; W327-F410 HydrophobicContact CZ3-CD1 3.86Å; W327-F410 HydrophobicContact CZ3-CG 4.41Å; W327-F410 WeakPolarHBondContact CZ3-O 3.38Å; Y330-F410 AromaticContact CD1-CE1 3.7Å; Y330-F410 HydrophobicContact CD1-CE1 3.7Å; Y330-F410 AromaticContact CD1-CZ 3.45Å; Y330-F410 HydrophobicContact CD1-CZ 3.45Å; Y330-F410 VanDerWaalsContact CD1-CZ 3.45Å; Y330-F410 HydrophobicContact CD2-CE1 4.32Å; Y330-F410 HydrophobicContact CE1-CE1 4.39Å; Y330-F410 AromaticContact CE1-CZ 3.89Å; Y330-F410 HydrophobicContact CE1-CZ 3.89Å; Y330-F410 AromaticContact CG-CE1 3.67Å; Y330-F410 HydrophobicContact CG-CE1 3.67Å; Y330-F410 AromaticContact CG-CZ 3.95Å; Y330-F410 HydrophobicContact CG-CZ 3.95Å; W342-F410 HydrophobicContact CH2-CE2 4.15Å; W342-F410 HydrophobicContact CZ2-CE2 4.04Å; W342-F410 HydrophobicContact CZ2-CZ 4.14Å; L345-F410 HydrophobicContact CD1-CB 4.43Å; L345-F410 HydrophobicContact CD1-CD1 3.65Å; L345-F410 HydrophobicContact CD1-CD2 4.36Å; L345-F410 HydrophobicContact CD1-CE1 3.87Å; L345-F410 HydrophobicContact CD1-CG 3.9Å; L345-F410 HydrophobicContact CD1-CZ 4.3Å; L345-F410 HydrophobicContact CD2-CD2 3.86Å; L345-F410 HydrophobicContact CD2-CE2 4.03Å; L345-F410 HydrophobicContact CD2-CG 4.14Å; L345-F410 HydrophobicContact CD2-CZ 4.47Å; G386-F410 WeakPolarHBondContact O-CB 3.43Å; G386-F410 PolarHBondContact O-N 3.37Å; F387-F410 HydrophobicContact CB-CB 4.35Å; F410-T412 HydrophobicContact CD1-CG2 3.99Å; F410-T412 HydrophobicContact CE1-CG2 3.68Å; F410-G431 VanDerWaalsContact CZ-O 3.24Å; F410-G431 WeakPolarHBondContact CZ-O 3.49Å; F410-W433 AromaticContact CD2-CD1 3.94Å; F410-W433 AromaticContact CD2-CD2 3.79Å; F410-W433 HydrophobicContact CD2-CD2 3.79Å; F410-W433 AromaticContact CD2-CE2 3.58Å; F410-W433 HydrophobicContact CD2-CE3 4.35Å; F410-W433 HydrophobicContact CD2-CG 4.05Å; F410-W433 HydrophobicContact CD2-CZ2 4.01Å; F410-W433 AromaticContact CD2-NE1 3.67Å; F410-W433 HydrophobicContact CE2-CD2 4.25Å; F410-W433 HydrophobicContact CE2-CE3 4.37Å; F410-W433 HydrophobicContact CE2-CH2 4.45Å; F410-W433 HydrophobicContact CE2-CZ2 4.29Å; F410-W433 HydrophobicContact CE2-CZ3 4.47Å
411	T	98.3	Very high	96.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-128.3	138	-178.4	-71.3	0	0	0	0	110.6	R415 R417 D418 A425 G431 W432 Y434	T411-R415 WeakPolarHBondContact CA-O 3.17Å; T411-R417 WeakPolarHBondContact OG1-CA 3.31Å; T411-R417 PolarHBondContact OG1-N 3.31Å; T411-R417 VanDerWaalsContact OG1-N 3.09Å; T411-D418 HydrophobicContact CG2-CB 4.37Å; T411-D418 WeakPolarHBondContact CG2-OD2 3.35Å; T411-D418 PolarHBondContact OG1-N 3Å; T411-A425 HydrophobicContact CG2-CB 4.36Å; T411-G431 WeakPolarHBondContact O-CA 3.38Å; T411-W432 PolarHBondContact N-O 3.4Å; T411-W432 PolarHBondContact O-N 3Å; T411-W432 VanDerWaalsContact O-N 3.13Å; T411-Y434 HydrophobicContact CG2-CD2 4.19Å
412	T	98.3	Very high	96.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-130.9	171.1	175.3	55.5	0	0	0	0	111	W327 Y330 F410 D414 R415 N423	W327-T412 HydrophobicContact CE3-CG2 4.09Å; W327-T412 PolarHBondContact N-OG1 3.26Å; Y330-T412 HydrophobicContact CD2-CG2 3.65Å; Y330-T412 HydrophobicContact CE2-CG2 4.41Å; Y330-T412 HydrophobicContact CG-CG2 4.08Å; F410-T412 HydrophobicContact CD1-CG2 3.99Å; F410-T412 HydrophobicContact CE1-CG2 3.68Å; T412-D414 VanDerWaalsContact CB-OD1 3.28Å; T412-D414 WeakPolarHBondContact CB-OD1 3.2Å; T412-D414 PolarHBondContact O-N 3.02Å; T412-D414 PolarHBondContact OG1-OD1 3.27Å; T412-R415 PolarHBondContact N-O 3.38Å; T412-R415 CarbonylContact O-C 3.58Å; T412-R415 PolarHBondContact O-N 3.26Å; T412-R415 VanDerWaalsContact O-N 3.14Å; T412-N423 PolarHBondContact O-ND2 3.13Å
413	L	97.1	Very high	96.6	Very high	50 Å²	50	48 Å²	48	26%	0.262	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.8	-178.4	69.9	91.8	0	0	0	114.7	F324 R325 H426	F324-L413 HydrophobicContact CD1-CD2 4.3Å; F324-L413 HydrophobicContact CD2-CD2 3.84Å; F324-L413 HydrophobicContact CE1-CD2 4.11Å; F324-L413 HydrophobicContact CE2-CB 3.7Å; F324-L413 HydrophobicContact CE2-CD2 3.63Å; F324-L413 HydrophobicContact CE2-CG 4.31Å; F324-L413 HydrophobicContact CG-CD2 4.19Å; F324-L413 HydrophobicContact CZ-CB 3.99Å; F324-L413 HydrophobicContact CZ-CD2 3.77Å; F324-L413 HydrophobicContact CZ-CG 4.45Å; R325-L413 WeakPolarHBondContact O-CD2 3.43Å; L413-H426 PolarHBondContact O-CE1 3.19Å
414	D	97.8	Very high	96.7	Very high	83 Å²	83	46 Å²	46	44%	0.444	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-8.5	-177.7	61.2	-39.8	0	0	0	113.5	N326 W327 T412	N326-D414 WeakPolarHBondContact CA-OD1 3.47Å; N326-D414 HydrophobicContact CB-CB 4.41Å; N326-D414 WeakPolarHBondContact CB-OD2 3.42Å; W327-D414 WeakPolarHBondContact CB-OD2 3.45Å; W327-D414 VanDerWaalsContact N-CG 3.3Å; W327-D414 PolarHBondContact N-OD1 3.43Å; W327-D414 PolarHBondContact N-OD2 2.89Å; T412-D414 VanDerWaalsContact CB-OD1 3.28Å; T412-D414 WeakPolarHBondContact CB-OD1 3.2Å; T412-D414 PolarHBondContact O-N 3.02Å; T412-D414 PolarHBondContact OG1-OD1 3.27Å
415	R	97.3	Very high	96.8	Very high	75 Å²	75	44.5 Å²	44.5	28%	0.283	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-139.2	92	-179.4	-162.2	178.2	-170.4	165.8	-3	109.4	W327 E383 T411 T412 R417	W327-R415 HydrophobicContact CB-CB 4.33Å; W327-R415 HydrophobicContact CD2-CB 4.37Å; W327-R415 VanDerWaalsContact CD2-CD 3.41Å; W327-R415 HydrophobicContact CE3-CB 3.95Å; W327-R415 VanDerWaalsContact CE3-CD 3.46Å; W327-R415 HydrophobicContact CE3-CG 4.21Å; E383-R415 IonicContact OE1-NH1 2.67Å; E383-R415 PolarHBondContact OE1-NH1 2.89Å; T411-R415 WeakPolarHBondContact CA-O 3.17Å; T412-R415 PolarHBondContact N-O 3.38Å; T412-R415 CarbonylContact O-C 3.58Å; T412-R415 PolarHBondContact O-N 3.26Å; T412-R415 VanDerWaalsContact O-N 3.14Å; R415-R417 HydrophobicContact CG-CG 4.3Å
416	D	97.6	Very high	96.8	Very high	81 Å²	81	49 Å²	49	43%	0.433	26%	0.259	S	S	.	.			trans	-77.4	122.9	177.8	-159.3	-13.1	0	0	0	110.9	N423	D416-N423 HydrophobicContact CB-CB 4.37Å; D416-N423 WeakPolarHBondContact CB-ND2 3.47Å; D416-N423 WeakPolarHBondContact OD2-CA 3.33Å; D416-N423 VanDerWaalsContact OD2-CB 3.28Å; D416-N423 WeakPolarHBondContact OD2-CB 3.28Å; D416-N423 PolarHBondContact OD2-N 2.64Å
417	R	95.9	Very high	96.7	Very high	66 Å²	66	49.5 Å²	49.5	25%	0.249	26%	0.259	C	S	.	.			trans	-148.3	17.6	-179.3	-58.1	-171.7	124.4	178.2	-14.4	112.3	Q409 T411 R415	Q409-R417 HydrophobicContact CB-CB 3.81Å; T411-R417 WeakPolarHBondContact OG1-CA 3.31Å; T411-R417 PolarHBondContact OG1-N 3.31Å; T411-R417 VanDerWaalsContact OG1-N 3.09Å; R415-R417 HydrophobicContact CG-CG 4.3Å
418	D	96.1	Very high	96.7	Very high	21 Å²	21	49 Å²	49	11%	0.112	25%	0.248	C	C	.	.	S	Bend	trans	-90.2	-175	178.4	71.6	60.7	0	0	0	111.8	T411 F420 C424 Y434 N435	T411-D418 HydrophobicContact CG2-CB 4.37Å; T411-D418 WeakPolarHBondContact CG2-OD2 3.35Å; T411-D418 PolarHBondContact OG1-N 3Å; D418-F420 VanDerWaalsContact OD1-CB 3.26Å; D418-F420 WeakPolarHBondContact OD1-CB 3.4Å; D418-F420 PolarHBondContact OD1-N 2.99Å; D418-C424 VanDerWaalsContact CG-SG 3.58Å; D418-C424 WeakPolarHBondContact OD2-CB 3.45Å; D418-C424 PolarHBondContact OD2-N 2.68Å; D418-C424 PolarHBondContact OD2-SG 2.81Å; D418-Y434 WeakPolarHBondContact CB-O 3.45Å; D418-N435 WeakPolarHBondContact CB-O 3.49Å
419	E	95.1	Very high	96.6	Very high	120 Å²	120	50.5 Å²	50.5	56%	0.561	25%	0.254	S	S	*	.	S	Bend	trans	-107.4	9.3	-175.6	-73	174.9	-162.4	0	0	112.9	K408 N435	K408-E419 WeakPolarHBondContact CD-OE1 3.37Å; K408-E419 IonicContact NZ-OE1 3.37Å; K408-E419 PolarHBondContact NZ-OE1 2.73Å; K408-E419 IonicContact NZ-OE2 3.75Å; K408-E419 PolarHBondContact NZ-OE2 3.03Å; E419-N435 PolarHBondContact N-O 3.11Å; E419-N435 PolarHBondContact OE2-OD1 3.41Å
420	F	95.2	Very high	96.5	Very high	96 Å²	96	47.5 Å²	47.5	42%	0.421	24%	0.241	S	C	.	.	S	Bend	trans	-85.7	164.8	174.9	-168.3	-145.3	0	0	0	111.4	D418 G422 F427 A436	D418-F420 VanDerWaalsContact OD1-CB 3.26Å; D418-F420 WeakPolarHBondContact OD1-CB 3.4Å; D418-F420 PolarHBondContact OD1-N 2.99Å; F420-G422 WeakPolarHBondContact CD1-O 3.39Å; F420-G422 PolarHBondContact O-N 3.4Å; F420-F427 HydrophobicContact CD1-CE2 4.36Å; F420-F427 HydrophobicContact CE1-CD2 4.21Å; F420-F427 AromaticContact CE1-CE2 3.87Å; F420-F427 HydrophobicContact CE1-CE2 3.87Å; F420-A436 HydrophobicContact CB-CB 4.18Å
421	S	94.9	Very high	96.5	Very high	119 Å²	119	47.5 Å²	47.5	83%	0.832	24%	0.241	S	C	*	.	S	Bend	trans	-75	18.7	177.2	61.4	0	0	0	0	113.8
422	G	94.6	Very high	96.5	Very high	27 Å²	27	47.5 Å²	47.5	28%	0.278	24%	0.241	S	C	.	.	S	Bend	trans	162.5	134.8	177.8	0	0	0	0	0	112.3	F420 C424	F420-G422 WeakPolarHBondContact CD1-O 3.39Å; F420-G422 PolarHBondContact O-N 3.4Å; G422-C424 PolarHBondContact O-N 3.01Å
423	N	97	Very high	96.5	Very high	12 Å²	12	47.6 Å²	47.6	6%	0.064	24%	0.241	C	C	.	.			trans	-21.5	109	-174.3	-162.6	-72.6	0	0	0	118.3	T412 D416 A425 H426 F427	T412-N423 PolarHBondContact O-ND2 3.13Å; D416-N423 HydrophobicContact CB-CB 4.37Å; D416-N423 WeakPolarHBondContact CB-ND2 3.47Å; D416-N423 WeakPolarHBondContact OD2-CA 3.33Å; D416-N423 VanDerWaalsContact OD2-CB 3.28Å; D416-N423 WeakPolarHBondContact OD2-CB 3.28Å; D416-N423 PolarHBondContact OD2-N 2.64Å; N423-A425 VanDerWaalsContact C-N 3.34Å; N423-A425 PolarHBondContact O-N 3.48Å; N423-A425 VanDerWaalsContact OD1-CA 3.31Å; N423-A425 WeakPolarHBondContact OD1-CA 3.12Å; N423-A425 WeakPolarHBondContact OD1-CB 3.35Å; N423-A425 PolarHBondContact OD1-N 3.27Å; N423-H426 HydrophobicContact CB-CB 4.43Å; N423-H426 WeakPolarHBondContact O-CB 3.44Å; N423-H426 PolarHBondContact O-N 3.43Å; N423-H426 PolarHBondContact OD1-N 3.28Å; N423-F427 VanDerWaalsContact O-CD2 3.26Å; N423-F427 WeakPolarHBondContact O-CD2 3.25Å
424	C	97.1	Very high	96.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-30.9	174.3	-73.4	0	0	0	0	114	D418 G422 H426 F427 H428 Y434 C437	D418-C424 VanDerWaalsContact CG-SG 3.58Å; D418-C424 WeakPolarHBondContact OD2-CB 3.45Å; D418-C424 PolarHBondContact OD2-N 2.68Å; D418-C424 PolarHBondContact OD2-SG 2.81Å; G422-C424 PolarHBondContact O-N 3.01Å; C424-H426 VanDerWaalsContact C-N 3.26Å; C424-H426 PolarHBondContact O-N 2.88Å; C424-F427 PolarHBondContact O-N 2.98Å; C424-H428 PolarHBondContact O-N 3.39Å; C424-Y434 HydrophobicContact CB-CD1 4.1Å; C424-Y434 HydrophobicContact CB-CD2 3.81Å; C424-Y434 HydrophobicContact CB-CE2 4.49Å; C424-Y434 HydrophobicContact CB-CG 3.6Å; C424-C437 HydrophobicContact CB-CB 3.64Å; C424-C437 WeakPolarHBondContact CB-SG 3.16Å; C424-C437 WeakPolarHBondContact SG-CA 3.15Å; C424-C437 WeakPolarHBondContact SG-CB 3.49Å; C424-C437 CovalentContact SG-SG 2.03Å; C424-C437 PolarHBondContact SG-SG 2.97Å
425	A	97.2	Very high	96.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-28.2	176.7	0	0	0	0	0	112.4	T411 N423 F427 K429 G430 Y434	T411-A425 HydrophobicContact CG2-CB 4.36Å; N423-A425 VanDerWaalsContact C-N 3.34Å; N423-A425 PolarHBondContact O-N 3.48Å; N423-A425 VanDerWaalsContact OD1-CA 3.31Å; N423-A425 WeakPolarHBondContact OD1-CA 3.12Å; N423-A425 WeakPolarHBondContact OD1-CB 3.35Å; N423-A425 PolarHBondContact OD1-N 3.27Å; A425-F427 VanDerWaalsContact C-N 3.26Å; A425-F427 PolarHBondContact O-N 3.1Å; A425-K429 WeakPolarHBondContact O-CA 3.49Å; A425-K429 PolarHBondContact O-N 3.34Å; A425-G430 WeakPolarHBondContact CB-O 3.48Å; A425-Y434 HydrophobicContact CB-CD2 4.39Å; A425-Y434 HydrophobicContact CB-CE2 3.83Å
426	H	95.8	Very high	96.2	Very high	95 Å²	95	42.4 Å²	42.4	44%	0.44	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-30.5	169.9	-76.1	-5.8	0	0	0	113	L413 N423 C424 K429	L413-H426 PolarHBondContact O-CE1 3.19Å; N423-H426 HydrophobicContact CB-CB 4.43Å; N423-H426 WeakPolarHBondContact O-CB 3.44Å; N423-H426 PolarHBondContact O-N 3.43Å; N423-H426 PolarHBondContact OD1-N 3.28Å; C424-H426 VanDerWaalsContact C-N 3.26Å; C424-H426 PolarHBondContact O-N 2.88Å; H426-K429 WeakPolarHBondContact O-CE 3.38Å; H426-K429 PolarHBondContact O-NZ 3.24Å
427	F	94.7	Very high	95.8	Very high	68 Å²	68	39.4 Å²	39.4	30%	0.298	21%	0.213	S	C	.	.	H	α-helix	trans	-89.7	-49.3	179.2	-59.8	-68.5	0	0	0	111.9	F420 N423 C424 A425 F456	F420-F427 HydrophobicContact CD1-CE2 4.36Å; F420-F427 HydrophobicContact CE1-CD2 4.21Å; F420-F427 AromaticContact CE1-CE2 3.87Å; F420-F427 HydrophobicContact CE1-CE2 3.87Å; N423-F427 VanDerWaalsContact O-CD2 3.26Å; N423-F427 WeakPolarHBondContact O-CD2 3.25Å; C424-F427 PolarHBondContact O-N 2.98Å; A425-F427 VanDerWaalsContact C-N 3.26Å; A425-F427 PolarHBondContact O-N 3.1Å; F427-F456 HydrophobicContact CB-CD1 4.43Å; F427-F456 HydrophobicContact CB-CG 4.29Å; F427-F456 AromaticContact CD1-CD1 3.8Å; F427-F456 HydrophobicContact CD1-CD1 3.8Å; F427-F456 HydrophobicContact CD1-CD2 4.05Å; F427-F456 AromaticContact CD1-CE1 3.49Å; F427-F456 HydrophobicContact CD1-CE1 3.49Å; F427-F456 VanDerWaalsContact CD1-CE1 3.49Å; F427-F456 AromaticContact CD1-CE2 3.75Å; F427-F456 HydrophobicContact CD1-CE2 3.75Å; F427-F456 HydrophobicContact CD1-CG 4.06Å; F427-F456 AromaticContact CD1-CZ 3.46Å; F427-F456 HydrophobicContact CD1-CZ 3.46Å; F427-F456 VanDerWaalsContact CD1-CZ 3.46Å; F427-F456 AromaticContact CE1-CE1 3.87Å; F427-F456 HydrophobicContact CE1-CE1 3.87Å; F427-F456 HydrophobicContact CE1-CE2 4.25Å; F427-F456 AromaticContact CE1-CZ 3.66Å; F427-F456 HydrophobicContact CE1-CZ 3.66Å; F427-F456 HydrophobicContact CG-CD1 4.47Å; F427-F456 HydrophobicContact CG-CE1 4.5Å
428	H	95.7	Very high	95.4	Very high	20 Å²	20	37.5 Å²	37.5	9%	0.093	21%	0.214	C	C	.	.	H	α-helix	trans	-88.6	-8.3	-173.2	-71.8	-76.8	0	0	0	115.4	C424 G430 Y434 C437 N441 Q457 F461	C424-H428 PolarHBondContact O-N 3.39Å; H428-G430 PolarHBondContact O-N 2.99Å; H428-Y434 HydrophobicContact CB-CE1 3.76Å; H428-Y434 WeakPolarHBondContact CB-OH 3.4Å; H428-C437 VanDerWaalsContact CD2-CB 3.48Å; H428-C437 WeakPolarHBondContact CD2-CB 3.38Å; H428-C437 WeakPolarHBondContact NE2-CB 3.4Å; H428-N441 PolarHBondContact O-ND2 3.21Å; H428-Q457 PolarHBondContact CE1-O 2.99Å; H428-Q457 PolarHBondContact ND1-O 3.11Å; H428-F461 AromaticContact ND1-CE1 3.81Å
429	K	96.4	Very high	95.3	Very high	63 Å²	63	41.2 Å²	41.2	27%	0.274	23%	0.231	S	C	.	.			trans	62	8	172.4	-45.8	-57.5	-177.5	-174.4	0	116.8	F324 A425 H426 V445 D458	F324-K429 VanDerWaalsContact CA-O 3.23Å; F324-K429 WeakPolarHBondContact CA-O 3.48Å; F324-K429 VanDerWaalsContact CB-O 3.28Å; F324-K429 WeakPolarHBondContact CB-O 3.25Å; F324-K429 HydrophobicContact CD2-CB 4.1Å; F324-K429 HydrophobicContact CD2-CD 4.34Å; F324-K429 VanDerWaalsContact CD2-O 3.31Å; F324-K429 WeakPolarHBondContact CD2-O 3.24Å; F324-K429 HydrophobicContact CE2-CD 4.18Å; F324-K429 HydrophobicContact CG-CB 4.43Å; F324-K429 HydrophobicContact CZ-CD 4.43Å; F324-K429 PolarHBondContact N-O 3.41Å; A425-K429 WeakPolarHBondContact O-CA 3.49Å; A425-K429 PolarHBondContact O-N 3.34Å; H426-K429 WeakPolarHBondContact O-CE 3.38Å; H426-K429 PolarHBondContact O-NZ 3.24Å; K429-V445 HydrophobicContact CB-CG2 3.72Å; K429-V445 HydrophobicContact CG-CG2 3.91Å; K429-D458 HydrophobicContact CB-CB 4.41Å; K429-D458 HydrophobicContact CG-CB 3.73Å
430	G	96.9	Very high	95.3	Very high	2 Å²	2	35.6 Å²	35.6	2%	0.021	21%	0.205	C	C	.	.	S	Bend	trans	-105.1	172.6	168.9	0	0	0	0	0	112.3	A425 H428 Y434 N443	A425-G430 WeakPolarHBondContact CB-O 3.48Å; H428-G430 PolarHBondContact O-N 2.99Å; G430-Y434 WeakPolarHBondContact CA-OH 2.97Å; G430-Y434 PolarHBondContact N-OH 3.21Å; G430-Y434 PolarHBondContact O-OH 3.34Å; G430-N443 WeakPolarHBondContact CA-O 3.28Å
431	G	98.1	Very high	95.4	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.185	C	C	.	.			trans	-98.4	128.9	154.1	0	0	0	0	0	108.3	Y330 F410 T411 N443	Y330-G431 PolarHBondContact OH-N 2.91Å; F410-G431 VanDerWaalsContact CZ-O 3.24Å; F410-G431 WeakPolarHBondContact CZ-O 3.49Å; T411-G431 WeakPolarHBondContact O-CA 3.38Å; G431-N443 WeakPolarHBondContact O-CB 3.49Å; G431-N443 PolarHBondContact O-ND2 3.31Å
432	W	98.3	Very high	95.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-158	169.6	-173.7	-156.1	-126.5	0	0	0	111.8	W342 F402 T411 Y434 T440 L442 N443 L477	W342-W432 HydrophobicContact CZ3-CZ3 4.35Å; F402-W432 AromaticContact CD2-CZ2 3.84Å; F402-W432 HydrophobicContact CD2-CZ2 3.84Å; F402-W432 AromaticContact CE2-CE2 3.62Å; F402-W432 HydrophobicContact CE2-CH2 4.04Å; F402-W432 AromaticContact CE2-CZ2 3.25Å; F402-W432 HydrophobicContact CE2-CZ2 3.25Å; F402-W432 AromaticContact CE2-NE1 3.83Å; F402-W432 AromaticContact CZ-CH2 3.97Å; F402-W432 HydrophobicContact CZ-CH2 3.97Å; F402-W432 AromaticContact CZ-CZ2 3.65Å; F402-W432 HydrophobicContact CZ-CZ2 3.65Å; T411-W432 PolarHBondContact N-O 3.4Å; T411-W432 PolarHBondContact O-N 3Å; T411-W432 VanDerWaalsContact O-N 3.13Å; W432-Y434 HydrophobicContact CB-CD1 3.95Å; W432-Y434 HydrophobicContact CB-CD2 3.97Å; W432-Y434 HydrophobicContact CB-CE1 3.62Å; W432-Y434 HydrophobicContact CB-CE2 3.64Å; W432-Y434 HydrophobicContact CB-CG 4.11Å; W432-Y434 VanDerWaalsContact CB-CZ 3.45Å; W432-Y434 HydrophobicContact CG-CD1 4.48Å; W432-Y434 HydrophobicContact CG-CE1 4.22Å; W432-Y434 PolarHBondContact O-N 3.08Å; W432-T440 PolarHBondContact NE1-O 3.13Å; W432-T440 PolarHBondContact NE1-OG1 2.97Å; W432-L442 HydrophobicContact CH2-CB 3.86Å; W432-L442 HydrophobicContact CH2-CD1 3.92Å; W432-L442 HydrophobicContact CH2-CG 4.07Å; W432-L442 HydrophobicContact CZ2-CB 4.19Å; W432-L442 HydrophobicContact CZ2-CD1 4.12Å; W432-L442 HydrophobicContact CZ2-CG 4.05Å; W432-L442 HydrophobicContact CZ3-CB 4.29Å; W432-N443 HydrophobicContact CE3-CB 4.26Å; W432-L477 HydrophobicContact CH2-CD2 4.48Å
433	W	98.1	Very high	95.8	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	13%	0.132	C	C	.	.			trans	-78.1	59	171.2	-60.6	-81.5	0	0	0	111.3	W342 L345 L380 F387 L389 F402 N405 K408 Q409 F410	W342-W433 AromaticContact CH2-CH2 3.8Å; W342-W433 HydrophobicContact CH2-CH2 3.8Å; W342-W433 HydrophobicContact CH2-CZ3 4.2Å; L345-W433 HydrophobicContact CD2-CZ2 4.15Å; L380-W433 HydrophobicContact CD1-CZ2 4.01Å; L380-W433 HydrophobicContact CD2-CH2 4.42Å; L380-W433 HydrophobicContact CD2-CZ2 3.5Å; L380-W433 HydrophobicContact CG-CZ2 4.43Å; F387-W433 PolarHBondContact O-NE1 3.23Å; L389-W433 HydrophobicContact CB-CB 4.24Å; L389-W433 HydrophobicContact CB-CD2 4.04Å; L389-W433 HydrophobicContact CB-CG 3.7Å; L389-W433 HydrophobicContact CD1-CD2 4.47Å; L389-W433 HydrophobicContact CD2-CB 4.2Å; L389-W433 HydrophobicContact CD2-CD2 4.05Å; L389-W433 HydrophobicContact CD2-CE3 4.2Å; L389-W433 HydrophobicContact CD2-CG 4.08Å; L389-W433 HydrophobicContact CG-CD2 4.43Å; L389-W433 HydrophobicContact CG-CG 4.45Å; F402-W433 AromaticContact CE2-CE3 3.9Å; F402-W433 HydrophobicContact CE2-CE3 3.9Å; F402-W433 HydrophobicContact CE2-CZ3 4.41Å; F402-W433 AromaticContact CZ-CE3 3.65Å; F402-W433 HydrophobicContact CZ-CE3 3.65Å; F402-W433 AromaticContact CZ-CZ3 3.77Å; F402-W433 HydrophobicContact CZ-CZ3 3.77Å; N405-W433 HydrophobicContact CB-CB 4.28Å; N405-W433 WeakPolarHBondContact CB-O 3.28Å; N405-W433 PolarHBondContact ND2-O 3.45Å; K408-W433 HydrophobicContact CB-CB 4.42Å; Q409-W433 WeakPolarHBondContact O-CA 3.48Å; F410-W433 AromaticContact CD2-CD1 3.94Å; F410-W433 AromaticContact CD2-CD2 3.79Å; F410-W433 HydrophobicContact CD2-CD2 3.79Å; F410-W433 AromaticContact CD2-CE2 3.58Å; F410-W433 HydrophobicContact CD2-CE3 4.35Å; F410-W433 HydrophobicContact CD2-CG 4.05Å; F410-W433 HydrophobicContact CD2-CZ2 4.01Å; F410-W433 AromaticContact CD2-NE1 3.67Å; F410-W433 HydrophobicContact CE2-CD2 4.25Å; F410-W433 HydrophobicContact CE2-CE3 4.37Å; F410-W433 HydrophobicContact CE2-CH2 4.45Å; F410-W433 HydrophobicContact CE2-CZ2 4.29Å; F410-W433 HydrophobicContact CE2-CZ3 4.47Å
434	Y	98	Very high	95.8	Very high	1 Å²	1	23.6 Å²	23.6	0%	0.004	13%	0.13	C	C	.	.			trans	-63.2	143.7	-173.5	-65.9	-61.8	0	0	0	112.1	T411 D418 C424 A425 H428 G430 W432 C437 N441	T411-Y434 HydrophobicContact CG2-CD2 4.19Å; D418-Y434 WeakPolarHBondContact CB-O 3.45Å; C424-Y434 HydrophobicContact CB-CD1 4.1Å; C424-Y434 HydrophobicContact CB-CD2 3.81Å; C424-Y434 HydrophobicContact CB-CE2 4.49Å; C424-Y434 HydrophobicContact CB-CG 3.6Å; A425-Y434 HydrophobicContact CB-CD2 4.39Å; A425-Y434 HydrophobicContact CB-CE2 3.83Å; H428-Y434 HydrophobicContact CB-CE1 3.76Å; H428-Y434 WeakPolarHBondContact CB-OH 3.4Å; G430-Y434 WeakPolarHBondContact CA-OH 2.97Å; G430-Y434 PolarHBondContact N-OH 3.21Å; G430-Y434 PolarHBondContact O-OH 3.34Å; W432-Y434 HydrophobicContact CB-CD1 3.95Å; W432-Y434 HydrophobicContact CB-CD2 3.97Å; W432-Y434 HydrophobicContact CB-CE1 3.62Å; W432-Y434 HydrophobicContact CB-CE2 3.64Å; W432-Y434 HydrophobicContact CB-CG 4.11Å; W432-Y434 VanDerWaalsContact CB-CZ 3.45Å; W432-Y434 HydrophobicContact CG-CD1 4.48Å; W432-Y434 HydrophobicContact CG-CE1 4.22Å; W432-Y434 PolarHBondContact O-N 3.08Å; Y434-C437 CarbonylContact C-O 3.6Å; Y434-C437 WeakPolarHBondContact CA-O 3.41Å; Y434-C437 HydrophobicContact CD1-CB 4.46Å; Y434-C437 WeakPolarHBondContact CD1-O 3.26Å; Y434-N441 PolarHBondContact OH-OD1 3.44Å
435	N	94.8	Very high	95.8	Very high	39 Å²	39	25.9 Å²	25.9	21%	0.209	14%	0.143	C	C	.	.	S	Bend	trans	-101.2	-110.5	173	-174.2	-20.4	0	0	0	107.6	S404 K408 D418 E419 C437	S404-N435 PolarHBondContact O-ND2 3.5Å; K408-N435 HydrophobicContact CD-CB 4.12Å; K408-N435 WeakPolarHBondContact CE-ND2 3.01Å; K408-N435 HydrophobicContact CG-CB 4.09Å; D418-N435 WeakPolarHBondContact CB-O 3.49Å; E419-N435 PolarHBondContact N-O 3.11Å; E419-N435 PolarHBondContact OE2-OD1 3.41Å; N435-C437 PolarHBondContact N-O 3.34Å
436	A	93.5	Very high	95.8	Very high	60 Å²	60	28.6 Å²	28.6	50%	0.496	15%	0.154	S	C	.	.	S	Bend	trans	-133.3	61.1	170.8	0	0	0	0	0	113.1	F420	F420-A436 HydrophobicContact CB-CB 4.18Å
437	C	88.9	Confident	95.9	Very high	18 Å²	18	27.1 Å²	27.1	12%	0.122	15%	0.145	C	C	.	.	S	Bend	cis	-101.2	-14	-1.3	-70.1	0	0	0	0	113.6	C424 H428 Y434 N435	C424-C437 HydrophobicContact CB-CB 3.64Å; C424-C437 WeakPolarHBondContact CB-SG 3.16Å; C424-C437 WeakPolarHBondContact SG-CA 3.15Å; C424-C437 WeakPolarHBondContact SG-CB 3.49Å; C424-C437 CovalentContact SG-SG 2.03Å; C424-C437 PolarHBondContact SG-SG 2.97Å; H428-C437 VanDerWaalsContact CD2-CB 3.48Å; H428-C437 WeakPolarHBondContact CD2-CB 3.38Å; H428-C437 WeakPolarHBondContact NE2-CB 3.4Å; Y434-C437 CarbonylContact C-O 3.6Å; Y434-C437 WeakPolarHBondContact CA-O 3.41Å; Y434-C437 HydrophobicContact CD1-CB 4.46Å; Y434-C437 WeakPolarHBondContact CD1-O 3.26Å; N435-C437 PolarHBondContact N-O 3.34Å
438	G	86.6	Confident	95.9	Very high	26 Å²	26	28.1 Å²	28.1	27%	0.268	16%	0.16	S	C	.	.			trans	121	174.5	178.2	0	0	0	0	0	113.8
439	Q	93.7	Very high	95.6	Very high	99 Å²	99	29.4 Å²	29.4	46%	0.463	18%	0.179	S	C	.	.	S	Bend	trans	-103.7	5.8	-174.1	-71.2	-179.6	-20.6	0	0	114.2	S401 S404 F461 A463	S401-Q439 WeakPolarHBondContact O-CB 3.43Å; S404-Q439 PolarHBondContact OG-N 2.97Å; Q439-F461 WeakPolarHBondContact O-CE2 3.47Å; Q439-A463 HydrophobicContact CB-CB 3.71Å; Q439-A463 HydrophobicContact CG-CB 4.09Å; Q439-A463 VanDerWaalsContact O-CB 3.29Å; Q439-A463 WeakPolarHBondContact O-CB 3.36Å; Q439-A463 PolarHBondContact O-N 3.18Å
440	T	96.6	Very high	95.4	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.012	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-137.4	149.3	176.8	58.5	0	0	0	0	111.4	S401 F402 N405 W432 W462	S401-T440 VanDerWaalsContact CB-CG2 3.48Å; F402-T440 HydrophobicContact CB-CG2 4.15Å; N405-T440 PolarHBondContact OD1-OG1 3.22Å; W432-T440 PolarHBondContact NE1-O 3.13Å; W432-T440 PolarHBondContact NE1-OG1 2.97Å; T440-W462 HydrophobicContact CG2-CD2 3.86Å; T440-W462 HydrophobicContact CG2-CE3 3.36Å; T440-W462 HydrophobicContact CG2-CH2 4.31Å; T440-W462 HydrophobicContact CG2-CZ3 3.62Å
441	N	97.3	Very high	95.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.197	C	C	.	.			trans	-148.8	57.4	175.1	-171.4	40.6	0	0	0	111.4	H428 Y434 N443 G444 D458 G459 I460 F461	H428-N441 PolarHBondContact O-ND2 3.21Å; Y434-N441 PolarHBondContact OH-OD1 3.44Å; N441-N443 PolarHBondContact O-N 3.3Å; N441-N443 VanDerWaalsContact O-N 3.11Å; N441-G444 VanDerWaalsContact ND2-CA 3.29Å; N441-G444 WeakPolarHBondContact ND2-CA 3.46Å; N441-G444 PolarHBondContact O-N 2.92Å; N441-D458 PolarHBondContact ND2-O 3.45Å; N441-G459 PolarHBondContact ND2-O 3.4Å; N441-I460 WeakPolarHBondContact O-CA 3.42Å; N441-F461 HydrophobicContact CB-CD1 3.61Å; N441-F461 HydrophobicContact CB-CE1 3.33Å; N441-F461 HydrophobicContact CB-CG 4.46Å; N441-F461 HydrophobicContact CB-CZ 4.03Å; N441-F461 PolarHBondContact N-O 3.17Å
442	L	98	Very high	95.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.4	-173.4	-57.1	-177.2	0	0	0	113.3	Q314 R316 V361 L363 W432 I460 W462 V475 L477	Q314-L442 PolarHBondContact NE2-O 3.47Å; R316-L442 PolarHBondContact NH1-O 2.98Å; V361-L442 HydrophobicContact CG1-CD1 3.56Å; L363-L442 HydrophobicContact CD2-CD2 4.1Å; W432-L442 HydrophobicContact CH2-CB 3.86Å; W432-L442 HydrophobicContact CH2-CD1 3.92Å; W432-L442 HydrophobicContact CH2-CG 4.07Å; W432-L442 HydrophobicContact CZ2-CB 4.19Å; W432-L442 HydrophobicContact CZ2-CD1 4.12Å; W432-L442 HydrophobicContact CZ2-CG 4.05Å; W432-L442 HydrophobicContact CZ3-CB 4.29Å; L442-I460 HydrophobicContact CD2-CG2 4.48Å; L442-W462 HydrophobicContact CD1-CE3 4.44Å; L442-W462 HydrophobicContact CD1-CZ3 4.25Å; L442-W462 HydrophobicContact CD2-CE3 4.16Å; L442-V475 HydrophobicContact CB-CG1 4.24Å; L442-V475 HydrophobicContact CD1-CG1 4.02Å; L442-V475 HydrophobicContact CD2-CG1 4.03Å; L442-V475 HydrophobicContact CD2-CG2 4.24Å; L442-V475 HydrophobicContact CG-CG1 4.31Å; L442-L477 HydrophobicContact CD1-CD1 4.4Å
443	N	98.3	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	12.5	174	-72.4	-12.6	0	0	0	113.8	Q314 F323 Y330 W342 G430 G431 W432 N441	Q314-N443 WeakPolarHBondContact CG-OD1 3.43Å; Q314-N443 PolarHBondContact NE2-OD1 3.24Å; F323-N443 WeakPolarHBondContact CB-O 3.48Å; F323-N443 HydrophobicContact CD1-CB 4.02Å; Y330-N443 WeakPolarHBondContact CE1-ND2 3.44Å; W342-N443 WeakPolarHBondContact CZ3-ND2 3.44Å; G430-N443 WeakPolarHBondContact CA-O 3.28Å; G431-N443 WeakPolarHBondContact O-CB 3.49Å; G431-N443 PolarHBondContact O-ND2 3.31Å; W432-N443 HydrophobicContact CE3-CB 4.26Å; N441-N443 PolarHBondContact O-N 3.3Å; N441-N443 VanDerWaalsContact O-N 3.11Å
444	G	97.1	Very high	94.5	Very high	2 Å²	2	45.8 Å²	45.8	2%	0.021	26%	0.257	C	S	.	.	S	Bend	trans	-70.7	-173.6	178.6	0	0	0	0	0	115.8	R316 N441 D458	R316-G444 PolarHBondContact NH1-O 3.08Å; R316-G444 PolarHBondContact NH2-O 3.45Å; N441-G444 VanDerWaalsContact ND2-CA 3.29Å; N441-G444 WeakPolarHBondContact ND2-CA 3.46Å; N441-G444 PolarHBondContact O-N 2.92Å; G444-D458 WeakPolarHBondContact CA-O 3.25Å
445	V	97.6	Very high	94.2	Very high	48 Å²	48	54 Å²	54	29%	0.291	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-67.3	126.7	173.2	-174.3	0	0	0	0	109.7	K429 Y447 D458 G459 I460 S471	K429-V445 HydrophobicContact CB-CG2 3.72Å; K429-V445 HydrophobicContact CG-CG2 3.91Å; V445-Y447 HydrophobicContact CB-CD2 4.12Å; V445-Y447 HydrophobicContact CB-CE2 3.65Å; V445-Y447 HydrophobicContact CG1-CD2 4.02Å; V445-Y447 HydrophobicContact CG1-CE1 4.17Å; V445-Y447 HydrophobicContact CG1-CE2 3.63Å; V445-Y447 HydrophobicContact CG1-CG 4.46Å; V445-Y447 HydrophobicContact CG2-CE2 4.47Å; V445-Y447 PolarHBondContact O-N 3.49Å; V445-D458 HydrophobicContact CG2-CB 4.23Å; V445-D458 PolarHBondContact N-O 2.88Å; V445-G459 CarbonylContact O-C 3.58Å; V445-G459 VanDerWaalsContact O-CA 3.29Å; V445-G459 WeakPolarHBondContact O-CA 3.36Å; V445-I460 PolarHBondContact O-N 3.45Å; V445-S471 PolarHBondContact O-OG 3.3Å
446	W	97.6	Very high	94.1	Very high	57 Å²	57	55.4 Å²	55.4	22%	0.216	30%	0.297	C	S	.	.			trans	-76.8	115.1	171.8	-171.5	95.1	0	0	0	109.1	W366 I460 K473	W366-W446 AromaticContact CH2-CH2 3.63Å; W366-W446 HydrophobicContact CH2-CH2 3.63Å; W366-W446 AromaticContact CH2-CZ2 3.45Å; W366-W446 HydrophobicContact CH2-CZ2 3.45Å; W366-W446 VanDerWaalsContact CH2-CZ2 3.45Å; W366-W446 HydrophobicContact CZ2-CH2 4.21Å; W366-W446 AromaticContact CZ2-CZ2 3.74Å; W366-W446 HydrophobicContact CZ2-CZ2 3.74Å; W446-I460 HydrophobicContact CB-CD1 3.68Å; W446-I460 HydrophobicContact CG-CD1 3.98Å; W446-K473 PolarHBondContact NE1-O 2.99Å
447	Y	97	Very high	94.1	Very high	64 Å²	64	55.8 Å²	55.8	25%	0.251	29%	0.288	S	S	.	.			trans	-107.3	123.5	174.1	-72.9	-78.3	0	0	0	111.3	W366 V445 Y452 D458 S471	W366-Y447 WeakPolarHBondContact CZ2-O 3.4Å; V445-Y447 HydrophobicContact CB-CD2 4.12Å; V445-Y447 HydrophobicContact CB-CE2 3.65Å; V445-Y447 HydrophobicContact CG1-CD2 4.02Å; V445-Y447 HydrophobicContact CG1-CE1 4.17Å; V445-Y447 HydrophobicContact CG1-CE2 3.63Å; V445-Y447 HydrophobicContact CG1-CG 4.46Å; V445-Y447 HydrophobicContact CG2-CE2 4.47Å; V445-Y447 PolarHBondContact O-N 3.49Å; Y447-Y452 HydrophobicContact CD1-CG 4.4Å; Y447-Y452 AromaticContact CD2-CD1 3.92Å; Y447-Y452 HydrophobicContact CD2-CD1 3.92Å; Y447-Y452 AromaticContact CD2-CD2 3.53Å; Y447-Y452 HydrophobicContact CD2-CD2 3.53Å; Y447-Y452 HydrophobicContact CD2-CE1 4.39Å; Y447-Y452 HydrophobicContact CD2-CE2 4.04Å; Y447-Y452 AromaticContact CD2-CG 3.47Å; Y447-Y452 HydrophobicContact CD2-CG 3.47Å; Y447-Y452 VanDerWaalsContact CD2-CG 3.47Å; Y447-Y452 HydrophobicContact CE1-CD2 4.45Å; Y447-Y452 AromaticContact CE2-CD2 3.37Å; Y447-Y452 HydrophobicContact CE2-CD2 3.37Å; Y447-Y452 AromaticContact CE2-CE2 3.71Å; Y447-Y452 HydrophobicContact CE2-CE2 3.71Å; Y447-Y452 AromaticContact CE2-CG 3.86Å; Y447-Y452 HydrophobicContact CE2-CG 3.86Å; Y447-Y452 HydrophobicContact CG-CD1 4.36Å; Y447-Y452 HydrophobicContact CG-CD2 4.13Å; Y447-Y452 AromaticContact CG-CG 3.77Å; Y447-Y452 HydrophobicContact CG-CG 3.77Å; Y447-Y452 AromaticContact CZ-CD2 3.88Å; Y447-D458 WeakPolarHBondContact CE2-OD1 3.33Å; Y447-D458 PolarHBondContact OH-OD1 3.21Å; Y447-S471 PolarHBondContact N-OG 3.46Å; Y447-S471 VanDerWaalsContact N-OG 3.14Å
448	S	94.4	Very high	94.5	Very high	88 Å²	88	55.2 Å²	55.2	62%	0.615	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	139.8	175.5	-169	0	0	0	0	112	G450	S448-G450 VanDerWaalsContact C-N 3.33Å
449	G	91.4	Very high	95	Very high	48 Å²	48	54 Å²	54	50%	0.495	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	3.8	178.5	0	0	0	0	0	115.7	V451	G449-V451 PolarHBondContact O-N 3.23Å
450	G	91.7	Very high	95.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.25	C	C	.	.	S	Bend	trans	82.9	-72.3	169.8	0	0	0	0	0	114.5	S448 Y452 Y470 S471	S448-G450 VanDerWaalsContact C-N 3.33Å; G450-Y452 PolarHBondContact O-N 3.1Å; G450-Y470 WeakPolarHBondContact O-CA 3.39Å; G450-S471 WeakPolarHBondContact CA-O 3.21Å; G450-S471 PolarHBondContact O-N 2.94Å
451	V	94.2	Very high	95.2	Very high	112 Å²	112	49.4 Å²	49.4	68%	0.679	25%	0.25	S	C	*	.	B	Isolated β-bridge	trans	-75.1	115	-178.8	-179.8	0	0	0	0	109.7	G449 Y470	G449-V451 PolarHBondContact O-N 3.23Å; V451-Y470 HydrophobicContact CG2-CD2 3.95Å; V451-Y470 HydrophobicContact CG2-CE2 4.3Å
452	Y	94.3	Very high	95.2	Very high	15 Å²	15	49.4 Å²	49.4	6%	0.059	25%	0.25	C	C	.	.			trans	-117.8	168.9	-177	71	-83.1	0	0	0	112.3	Y447 G450 Q457 D458 G459 G468 F469	Y447-Y452 HydrophobicContact CD1-CG 4.4Å; Y447-Y452 AromaticContact CD2-CD1 3.92Å; Y447-Y452 HydrophobicContact CD2-CD1 3.92Å; Y447-Y452 AromaticContact CD2-CD2 3.53Å; Y447-Y452 HydrophobicContact CD2-CD2 3.53Å; Y447-Y452 HydrophobicContact CD2-CE1 4.39Å; Y447-Y452 HydrophobicContact CD2-CE2 4.04Å; Y447-Y452 AromaticContact CD2-CG 3.47Å; Y447-Y452 HydrophobicContact CD2-CG 3.47Å; Y447-Y452 VanDerWaalsContact CD2-CG 3.47Å; Y447-Y452 HydrophobicContact CE1-CD2 4.45Å; Y447-Y452 AromaticContact CE2-CD2 3.37Å; Y447-Y452 HydrophobicContact CE2-CD2 3.37Å; Y447-Y452 AromaticContact CE2-CE2 3.71Å; Y447-Y452 HydrophobicContact CE2-CE2 3.71Å; Y447-Y452 AromaticContact CE2-CG 3.86Å; Y447-Y452 HydrophobicContact CE2-CG 3.86Å; Y447-Y452 HydrophobicContact CG-CD1 4.36Å; Y447-Y452 HydrophobicContact CG-CD2 4.13Å; Y447-Y452 AromaticContact CG-CG 3.77Å; Y447-Y452 HydrophobicContact CG-CG 3.77Å; Y447-Y452 AromaticContact CZ-CD2 3.88Å; G450-Y452 PolarHBondContact O-N 3.1Å; Y452-Q457 WeakPolarHBondContact OH-CA 3.06Å; Y452-D458 VanDerWaalsContact CE2-OD1 3.27Å; Y452-D458 WeakPolarHBondContact CE2-OD1 3.29Å; Y452-D458 PolarHBondContact OH-N 2.86Å; Y452-G459 VanDerWaalsContact CZ-N 3.34Å; Y452-G459 PolarHBondContact OH-N 3.12Å; Y452-G468 PolarHBondContact OH-O 2.6Å; Y452-F469 VanDerWaalsContact CD1-O 3.27Å; Y452-F469 WeakPolarHBondContact CD1-O 3.35Å; Y452-F469 WeakPolarHBondContact CE1-O 3.31Å; Y452-F469 HydrophobicContact CE2-CD1 4.49Å; Y452-F469 PolarHBondContact N-O 2.75Å
453	R	92.1	Very high	95.2	Very high	243 Å²	243	51.2 Å²	51.2	92%	0.917	27%	0.265	S	S	*	.			trans	-130.7	99.8	176.2	-65.8	-173.5	-179.4	104.2	-1.7	109.9
454	S	92.1	Very high	95.1	Very high	40 Å²	40	53.8 Å²	53.8	28%	0.28	29%	0.286	S	S	.	.			trans	-120.8	171.2	166.9	-175.7	0	0	0	0	109.9	F456 D458	S454-F456 WeakPolarHBondContact CB-O 3.26Å; S454-D458 WeakPolarHBondContact CB-OD1 3.32Å; S454-D458 WeakPolarHBondContact CB-OD2 3.5Å; S454-D458 VanDerWaalsContact OG-CG 3.27Å; S454-D458 PolarHBondContact OG-OD1 3.25Å; S454-D458 PolarHBondContact OG-OD2 2.98Å
455	K	91.8	Very high	95	Very high	174 Å²	174	55.1 Å²	55.1	76%	0.757	29%	0.291	S	S	*	.	S	Bend	trans	-70.5	-24.6	172.6	-178.6	178.3	172.8	-172	0	111.8
456	F	92.8	Very high	94.5	Very high	67 Å²	67	55.7 Å²	55.7	29%	0.294	31%	0.306	S	S	.	.	S	Bend	trans	-128.4	173	-177.7	-55.9	-70.9	0	0	0	109.9	F427 S454 D458	F427-F456 HydrophobicContact CB-CD1 4.43Å; F427-F456 HydrophobicContact CB-CG 4.29Å; F427-F456 AromaticContact CD1-CD1 3.8Å; F427-F456 HydrophobicContact CD1-CD1 3.8Å; F427-F456 HydrophobicContact CD1-CD2 4.05Å; F427-F456 AromaticContact CD1-CE1 3.49Å; F427-F456 HydrophobicContact CD1-CE1 3.49Å; F427-F456 VanDerWaalsContact CD1-CE1 3.49Å; F427-F456 AromaticContact CD1-CE2 3.75Å; F427-F456 HydrophobicContact CD1-CE2 3.75Å; F427-F456 HydrophobicContact CD1-CG 4.06Å; F427-F456 AromaticContact CD1-CZ 3.46Å; F427-F456 HydrophobicContact CD1-CZ 3.46Å; F427-F456 VanDerWaalsContact CD1-CZ 3.46Å; F427-F456 AromaticContact CE1-CE1 3.87Å; F427-F456 HydrophobicContact CE1-CE1 3.87Å; F427-F456 HydrophobicContact CE1-CE2 4.25Å; F427-F456 AromaticContact CE1-CZ 3.66Å; F427-F456 HydrophobicContact CE1-CZ 3.66Å; F427-F456 HydrophobicContact CG-CD1 4.47Å; F427-F456 HydrophobicContact CG-CE1 4.5Å; S454-F456 WeakPolarHBondContact CB-O 3.26Å; F456-D458 VanDerWaalsContact C-N 3.26Å; F456-D458 PolarHBondContact O-N 2.92Å; F456-D458 VanDerWaalsContact O-N 3.15Å
457	Q	93.3	Very high	94.3	Very high	68 Å²	68	53.9 Å²	53.9	32%	0.318	31%	0.306	S	S	.	.			trans	-88.3	64.4	176.2	-70.3	179.8	-17.1	0	0	110.1	H428 Y452 F461 G468 F469	H428-Q457 PolarHBondContact CE1-O 2.99Å; H428-Q457 PolarHBondContact ND1-O 3.11Å; Y452-Q457 WeakPolarHBondContact OH-CA 3.06Å; Q457-F461 HydrophobicContact CB-CD1 4.45Å; Q457-F461 HydrophobicContact CB-CE1 4.11Å; Q457-F461 VanDerWaalsContact O-CE1 3.23Å; Q457-F461 WeakPolarHBondContact O-CE1 3.49Å; Q457-G468 WeakPolarHBondContact CB-O 3.15Å; Q457-G468 WeakPolarHBondContact CG-O 3.39Å; Q457-F469 HydrophobicContact CG-CD1 3.95Å; Q457-F469 HydrophobicContact CG-CD2 4.36Å; Q457-F469 HydrophobicContact CG-CE1 3.61Å; Q457-F469 HydrophobicContact CG-CE2 4.06Å; Q457-F469 HydrophobicContact CG-CG 4.31Å; Q457-F469 HydrophobicContact CG-CZ 3.67Å
458	D	96.1	Very high	94.1	Very high	7 Å²	7	51.3 Å²	51.3	4%	0.037	30%	0.299	C	S	.	.			trans	-87.8	-2.9	-173.7	47.4	15.4	0	0	0	115.1	K429 N441 G444 V445 Y447 Y452 S454 F456	K429-D458 HydrophobicContact CB-CB 4.41Å; K429-D458 HydrophobicContact CG-CB 3.73Å; N441-D458 PolarHBondContact ND2-O 3.45Å; G444-D458 WeakPolarHBondContact CA-O 3.25Å; V445-D458 HydrophobicContact CG2-CB 4.23Å; V445-D458 PolarHBondContact N-O 2.88Å; Y447-D458 WeakPolarHBondContact CE2-OD1 3.33Å; Y447-D458 PolarHBondContact OH-OD1 3.21Å; Y452-D458 VanDerWaalsContact CE2-OD1 3.27Å; Y452-D458 WeakPolarHBondContact CE2-OD1 3.29Å; Y452-D458 PolarHBondContact OH-N 2.86Å; S454-D458 WeakPolarHBondContact CB-OD1 3.32Å; S454-D458 WeakPolarHBondContact CB-OD2 3.5Å; S454-D458 VanDerWaalsContact OG-CG 3.27Å; S454-D458 PolarHBondContact OG-OD1 3.25Å; S454-D458 PolarHBondContact OG-OD2 2.98Å; F456-D458 VanDerWaalsContact C-N 3.26Å; F456-D458 PolarHBondContact O-N 2.92Å; F456-D458 VanDerWaalsContact O-N 3.15Å
459	G	96.8	Very high	94.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-69.2	172.9	176.7	0	0	0	0	0	115	N441 V445 Y452 F461	N441-G459 PolarHBondContact ND2-O 3.4Å; V445-G459 CarbonylContact O-C 3.58Å; V445-G459 VanDerWaalsContact O-CA 3.29Å; V445-G459 WeakPolarHBondContact O-CA 3.36Å; Y452-G459 VanDerWaalsContact CZ-N 3.34Å; Y452-G459 PolarHBondContact OH-N 3.12Å; G459-F461 WeakPolarHBondContact O-CD1 3.31Å; G459-F461 PolarHBondContact O-N 2.84Å; G459-F461 VanDerWaalsContact O-N 3.08Å
460	I	97.9	Very high	94.3	Very high	1 Å²	1	52 Å²	52	1%	0.005	28%	0.276	C	S	.	.	S	Bend	trans	-78.4	83.3	171.2	-58.8	168.9	0	0	0	109.1	R316 N441 L442 V445 W446 S471 L472 V475	R316-I460 HydrophobicContact CB-CD1 4.07Å; R316-I460 HydrophobicContact CG-CD1 4.07Å; N441-I460 WeakPolarHBondContact O-CA 3.42Å; L442-I460 HydrophobicContact CD2-CG2 4.48Å; V445-I460 PolarHBondContact O-N 3.45Å; W446-I460 HydrophobicContact CB-CD1 3.68Å; W446-I460 HydrophobicContact CG-CD1 3.98Å; I460-S471 PolarHBondContact N-OG 3.11Å; I460-S471 CarbonylContact O-C 3.35Å; I460-S471 WeakPolarHBondContact O-CA 3.33Å; I460-L472 HydrophobicContact CG2-CB 4.19Å; I460-L472 WeakPolarHBondContact O-CG 3.36Å; I460-L472 PolarHBondContact O-N 2.83Å; I460-V475 HydrophobicContact CG2-CG2 3.64Å
461	F	97.4	Very high	94.6	Very high	3 Å²	3	52 Å²	52	1%	0.013	28%	0.276	C	S	.	.			trans	-113.1	157.7	-173.5	78.4	-94.9	0	0	0	114	H428 Q439 N441 Q457 G459 Y470	H428-F461 AromaticContact ND1-CE1 3.81Å; Q439-F461 WeakPolarHBondContact O-CE2 3.47Å; N441-F461 HydrophobicContact CB-CD1 3.61Å; N441-F461 HydrophobicContact CB-CE1 3.33Å; N441-F461 HydrophobicContact CB-CG 4.46Å; N441-F461 HydrophobicContact CB-CZ 4.03Å; N441-F461 PolarHBondContact N-O 3.17Å; Q457-F461 HydrophobicContact CB-CD1 4.45Å; Q457-F461 HydrophobicContact CB-CE1 4.11Å; Q457-F461 VanDerWaalsContact O-CE1 3.23Å; Q457-F461 WeakPolarHBondContact O-CE1 3.49Å; G459-F461 WeakPolarHBondContact O-CD1 3.31Å; G459-F461 PolarHBondContact O-N 2.84Å; G459-F461 VanDerWaalsContact O-N 3.08Å; F461-Y470 WeakPolarHBondContact CB-O 3.19Å
462	W	97.9	Very high	94.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-130.8	116.9	168.2	-171.9	-89.8	0	0	0	107.1	V361 L363 A373 Y375 A398 G399 F402 T440 L442 A464 Y465 G467 L472	V361-W462 HydrophobicContact CB-CZ3 4.43Å; V361-W462 HydrophobicContact CG1-CZ3 4.11Å; V361-W462 HydrophobicContact CG2-CH2 4.17Å; V361-W462 HydrophobicContact CG2-CZ3 4.25Å; L363-W462 HydrophobicContact CD1-CB 3.8Å; L363-W462 HydrophobicContact CD1-CD2 3.84Å; L363-W462 HydrophobicContact CD1-CE3 4.22Å; L363-W462 HydrophobicContact CD1-CG 3.66Å; L363-W462 HydrophobicContact CD2-CE3 4.49Å; A373-W462 HydrophobicContact CB-CH2 3.65Å; A373-W462 HydrophobicContact CB-CZ2 3.46Å; A373-W462 VanDerWaalsContact CB-CZ2 3.46Å; Y375-W462 HydrophobicContact CE2-CH2 4.2Å; Y375-W462 WeakPolarHBondContact OH-CH2 3.03Å; Y375-W462 WeakPolarHBondContact OH-CZ2 3.33Å; A398-W462 PolarHBondContact O-NE1 2.87Å; G399-W462 WeakPolarHBondContact O-CZ2 3.29Å; G399-W462 PolarHBondContact O-NE1 3.27Å; F402-W462 HydrophobicContact CB-CH2 3.7Å; F402-W462 HydrophobicContact CB-CZ3 4.02Å; T440-W462 HydrophobicContact CG2-CD2 3.86Å; T440-W462 HydrophobicContact CG2-CE3 3.36Å; T440-W462 HydrophobicContact CG2-CH2 4.31Å; T440-W462 HydrophobicContact CG2-CZ3 3.62Å; L442-W462 HydrophobicContact CD1-CE3 4.44Å; L442-W462 HydrophobicContact CD1-CZ3 4.25Å; L442-W462 HydrophobicContact CD2-CE3 4.16Å; W462-A464 VanDerWaalsContact C-N 3.31Å; W462-A464 PolarHBondContact O-N 3.14Å; W462-Y465 CarbonylContact O-C 3.46Å; W462-Y465 PolarHBondContact O-N 3.38Å; W462-G467 PolarHBondContact O-N 3.02Å; W462-L472 HydrophobicContact CB-CD1 4.3Å
463	A	96.4	Very high	94.9	Very high	38 Å²	38	49.3 Å²	49.3	31%	0.314	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-37.4	-165.3	0	0	0	0	0	113.4	S401 Q439 Y465 G467	S401-A463 PolarHBondContact OG-N 2.98Å; Q439-A463 HydrophobicContact CB-CB 3.71Å; Q439-A463 HydrophobicContact CG-CB 4.09Å; Q439-A463 VanDerWaalsContact O-CB 3.29Å; Q439-A463 WeakPolarHBondContact O-CB 3.36Å; Q439-A463 PolarHBondContact O-N 3.18Å; A463-Y465 PolarHBondContact O-N 3.45Å; A463-G467 WeakPolarHBondContact O-CA 3.41Å
464	A	96.2	Very high	95.2	Very high	55 Å²	55	38.6 Å²	38.6	46%	0.455	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-9	176.3	0	0	0	0	0	114.4	A398 S401 W462	A398-A464 WeakPolarHBondContact O-CB 3.34Å; S401-A464 WeakPolarHBondContact OG-CB 3.47Å; S401-A464 PolarHBondContact OG-N 3.3Å; W462-A464 VanDerWaalsContact C-N 3.31Å; W462-A464 PolarHBondContact O-N 3.14Å
465	Y	95.4	Very high	95.4	Very high	29 Å²	29	36.7 Å²	36.7	11%	0.114	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-135	96.9	-177.5	-164	-99	0	0	0	112.5	D365 K369 V371 W462 A463 G467 L472	D365-Y465 HydrophobicContact CB-CE1 4.14Å; D365-Y465 PolarHBondContact OD2-OH 2.84Å; K369-Y465 VanDerWaalsContact CD-OH 3.22Å; K369-Y465 WeakPolarHBondContact CD-OH 3.47Å; K369-Y465 WeakPolarHBondContact CE-OH 3.29Å; K369-Y465 PolarHBondContact NZ-OH 3.01Å; K369-Y465 VanDerWaalsContact NZ-OH 3.15Å; V371-Y465 HydrophobicContact CB-CD2 4.48Å; V371-Y465 HydrophobicContact CB-CE2 4.28Å; V371-Y465 HydrophobicContact CG1-CD2 4.11Å; V371-Y465 HydrophobicContact CG1-CE2 3.51Å; V371-Y465 HydrophobicContact CG2-CD1 3.72Å; V371-Y465 HydrophobicContact CG2-CD2 3.79Å; V371-Y465 HydrophobicContact CG2-CE1 3.75Å; V371-Y465 HydrophobicContact CG2-CE2 3.82Å; V371-Y465 HydrophobicContact CG2-CG 3.75Å; W462-Y465 CarbonylContact O-C 3.46Å; W462-Y465 PolarHBondContact O-N 3.38Å; A463-Y465 PolarHBondContact O-N 3.45Å; Y465-G467 PolarHBondContact O-N 3.03Å; Y465-L472 HydrophobicContact CD1-CD2 4.03Å; Y465-L472 HydrophobicContact CE1-CD2 4.41Å
466	G	88.3	Confident	95.7	Very high	60 Å²	60	30 Å²	30	62%	0.619	18%	0.175	S	C	*	.	B	Isolated β-bridge	trans	84.2	-25.4	-176	0	0	0	0	0	114.1	Y470	G466-Y470 WeakPolarHBondContact O-CB 3.39Å
467	G	93.3	Very high	96	Very high	19 Å²	19	26.9 Å²	26.9	20%	0.196	16%	0.161	C	C	.	.			trans	79.2	173.6	174.1	0	0	0	0	0	114.2	W462 A463 Y465 F469 Y470	W462-G467 PolarHBondContact O-N 3.02Å; A463-G467 WeakPolarHBondContact O-CA 3.41Å; Y465-G467 PolarHBondContact O-N 3.03Å; G467-F469 PolarHBondContact O-N 3.11Å; G467-Y470 PolarHBondContact O-N 3.34Å
468	G	91.6	Very high	96.2	Very high	11 Å²	11	23.8 Å²	23.8	11%	0.113	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.9	-166.5	0	0	0	0	0	117	Y452 Q457	Y452-G468 PolarHBondContact OH-O 2.6Å; Q457-G468 WeakPolarHBondContact CB-O 3.15Å; Q457-G468 WeakPolarHBondContact CG-O 3.39Å
469	F	94.3	Very high	96.3	Very high	107 Å²	107	23.5 Å²	23.5	47%	0.469	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	15.2	176.7	-68.5	-65.9	0	0	0	114	Y452 Q457 G467	Y452-F469 VanDerWaalsContact CD1-O 3.27Å; Y452-F469 WeakPolarHBondContact CD1-O 3.35Å; Y452-F469 WeakPolarHBondContact CE1-O 3.31Å; Y452-F469 HydrophobicContact CE2-CD1 4.49Å; Y452-F469 PolarHBondContact N-O 2.75Å; Q457-F469 HydrophobicContact CG-CD1 3.95Å; Q457-F469 HydrophobicContact CG-CD2 4.36Å; Q457-F469 HydrophobicContact CG-CE1 3.61Å; Q457-F469 HydrophobicContact CG-CE2 4.06Å; Q457-F469 HydrophobicContact CG-CG 4.31Å; Q457-F469 HydrophobicContact CG-CZ 3.67Å; G467-F469 PolarHBondContact O-N 3.11Å
470	Y	96	Very high	96.2	Very high	42 Å²	42	24.1 Å²	24.1	17%	0.165	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-115.3	120.2	172.1	-166.4	-92.8	0	0	0	110.3	D365 W366 G450 V451 F461 G466 G467 L472	D365-Y470 HydrophobicContact CB-CE1 3.95Å; W366-Y470 WeakPolarHBondContact CB-OH 3.37Å; W366-Y470 AromaticContact CD1-CZ 3.79Å; W366-Y470 PolarHBondContact N-OH 3.29Å; W366-Y470 VanDerWaalsContact N-OH 3.14Å; G450-Y470 WeakPolarHBondContact O-CA 3.39Å; V451-Y470 HydrophobicContact CG2-CD2 3.95Å; V451-Y470 HydrophobicContact CG2-CE2 4.3Å; F461-Y470 WeakPolarHBondContact CB-O 3.19Å; G466-Y470 WeakPolarHBondContact O-CB 3.39Å; G467-Y470 PolarHBondContact O-N 3.34Å; Y470-L472 HydrophobicContact CD1-CD2 4.32Å; Y470-L472 HydrophobicContact CE1-CD2 4.31Å
471	S	97.6	Very high	96.1	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.153	C	C	.	.			trans	-91.6	121.8	172.8	-173.7	0	0	0	0	109.9	W366 V445 Y447 G450 I460	W366-S471 PolarHBondContact NE1-O 2.97Å; V445-S471 PolarHBondContact O-OG 3.3Å; Y447-S471 PolarHBondContact N-OG 3.46Å; Y447-S471 VanDerWaalsContact N-OG 3.14Å; G450-S471 WeakPolarHBondContact CA-O 3.21Å; G450-S471 PolarHBondContact O-N 2.94Å; I460-S471 PolarHBondContact N-OG 3.11Å; I460-S471 CarbonylContact O-C 3.35Å; I460-S471 WeakPolarHBondContact O-CA 3.33Å
472	L	98	Very high	95.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.173	C	C	.	.			trans	-63.2	151.2	176.8	-63	165.2	0	0	0	111.3	L363 I460 W462 Y465 Y470 V475	L363-L472 HydrophobicContact CB-CD1 4.05Å; L363-L472 HydrophobicContact CB-CD2 4.43Å; L363-L472 HydrophobicContact CD1-CD1 4.04Å; L363-L472 HydrophobicContact CD2-CD1 3.83Å; L363-L472 HydrophobicContact CG-CD1 4.19Å; I460-L472 HydrophobicContact CG2-CB 4.19Å; I460-L472 WeakPolarHBondContact O-CG 3.36Å; I460-L472 PolarHBondContact O-N 2.83Å; W462-L472 HydrophobicContact CB-CD1 4.3Å; Y465-L472 HydrophobicContact CD1-CD2 4.03Å; Y465-L472 HydrophobicContact CE1-CD2 4.41Å; Y470-L472 HydrophobicContact CD1-CD2 4.32Å; Y470-L472 HydrophobicContact CE1-CD2 4.31Å; L472-V475 HydrophobicContact CB-CG2 3.94Å; L472-V475 HydrophobicContact CD1-CG2 3.85Å
473	K	97.8	Very high	94.6	Very high	71 Å²	71	36.1 Å²	36.1	31%	0.309	21%	0.212	S	C	.	.	S	Bend	trans	-78.7	-48.1	-177.4	178.4	-169.4	166.4	-157.9	0	110.7	K317 E364 D365 W366 W446	K317-K473 CarbonylContact C-O 3.22Å; E364-K473 WeakPolarHBondContact O-CB 3.41Å; E364-K473 PolarHBondContact O-N 3.15Å; E364-K473 WeakPolarHBondContact OE1-CD 3.45Å; E364-K473 WeakPolarHBondContact OE1-CE 3.44Å; E364-K473 IonicContact OE1-NZ 3.62Å; E364-K473 PolarHBondContact OE1-NZ 3.43Å; D365-K473 WeakPolarHBondContact O-CD 3.48Å; W366-K473 HydrophobicContact CD2-CB 3.9Å; W366-K473 HydrophobicContact CD2-CG 4.13Å; W366-K473 HydrophobicContact CE3-CB 4.49Å; W366-K473 HydrophobicContact CE3-CD 4.43Å; W366-K473 HydrophobicContact CE3-CG 4.22Å; W366-K473 HydrophobicContact CG-CB 4.13Å; W366-K473 HydrophobicContact CH2-CG 4.22Å; W366-K473 HydrophobicContact CZ2-CB 4.04Å; W366-K473 HydrophobicContact CZ2-CG 4.13Å; W366-K473 HydrophobicContact CZ3-CG 4.28Å; W446-K473 PolarHBondContact NE1-O 2.99Å
474	S	97.4	Very high	94.5	Very high	18 Å²	18	36 Å²	36	13%	0.126	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.3	177.4	-172.4	0	0	0	0	110	R316 E364	R316-S474 CarbonylContact O-C 3.58Å; R316-S474 VanDerWaalsContact O-CA 3.27Å; R316-S474 WeakPolarHBondContact O-CA 3.38Å; R316-S474 PolarHBondContact O-OG 3.43Å; E364-S474 PolarHBondContact N-O 3.45Å; E364-S474 PolarHBondContact O-N 2.76Å
475	V	97.9	Very high	94.4	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	139.1	176.8	172	0	0	0	0	108.8	K315 R316 E362 L363 L442 I460 L472	K315-V475 WeakPolarHBondContact CA-O 3.28Å; R316-V475 HydrophobicContact CB-CB 4.18Å; R316-V475 HydrophobicContact CG-CB 4.26Å; R316-V475 PolarHBondContact N-O 3.31Å; R316-V475 PolarHBondContact O-N 2.9Å; E362-V475 WeakPolarHBondContact O-CA 3.47Å; L363-V475 HydrophobicContact CD2-CG1 4.11Å; L363-V475 HydrophobicContact CD2-CG2 3.97Å; L442-V475 HydrophobicContact CB-CG1 4.24Å; L442-V475 HydrophobicContact CD1-CG1 4.02Å; L442-V475 HydrophobicContact CD2-CG1 4.03Å; L442-V475 HydrophobicContact CD2-CG2 4.24Å; L442-V475 HydrophobicContact CG-CG1 4.31Å; I460-V475 HydrophobicContact CG2-CG2 3.64Å; L472-V475 HydrophobicContact CB-CG2 3.94Å; L472-V475 HydrophobicContact CD1-CG2 3.85Å
476	R	97.8	Very high	94.3	Very high	35 Å²	35	35.3 Å²	35.3	13%	0.132	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.8	170.4	-62.9	-170.7	-77.2	175.7	-3.6	110.7	E302 L305 Q314 K315 V361 E362	E302-R476 IonicContact OE2-CZ 3.79Å; E302-R476 IonicContact OE2-NH1 3.53Å; E302-R476 PolarHBondContact OE2-NH1 2.85Å; L305-R476 VanDerWaalsContact CD1-NH2 3.29Å; Q314-R476 WeakPolarHBondContact O-CA 3.31Å; K315-R476 HydrophobicContact CG-CG 4.46Å; V361-R476 CarbonylContact C-O 3.57Å; V361-R476 WeakPolarHBondContact CA-O 3.27Å; E362-R476 HydrophobicContact CB-CB 4.38Å; E362-R476 PolarHBondContact N-O 3.22Å; E362-R476 PolarHBondContact O-N 3.01Å; E362-R476 IonicContact OE1-CZ 2.65Å; E362-R476 IonicContact OE1-NH2 2.67Å; E362-R476 PolarHBondContact OE1-NH2 3.39Å; E362-R476 IonicContact OE2-CZ 3.83Å; E362-R476 IonicContact OE2-NE 2.67Å; E362-R476 PolarHBondContact OE2-NE 2.93Å; E362-R476 IonicContact OE2-NH2 2.64Å; E362-R476 PolarHBondContact OE2-NH2 3.03Å
477	L	98.2	Very high	94.7	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.5	172.5	-165.8	73.3	0	0	0	107.5	L313 Q314 W342 L359 V361 W432 L442	L313-L477 HydrophobicContact CB-CD2 4.49Å; L313-L477 PolarHBondContact N-O 3.08Å; Q314-L477 HydrophobicContact CB-CB 3.75Å; Q314-L477 HydrophobicContact CB-CD2 4.15Å; Q314-L477 PolarHBondContact N-O 3.11Å; Q314-L477 PolarHBondContact O-N 3.2Å; W342-L477 HydrophobicContact CZ3-CD2 4.34Å; L359-L477 HydrophobicContact CD1-CD1 3.75Å; L359-L477 HydrophobicContact CD1-CG 3.9Å; L359-L477 HydrophobicContact CD2-CD1 4.17Å; L359-L477 HydrophobicContact CG-CD1 4.37Å; V361-L477 HydrophobicContact CG1-CD1 4.25Å; V361-L477 HydrophobicContact CG2-CD1 3.9Å; W432-L477 HydrophobicContact CH2-CD2 4.48Å; L442-L477 HydrophobicContact CD1-CD1 4.4Å
478	M	97.9	Very high	94.8	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.015	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	146.8	-172	61.9	-162.7	166.7	0	0	112.9	E302 L305 W310 T311 V312 M360 E362	E302-M478 HydrophobicContact CG-SD 4.29Å; L305-M478 HydrophobicContact CD1-CE 3.83Å; L305-M478 HydrophobicContact CD1-SD 4.45Å; W310-M478 HydrophobicContact CB-CB 4.07Å; W310-M478 HydrophobicContact CB-CG 3.96Å; W310-M478 HydrophobicContact CB-SD 3.97Å; W310-M478 HydrophobicContact CD2-CG 4.17Å; W310-M478 HydrophobicContact CE3-CG 3.96Å; W310-M478 HydrophobicContact CG-CG 4.19Å; W310-M478 HydrophobicContact CG-SD 4.18Å; T311-M478 CarbonylContact O-C 3.6Å; T311-M478 VanDerWaalsContact O-CA 3.22Å; T311-M478 WeakPolarHBondContact O-CA 3.44Å; T311-M478 WeakPolarHBondContact O-CB 3.47Å; V312-M478 HydrophobicContact CB-CB 4.47Å; V312-M478 HydrophobicContact CG2-CB 4.13Å; M360-M478 HydrophobicContact CB-CE 4.1Å; M360-M478 HydrophobicContact CB-CG 4.03Å; M360-M478 HydrophobicContact CG-CE 3.54Å; M360-M478 HydrophobicContact CG-CG 4.47Å; M360-M478 PolarHBondContact N-O 3.45Å; M360-M478 PolarHBondContact O-N 3.17Å; E362-M478 HydrophobicContact CB-CE 4.21Å
479	I	97.7	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	151.7	-175.8	59.2	172.7	0	0	0	112.3	W310 T311 L313 L351 Y357 K358 L359 F378	W310-I479 WeakPolarHBondContact CA-O 3.44Å; W310-I479 VanDerWaalsContact CE3-C 3.5Å; T311-I479 PolarHBondContact N-O 2.71Å; T311-I479 PolarHBondContact O-N 3Å; L313-I479 HydrophobicContact CD1-CB 4.47Å; L313-I479 HydrophobicContact CD1-CD1 4.16Å; L313-I479 HydrophobicContact CD1-CG1 4.13Å; L313-I479 HydrophobicContact CD1-CG2 3.65Å; L313-I479 HydrophobicContact CD2-CD1 3.94Å; L313-I479 HydrophobicContact CD2-CG1 3.93Å; L313-I479 HydrophobicContact CG-CD1 4.47Å; L313-I479 HydrophobicContact CG-CG1 4.17Å; L313-I479 HydrophobicContact CG-CG2 4.39Å; L351-I479 HydrophobicContact CB-CD1 4.12Å; Y357-I479 HydrophobicContact CD1-CB 4.07Å; Y357-I479 HydrophobicContact CD1-CD1 3.8Å; Y357-I479 HydrophobicContact CD1-CG1 4.04Å; Y357-I479 HydrophobicContact CE1-CD1 4.26Å; Y357-I479 HydrophobicContact CG-CD1 4.2Å; K358-I479 WeakPolarHBondContact O-CA 3.43Å; L359-I479 HydrophobicContact CB-CG2 4.28Å; L359-I479 HydrophobicContact CD1-CG2 3.73Å; F378-I479 HydrophobicContact CD1-CG2 3.65Å; F378-I479 HydrophobicContact CE1-CG2 4.02Å; F378-I479 HydrophobicContact CG-CG2 4.25Å
480	R	95.8	Very high	95	Very high	14 Å²	14	31.4 Å²	31.4	5%	0.053	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.4	171.7	-168.3	174.8	88.7	-146.2	6.8	108.5	Y273 D306 G308 W310 Y357 K358 D483	Y273-R480 HydrophobicContact CD2-CG 3.92Å; Y273-R480 HydrophobicContact CG-CG 4.37Å; D306-R480 PolarHBondContact O-NH1 3.27Å; D306-R480 IonicContact OD2-CZ 2.98Å; D306-R480 IonicContact OD2-NH1 3.15Å; D306-R480 PolarHBondContact OD2-NH1 3.49Å; D306-R480 IonicContact OD2-NH2 2.69Å; G308-R480 WeakPolarHBondContact O-CD 3.42Å; W310-R480 HydrophobicContact CD2-CB 3.96Å; W310-R480 HydrophobicContact CE3-CB 3.57Å; W310-R480 HydrophobicContact CH2-CB 4.24Å; W310-R480 HydrophobicContact CZ3-CB 3.71Å; Y357-R480 CarbonylContact C-O 3.56Å; Y357-R480 VanDerWaalsContact CA-O 3.31Å; Y357-R480 WeakPolarHBondContact CA-O 3.28Å; Y357-R480 VanDerWaalsContact CD1-C 3.41Å; K358-R480 PolarHBondContact N-O 3.28Å; K358-R480 PolarHBondContact O-N 3.08Å; K358-R480 VanDerWaalsContact O-N 3.11Å; R480-D483 IonicContact CZ-OD2 2.6Å; R480-D483 IonicContact NE-OD2 2.64Å; R480-D483 IonicContact NH2-OD2 2.75Å; R480-D483 PolarHBondContact NH2-OD2 3.18Å
481	P	95.5	Very high	95	Very high	19 Å²	19	30.5 Å²	30.5	12%	0.123	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.7	150.5	168.1	-26.2	35.4	0	0	0	111.3	D271 Y273 D356 Y357	D271-P481 WeakPolarHBondContact OD2-CG 3.22Å; Y273-P481 HydrophobicContact CD1-CG 4.25Å; Y273-P481 HydrophobicContact CG-CG 4.38Å; D356-P481 WeakPolarHBondContact O-CA 3.42Å; Y357-P481 HydrophobicContact CD1-CG 4.25Å; Y357-P481 HydrophobicContact CE1-CG 3.7Å
482	I	91.4	Very high	94.7	Very high	84 Å²	84	33.1 Å²	33.1	43%	0.431	17%	0.167	S	C	.	.			trans	-73.4	136	165.6	-52.5	178.1	0	0	0	107.7	D356 K358 S376	D356-I482 HydrophobicContact CB-CD1 3.82Å; D356-I482 HydrophobicContact CB-CG1 4.27Å; D356-I482 PolarHBondContact O-N 3.42Å; K358-I482 HydrophobicContact CB-CG1 4.33Å; S376-I482 WeakPolarHBondContact O-CD1 3.37Å
483	D	71.4	Confident	94.4	Very high	152 Å²	152	36.1 Å²	36.1	81%	0.813	18%	0.182	S	C	*	.			trans	-82.8	0	-179.2	-65.7	-78.7	0	0	0	112	Y273 R480	Y273-D483 WeakPolarHBondContact CE2-OD1 3.48Å; Y273-D483 PolarHBondContact OH-OD1 3.16Å; R480-D483 IonicContact CZ-OD2 2.6Å; R480-D483 IonicContact NE-OD2 2.64Å; R480-D483 IonicContact NH2-OD2 2.75Å; R480-D483 PolarHBondContact NH2-OD2 3.18Å

Retrieved 483 of 483 residues in 137.1 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).