G4LZE6_SCHMA Loading...

Poly(A) polymerase cid (Pap) (Caffein-induced death protein), putative

AlphaFold DB , UniProt , Accession G4LZE6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 410 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	35.2	Very low	32.8	Very low	243 Å²	243	186.7 Å²	186.7	100%	1.197	87%	0.865	S	S	*	*				0	81.7	0	-114.5	179.4	175.4	0	0	109.1
2	F	37.1	Very low	32.4	Very low	172 Å²	172	181.2 Å²	181.2	75%	0.754	85%	0.854	S	S	*	*			trans	-125.4	108.8	164.5	-89.3	-82	0	0	0	105.6	K4	F2-K4 PolarHBondContact O-N 2.99Å
3	K	36.1	Very low	31.8	Very low	202 Å²	202	180.9 Å²	180.9	88%	0.878	86%	0.861	S	S	*	*			trans	-61	124.2	175	-87.5	179.1	172.6	177.7	0	108.1	N5	K3-N5 PolarHBondContact O-N 3.33Å
4	K	31.5	Very low	31.5	Very low	204 Å²	204	181.3 Å²	181.3	89%	0.887	86%	0.858	S	S	*	*			trans	-60.8	101.5	170	-78	177.6	172.3	177.5	0	108.7	F2	F2-K4 PolarHBondContact O-N 2.99Å
5	N	36.6	Very low	31.1	Very low	149 Å²	149	175.2 Å²	175.2	80%	0.797	84%	0.842	S	S	*	*			trans	-90.2	105.9	161.1	-86.3	-4.5	0	0	0	108.7	K3 I7	K3-N5 PolarHBondContact O-N 3.33Å; N5-I7 PolarHBondContact O-N 3.49Å
6	K	30.5	Very low	31	Very low	196 Å²	196	172.9 Å²	172.9	85%	0.852	84%	0.842	S	S	*	*			trans	-72.4	103.1	174.8	-139.4	179.1	-173.3	178.3	0	107.4	R8	K6-R8 PolarHBondContact O-N 2.98Å
7	I	36.5	Very low	30.9	Very low	148 Å²	148	172.1 Å²	172.1	76%	0.759	84%	0.843	S	S	*	*			trans	-84.6	103.6	165.7	-62.2	176.6	0	0	0	106.8	N5 K9	N5-I7 PolarHBondContact O-N 3.49Å; I7-K9 PolarHBondContact O-N 3.01Å
8	R	27.6	Very low	30.7	Very low	230 Å²	230	167.7 Å²	167.7	87%	0.868	83%	0.832	S	S	*	*			trans	-73.7	112	162.4	-93.9	179.3	167.1	173.1	-4	107.6	K6	K6-R8 PolarHBondContact O-N 2.98Å
9	K	34.5	Very low	30.6	Very low	194 Å²	194	163.4 Å²	163.4	84%	0.843	82%	0.82	S	S	*	*			trans	-140.1	115.3	147.8	-82.8	-166.5	176.4	-179.9	0	109.3	I7	I7-K9 PolarHBondContact O-N 3.01Å
10	T	26.9	Very low	30.6	Very low	135 Å²	135	161.3 Å²	161.3	83%	0.828	81%	0.81	S	S	*	*			trans	-61.3	116.7	163.4	39.2	0	0	0	0	109.9
11	Q	28.4	Very low	30.4	Very low	181 Å²	181	158.5 Å²	158.5	85%	0.846	81%	0.806	S	S	*	*			trans	-169.8	108.5	146.8	-110.7	165.2	3.3	0	0	111
12	T	27.7	Very low	29.9	Very low	120 Å²	120	153 Å²	153	74%	0.736	78%	0.781	S	S	*	*			trans	37.1	105.2	147.4	52	0	0	0	0	118.3	K14	T12-K14 VanDerWaalsContact C-N 3.32Å; T12-K14 PolarHBondContact O-N 3.08Å
13	N	25.2	Very low	29.6	Very low	178 Å²	178	147.8 Å²	147.8	95%	0.952	76%	0.761	S	S	*	*			trans	-46.2	92.8	152.2	-79.6	-20.6	0	0	0	110.5
14	K	27	Very low	29.1	Very low	186 Å²	186	141.9 Å²	141.9	81%	0.809	75%	0.749	S	S	*	*			trans	-100	111.2	151.3	-84.3	-174.2	176.6	179.4	0	106.2	T12 V16	T12-K14 VanDerWaalsContact C-N 3.32Å; T12-K14 PolarHBondContact O-N 3.08Å; K14-V16 PolarHBondContact O-N 3.01Å; K14-V16 VanDerWaalsContact O-N 3.09Å
15	S	26.4	Very low	29	Very low	90 Å²	90	136 Å²	136	63%	0.629	73%	0.731	S	S	*	*			trans	-41.2	112.9	172.1	53.6	0	0	0	0	111.3	N17	S15-N17 PolarHBondContact O-N 3.33Å
16	V	29.3	Very low	28.7	Very low	139 Å²	139	132.4 Å²	132.4	84%	0.842	72%	0.716	S	S	*	*	S	Bend	trans	-72.8	71	162.6	-176.8	0	0	0	0	106.7	K14	K14-V16 PolarHBondContact O-N 3.01Å; K14-V16 VanDerWaalsContact O-N 3.09Å
17	N	28.3	Very low	28.6	Very low	158 Å²	158	127.4 Å²	127.4	85%	0.845	71%	0.706	S	S	*	*			trans	-146.7	20.3	177.6	-104.4	-8.6	0	0	0	111.7	S15	S15-N17 PolarHBondContact O-N 3.33Å
18	S	27.3	Very low	28.3	Very low	94 Å²	94	126.9 Å²	126.9	66%	0.657	71%	0.705	S	S	*	*	S	Bend	trans	-112.7	112.5	173.3	56.9	0	0	0	0	110.9
19	S	29.2	Very low	28.5	Very low	85 Å²	85	119.5 Å²	119.5	59%	0.594	68%	0.68	S	S	*	*			trans	73.9	42	151.5	55.2	0	0	0	0	121.7	S21	S19-S21 PolarHBondContact O-N 3.18Å
20	I	30.6	Very low	28.3	Very low	121 Å²	121	114.3 Å²	114.3	62%	0.621	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	3.3	158.4	-62.9	176.4	0	0	0	112
21	S	26	Very low	28.5	Very low	104 Å²	104	116.6 Å²	116.6	73%	0.727	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-0	177.3	54.6	0	0	0	0	115.7	S19	S19-S21 PolarHBondContact O-N 3.18Å
22	N	26.4	Very low	28.6	Very low	126 Å²	126	114.5 Å²	114.5	67%	0.674	66%	0.66	S	S	*	*			trans	-114.9	55.5	176.1	-74.3	-11.1	0	0	0	111.9	A24	N22-A24 PolarHBondContact O-N 2.7Å
23	L	28.9	Very low	28.8	Very low	64 Å²	64	114.8 Å²	114.8	34%	0.335	66%	0.655	S	S	.	*			trans	-73.7	83.8	157.7	-83.9	145.5	0	0	0	107.6	V25 Y97 I101	L23-V25 VanDerWaalsContact C-N 3.27Å; L23-V25 PolarHBondContact O-N 3.05Å; L23-Y97 HydrophobicContact CB-CE1 3.97Å; L23-Y97 HydrophobicContact CD1-CE1 3.47Å; L23-Y97 VanDerWaalsContact CD1-CE1 3.47Å; L23-Y97 HydrophobicContact CD2-CE1 3.61Å; L23-Y97 WeakPolarHBondContact CD2-OH 3.45Å; L23-Y97 HydrophobicContact CG-CE1 3.82Å; L23-I101 HydrophobicContact CD1-CD1 4.08Å; L23-I101 HydrophobicContact CD1-CG1 4.12Å
24	A	26	Very low	28.9	Very low	77 Å²	77	111.9 Å²	111.9	64%	0.636	64%	0.64	S	S	*	*			trans	-62.9	95.6	164.7	0	0	0	0	0	107.5	N22 C26	N22-A24 PolarHBondContact O-N 2.7Å; A24-C26 PolarHBondContact O-N 2.86Å
25	V	30.2	Very low	29.2	Very low	81 Å²	81	110.6 Å²	110.6	49%	0.491	64%	0.642	S	S	.	*			trans	-52.7	112	152.4	175.9	0	0	0	0	104.7	L23 S27 P94	L23-V25 VanDerWaalsContact C-N 3.27Å; L23-V25 PolarHBondContact O-N 3.05Å; V25-S27 PolarHBondContact O-N 3.38Å; V25-P94 HydrophobicContact CG1-CG 4.44Å; V25-P94 HydrophobicContact CG2-CB 4.2Å; V25-P94 HydrophobicContact CG2-CG 4.16Å
26	C	31	Very low	29.3	Very low	73 Å²	73	118 Å²	118	49%	0.493	66%	0.656	S	S	.	*			trans	-34.9	101	-175.7	-82.3	0	0	0	0	111.8	A24 N28	A24-C26 PolarHBondContact O-N 2.86Å; C26-N28 PolarHBondContact O-N 3.48Å; C26-N28 VanDerWaalsContact O-N 3.16Å
27	S	27.1	Very low	29.3	Very low	91 Å²	91	119.6 Å²	119.6	64%	0.636	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	28.9	179	52.6	0	0	0	0	112.3	V25	V25-S27 PolarHBondContact O-N 3.38Å
28	N	30.8	Very low	29.4	Very low	137 Å²	137	120.6 Å²	120.6	73%	0.733	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	1.8	170.8	-80	-7	0	0	0	113	C26 S30	C26-N28 PolarHBondContact O-N 3.48Å; C26-N28 VanDerWaalsContact O-N 3.16Å; N28-S30 VanDerWaalsContact C-N 3.28Å; N28-S30 PolarHBondContact O-N 2.99Å
29	E	32.5	Very low	29.4	Very low	75 Å²	75	124.1 Å²	124.1	35%	0.35	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.1	-2.5	176.5	-70.7	179.6	-176.3	0	0	113.4	Y87 K91 R222	E29-Y87 PolarHBondContact OE1-OH 2.9Å; E29-K91 IonicContact OE2-NZ 3.82Å; E29-K91 PolarHBondContact OE2-NZ 3.41Å; E29-R222 IonicContact OE1-CZ 3.07Å; E29-R222 IonicContact OE1-NH1 3.88Å; E29-R222 PolarHBondContact OE1-NH1 3.33Å
30	S	29	Very low	29.5	Very low	85 Å²	85	124.9 Å²	124.9	59%	0.594	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	7.9	-178.2	50	0	0	0	0	115.8	N28	N28-S30 VanDerWaalsContact C-N 3.28Å; N28-S30 PolarHBondContact O-N 2.99Å
31	K	30.9	Very low	29.5	Very low	183 Å²	183	126.7 Å²	126.7	80%	0.796	68%	0.675	S	S	*	*	S	Bend	trans	-107.3	6.3	175.1	-83.5	-172.9	175.9	-178.1	0	115.3
32	I	31.8	Very low	29.7	Very low	137 Å²	137	124.9 Å²	124.9	70%	0.703	67%	0.673	S	S	*	*	S	Bend	trans	-113.9	-0.5	-177.4	-59.5	177	0	0	0	112.6
33	I	30.8	Very low	29.9	Very low	126 Å²	126	125.8 Å²	125.8	65%	0.646	68%	0.683	S	S	*	*	S	Bend	trans	-110.3	2.3	179.8	-60.4	176.8	0	0	0	112.7
34	N	28.7	Very low	30.1	Very low	118 Å²	118	127.9 Å²	127.9	63%	0.631	70%	0.7	S	S	*	*	S	Bend	trans	-105	8.3	-178.3	-87.2	-20.1	0	0	0	116.3
35	D	31.6	Very low	30.2	Very low	159 Å²	159	132.4 Å²	132.4	85%	0.85	71%	0.713	S	S	*	*	S	Bend	trans	-100.3	25.2	171.9	-79	-23	0	0	0	113.7
36	R	29.8	Very low	30.2	Very low	244 Å²	244	133 Å²	133	92%	0.921	72%	0.721	S	S	*	*			trans	-126.5	64.9	166.2	-72.6	-172.5	180	-177.5	-0.2	110.6
37	K	28.6	Very low	30.2	Very low	174 Å²	174	134.3 Å²	134.3	76%	0.757	73%	0.731	S	S	*	*			trans	-120.3	93.5	157.8	-78.7	-173.4	178.2	-178.6	0	107.8
38	H	31.1	Very low	30.4	Very low	178 Å²	178	134.5 Å²	134.5	82%	0.824	74%	0.738	S	S	*	*			trans	170.4	92	142.7	-94.4	-64	0	0	0	108.3
39	I	27.4	Very low	30.3	Very low	168 Å²	168	132.5 Å²	132.5	86%	0.862	73%	0.734	S	S	*	*			trans	-108.9	112.2	150.8	-59.9	171.6	0	0	0	104.2
40	P	31.2	Very low	30.3	Very low	101 Å²	101	139.1 Å²	139.1	66%	0.656	76%	0.762	S	S	*	*			trans	-114.6	136.4	155.4	9.7	11.2	0	0	0	110.2
41	D	30.6	Very low	30.6	Very low	160 Å²	160	143.7 Å²	143.7	86%	0.856	77%	0.774	S	S	*	*			trans	-54.8	151.1	173.6	-61.9	-52.8	0	0	0	113.2
42	G	29.7	Very low	31	Very low	66 Å²	66	139.7 Å²	139.7	68%	0.68	77%	0.767	S	S	*	*			trans	91.5	99.4	141.9	0	0	0	0	0	118.7
43	T	30.2	Very low	31.1	Very low	144 Å²	144	140.6 Å²	140.6	88%	0.883	77%	0.773	S	S	*	*			trans	73.7	144.6	142.9	34.1	0	0	0	0	121.3
44	P	33.2	Very low	31.3	Very low	109 Å²	109	139 Å²	139	71%	0.708	78%	0.779	S	S	*	*			trans	-98.8	154.3	-162.4	38.6	-31	0	0	0	112.7
45	L	29.3	Very low	31.9	Very low	171 Å²	171	140.4 Å²	140.4	90%	0.895	79%	0.785	S	S	*	*			trans	177.1	125.8	140.9	-95.8	151	0	0	0	112.5
46	S	29.1	Very low	31.9	Very low	95 Å²	95	138.5 Å²	138.5	66%	0.664	78%	0.782	S	S	*	*			trans	65.9	122.2	133.9	-160.9	0	0	0	0	122.9
47	S	30.8	Very low	32.2	Very low	100 Å²	100	136.5 Å²	136.5	70%	0.699	78%	0.78	S	S	*	*			trans	76.1	117.8	132.8	60.4	0	0	0	0	122
48	A	30.7	Very low	32.6	Very low	95 Å²	95	134.1 Å²	134.1	79%	0.785	78%	0.78	S	S	*	*			trans	65.9	139.7	134.4	0	0	0	0	0	117.1
49	S	30.4	Very low	32.6	Very low	94 Å²	94	132.2 Å²	132.2	66%	0.657	78%	0.781	S	S	*	*			cis	176.8	132.9	1.9	41.2	0	0	0	0	103.7
50	F	32.1	Very low	32.8	Very low	215 Å²	215	129.6 Å²	129.6	94%	0.943	78%	0.778	S	S	*	*			trans	-171.9	114.7	147.8	-103.1	-72.7	0	0	0	109.9
51	Q	34.4	Very low	33.1	Very low	180 Å²	180	129.1 Å²	129.1	84%	0.841	78%	0.777	S	S	*	*			trans	-114.9	172.6	162.4	-98.7	-163.2	-9.6	0	0	106.4
52	P	39.5	Very low	33.4	Very low	100 Å²	100	126.9 Å²	126.9	65%	0.649	77%	0.774	S	S	*	*			cis	-148.1	168.2	29.7	37.1	-14.5	0	0	0	117.7
53	N	33.7	Very low	34.3	Very low	155 Å²	155	132.4 Å²	132.4	83%	0.829	78%	0.779	S	S	*	*			trans	141.7	92.4	138.2	-73.8	-18.2	0	0	0	113.4
54	A	36.3	Very low	35	Very low	94 Å²	94	132.4 Å²	132.4	78%	0.777	77%	0.772	S	S	*	*			trans	-176.2	101.9	139.3	0	0	0	0	0	111.1
55	I	41	Very low	35.4	Very low	146 Å²	146	130.9 Å²	130.9	75%	0.749	76%	0.762	S	S	*	*			trans	43.7	118.5	144.8	-50.4	162.4	0	0	0	118.5
56	P	30.4	Very low	36.3	Very low	120 Å²	120	126.5 Å²	126.5	78%	0.779	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-81.7	122	176.9	32.1	-29.2	0	0	0	111.4
57	F	36.1	Very low	37.7	Very low	202 Å²	202	127.1 Å²	127.1	89%	0.886	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-89.9	124.8	158.1	-96.7	-85	0	0	0	109.7
58	T	37.1	Very low	39.1	Very low	124 Å²	124	125.9 Å²	125.9	76%	0.761	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-66.8	126.6	-177.8	36	0	0	0	0	112.4
59	T	32	Very low	40.7	Very low	137 Å²	137	124.7 Å²	124.7	84%	0.84	72%	0.722	S	S	*	*			trans	-3.7	120.1	157	54.6	0	0	0	0	118.8
60	S	31.9	Very low	42.1	Very low	113 Å²	113	125.4 Å²	125.4	79%	0.79	72%	0.718	S	S	*	*			trans	-159.6	125.9	131.6	49.1	0	0	0	0	112.3
61	S	36.1	Very low	44.2	Very low	92 Å²	92	118.1 Å²	118.1	64%	0.643	69%	0.693	S	S	*	*			trans	62.9	98.8	172.8	74.8	0	0	0	0	118.7	F63	S61-F63 PolarHBondContact O-N 3.28Å
62	S	37.2	Very low	46.2	Very low	113 Å²	113	111.9 Å²	111.9	79%	0.79	67%	0.67	S	S	*	*			trans	-62.2	97.2	150.9	53.4	0	0	0	0	109	I64	S62-I64 PolarHBondContact O-N 3.25Å; S62-I64 VanDerWaalsContact O-N 3.09Å
63	F	48.6	Very low	48.4	Very low	182 Å²	182	109.2 Å²	109.2	80%	0.798	65%	0.653	S	S	*	*			trans	-69.5	99.7	165	-106.2	-95	0	0	0	108.1	S61 P65	S61-F63 PolarHBondContact O-N 3.28Å; F63-P65 WeakPolarHBondContact O-CD 3.31Å
64	I	44.9	Very low	51.1	Low	143 Å²	143	106.4 Å²	106.4	73%	0.733	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-74	116.9	160.3	-60	173.9	0	0	0	105.3	S62 T66	S62-I64 PolarHBondContact O-N 3.25Å; S62-I64 VanDerWaalsContact O-N 3.09Å; I64-T66 PolarHBondContact O-N 3.47Å
65	P	42.4	Very low	53.8	Low	77 Å²	77	103.4 Å²	103.4	50%	0.5	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-59.4	127.9	176.8	-17.8	30.1	0	0	0	109.1	F63 T69	F63-P65 WeakPolarHBondContact O-CD 3.31Å; P65-T69 VanDerWaalsContact CA-OG1 3.31Å; P65-T69 WeakPolarHBondContact CA-OG1 3.44Å; P65-T69 VanDerWaalsContact CB-OG1 3.29Å; P65-T69 WeakPolarHBondContact CB-OG1 3.26Å
66	T	47.4	Very low	56.4	Low	79 Å²	79	97 Å²	97	49%	0.485	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-64.3	156.4	168.6	53.7	0	0	0	0	109.3	I64 S68 T69 L70	I64-T66 PolarHBondContact O-N 3.47Å; T66-S68 PolarHBondContact O-N 3.24Å; T66-S68 PolarHBondContact OG1-OG 3.41Å; T66-T69 PolarHBondContact N-OG1 3.19Å; T66-T69 PolarHBondContact O-N 3.46Å; T66-T69 PolarHBondContact O-OG1 3.34Å; T66-T69 WeakPolarHBondContact OG1-CG2 3.39Å; T66-L70 PolarHBondContact O-N 3.45Å; T66-L70 VanDerWaalsContact O-N 3.1Å
67	S	58	Low	59.5	Low	109 Å²	109	96.4 Å²	96.4	76%	0.762	56%	0.56	S	S	*	*	H	α-helix	trans	-52.3	-33.1	177.3	53.3	0	0	0	0	112.9	S71	S67-S71 WeakPolarHBondContact O-CB 3.36Å; S67-S71 PolarHBondContact O-N 2.82Å
68	S	61.7	Low	62.2	Low	74 Å²	74	90.8 Å²	90.8	52%	0.517	54%	0.54	S	S	.	.	H	α-helix	trans	-66.4	-40	174.7	55.3	0	0	0	0	114	T66 S72	T66-S68 PolarHBondContact O-N 3.24Å; T66-S68 PolarHBondContact OG1-OG 3.41Å; S68-S72 WeakPolarHBondContact O-CB 3.43Å; S68-S72 PolarHBondContact O-N 2.86Å
69	T	63.5	Low	65	Low	69 Å²	69	85.3 Å²	85.3	42%	0.423	51%	0.506	S	S	.	.	H	α-helix	trans	-74	-36.4	178.8	56.2	0	0	0	0	111.2	P65 T66 S72 S73	P65-T69 VanDerWaalsContact CA-OG1 3.31Å; P65-T69 WeakPolarHBondContact CA-OG1 3.44Å; P65-T69 VanDerWaalsContact CB-OG1 3.29Å; P65-T69 WeakPolarHBondContact CB-OG1 3.26Å; T66-T69 PolarHBondContact N-OG1 3.19Å; T66-T69 PolarHBondContact O-N 3.46Å; T66-T69 PolarHBondContact O-OG1 3.34Å; T66-T69 WeakPolarHBondContact OG1-CG2 3.39Å; T69-S72 PolarHBondContact O-N 2.86Å; T69-S73 PolarHBondContact O-N 3.22Å; T69-S73 PolarHBondContact O-OG 3.43Å
70	L	60.1	Low	68.1	Low	109 Å²	109	79.5 Å²	79.5	57%	0.571	47%	0.471	S	S	*	.	H	α-helix	trans	-66.3	-37.7	174.8	-160.6	71.9	0	0	0	112.2	T66 S73 L74	T66-L70 PolarHBondContact O-N 3.45Å; T66-L70 VanDerWaalsContact O-N 3.1Å; L70-S73 PolarHBondContact O-OG 2.96Å; L70-L74 WeakPolarHBondContact O-CB 3.41Å; L70-L74 PolarHBondContact O-N 2.82Å; L70-L74 VanDerWaalsContact O-N 3.14Å
71	S	76.4	Confident	71.1	Confident	62 Å²	62	77.8 Å²	77.8	43%	0.434	46%	0.455	S	S	.	.	H	α-helix	trans	-63.3	-45.2	172.1	-173.8	0	0	0	0	111.5	S67 L74 Y75 Q398	S67-S71 WeakPolarHBondContact O-CB 3.36Å; S67-S71 PolarHBondContact O-N 2.82Å; S71-L74 PolarHBondContact O-N 3.39Å; S71-Y75 PolarHBondContact O-N 2.96Å; S71-Q398 PolarHBondContact OG-OE1 3.43Å
72	S	76.8	Confident	74	Confident	49 Å²	49	76.6 Å²	76.6	34%	0.343	44%	0.438	S	S	.	.	H	α-helix	trans	-63.4	-43.7	179.6	-168.5	0	0	0	0	112.3	S68 T69 Y75 M76	S68-S72 WeakPolarHBondContact O-CB 3.43Å; S68-S72 PolarHBondContact O-N 2.86Å; T69-S72 PolarHBondContact O-N 2.86Å; S72-Y75 PolarHBondContact O-N 3.38Å; S72-M76 WeakPolarHBondContact O-CG 3.41Å; S72-M76 PolarHBondContact O-N 3.32Å; S72-M76 VanDerWaalsContact O-N 3.12Å
73	S	84.1	Confident	76.8	Confident	44 Å²	44	71.2 Å²	71.2	31%	0.308	40%	0.401	S	S	.	.	H	α-helix	trans	-63.4	-44.5	178	64	0	0	0	0	111.5	T69 L70 Y75 M76 E77	T69-S73 PolarHBondContact O-N 3.22Å; T69-S73 PolarHBondContact O-OG 3.43Å; L70-S73 PolarHBondContact O-OG 2.96Å; S73-Y75 VanDerWaalsContact C-N 3.35Å; S73-Y75 PolarHBondContact O-N 3.16Å; S73-M76 PolarHBondContact O-N 3.39Å; S73-E77 WeakPolarHBondContact O-CG 3.28Å; S73-E77 PolarHBondContact O-N 2.64Å
74	L	91.8	Very high	79.1	Confident	96 Å²	96	67.1 Å²	67.1	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-63.9	-38.8	178.8	-175.3	62.4	0	0	0	112.2	L70 S71 E77 N78	L70-L74 WeakPolarHBondContact O-CB 3.41Å; L70-L74 PolarHBondContact O-N 2.82Å; L70-L74 VanDerWaalsContact O-N 3.14Å; S71-L74 PolarHBondContact O-N 3.39Å; L74-E77 PolarHBondContact O-N 3.32Å; L74-N78 WeakPolarHBondContact O-CB 3.46Å; L74-N78 VanDerWaalsContact O-CG 3.3Å; L74-N78 PolarHBondContact O-N 3.09Å; L74-N78 PolarHBondContact O-ND2 2.88Å
75	Y	93.3	Very high	81.6	Confident	32 Å²	32	66 Å²	66	13%	0.125	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-46.4	175.1	179	-91.3	0	0	0	111.7	S71 S72 S73 N78 L79 L395 Q398 Y399	S71-Y75 PolarHBondContact O-N 2.96Å; S72-Y75 PolarHBondContact O-N 3.38Å; S73-Y75 VanDerWaalsContact C-N 3.35Å; S73-Y75 PolarHBondContact O-N 3.16Å; Y75-N78 PolarHBondContact O-N 2.84Å; Y75-L79 HydrophobicContact CE1-CD2 4.47Å; Y75-L79 WeakPolarHBondContact O-CB 3.29Å; Y75-L79 PolarHBondContact O-N 3.47Å; Y75-L395 HydrophobicContact CE1-CD2 4.15Å; Y75-Q398 HydrophobicContact CD1-CB 4.37Å; Y75-Q398 HydrophobicContact CD1-CG 4.19Å; Y75-Q398 HydrophobicContact CD2-CB 3.65Å; Y75-Q398 HydrophobicContact CD2-CG 4.27Å; Y75-Q398 WeakPolarHBondContact CD2-O 3.16Å; Y75-Q398 VanDerWaalsContact CE2-CA 3.5Å; Y75-Q398 HydrophobicContact CE2-CB 3.96Å; Y75-Q398 WeakPolarHBondContact CE2-O 3.44Å; Y75-Q398 HydrophobicContact CG-CB 3.88Å; Y75-Q398 HydrophobicContact CG-CG 3.96Å; Y75-Y399 WeakPolarHBondContact CE2-O 3.39Å; Y75-Y399 PolarHBondContact OH-O 3.09Å
76	M	95.2	Very high	84.1	Confident	11 Å²	11	62.5 Å²	62.5	5%	0.054	35%	0.349	C	S	.	.	H	α-helix	trans	-68.3	-34.3	180	-66.3	-58.4	157.7	0	0	113	S72 S73 L79 S80 E308 N311	S72-M76 WeakPolarHBondContact O-CG 3.41Å; S72-M76 PolarHBondContact O-N 3.32Å; S72-M76 VanDerWaalsContact O-N 3.12Å; S73-M76 PolarHBondContact O-N 3.39Å; M76-L79 HydrophobicContact SD-CD2 4.4Å; M76-S80 WeakPolarHBondContact O-CB 3.24Å; M76-S80 PolarHBondContact O-N 2.79Å; M76-S80 PolarHBondContact O-OG 2.89Å; M76-E308 HydrophobicContact CB-CG 3.94Å; M76-E308 HydrophobicContact CG-CG 3.97Å; M76-N311 HydrophobicContact CE-CB 4Å; M76-N311 HydrophobicContact SD-CB 4.04Å
77	E	94.5	Very high	86.4	Confident	107 Å²	107	59 Å²	59	50%	0.5	33%	0.327	S	S	.	.	H	α-helix	trans	-64.6	-47.6	172.1	-75	177.7	-171.3	0	0	111.5	S73 L74 L79 S80 V81	S73-E77 WeakPolarHBondContact O-CG 3.28Å; S73-E77 PolarHBondContact O-N 2.64Å; L74-E77 PolarHBondContact O-N 3.32Å; E77-L79 VanDerWaalsContact C-N 3.32Å; E77-L79 PolarHBondContact O-N 2.97Å; E77-S80 WeakPolarHBondContact O-CA 3.23Å; E77-S80 VanDerWaalsContact O-CB 3.27Å; E77-S80 WeakPolarHBondContact O-CB 3.14Å; E77-S80 PolarHBondContact O-N 3.29Å; E77-S80 VanDerWaalsContact O-N 3.07Å; E77-V81 PolarHBondContact O-N 3.28Å
78	N	94	Very high	88.2	Confident	85 Å²	85	55.8 Å²	55.8	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-41.8	176.4	-76	-31.1	0	0	0	112	L74 Y75 S80 V81 K82	L74-N78 WeakPolarHBondContact O-CB 3.46Å; L74-N78 VanDerWaalsContact O-CG 3.3Å; L74-N78 PolarHBondContact O-N 3.09Å; L74-N78 PolarHBondContact O-ND2 2.88Å; Y75-N78 PolarHBondContact O-N 2.84Å; N78-S80 VanDerWaalsContact C-N 3.31Å; N78-S80 PolarHBondContact O-N 3.04Å; N78-V81 PolarHBondContact O-N 3.4Å; N78-K82 PolarHBondContact O-N 3.22Å; N78-K82 VanDerWaalsContact O-N 3.13Å
79	L	95.2	Very high	89.8	Confident	8 Å²	8	56.7 Å²	56.7	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-41.2	173.7	177.9	56.1	0	0	0	111.5	Y75 M76 E77 V81 K82 I83 F227 F310 L395 L401	Y75-L79 HydrophobicContact CE1-CD2 4.47Å; Y75-L79 WeakPolarHBondContact O-CB 3.29Å; Y75-L79 PolarHBondContact O-N 3.47Å; M76-L79 HydrophobicContact SD-CD2 4.4Å; E77-L79 VanDerWaalsContact C-N 3.32Å; E77-L79 PolarHBondContact O-N 2.97Å; L79-V81 VanDerWaalsContact C-N 3.31Å; L79-V81 PolarHBondContact O-N 3.32Å; L79-K82 PolarHBondContact O-N 3.05Å; L79-I83 HydrophobicContact CD1-CD1 4.19Å; L79-I83 HydrophobicContact CD1-CG1 4.23Å; L79-I83 HydrophobicContact CG-CD1 3.96Å; L79-I83 HydrophobicContact CG-CG1 4.46Å; L79-I83 VanDerWaalsContact O-CG1 3.29Å; L79-I83 WeakPolarHBondContact O-CG1 3.46Å; L79-I83 PolarHBondContact O-N 2.87Å; L79-F227 HydrophobicContact CD1-CZ 4.25Å; L79-F310 HydrophobicContact CD2-CD1 4.19Å; L79-L395 HydrophobicContact CD2-CD2 3.84Å; L79-L401 HydrophobicContact CD1-CD1 3.37Å; L79-L401 HydrophobicContact CD1-CG 4.43Å; L79-L401 HydrophobicContact CD2-CD1 4.44Å
80	S	96.9	Very high	91.3	Very high	16 Å²	16	55.2 Å²	55.2	11%	0.112	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-41.3	175.9	-62	0	0	0	0	112.5	M76 E77 N78 I83 W84 N305 L306 G307	M76-S80 WeakPolarHBondContact O-CB 3.24Å; M76-S80 PolarHBondContact O-N 2.79Å; M76-S80 PolarHBondContact O-OG 2.89Å; E77-S80 WeakPolarHBondContact O-CA 3.23Å; E77-S80 VanDerWaalsContact O-CB 3.27Å; E77-S80 WeakPolarHBondContact O-CB 3.14Å; E77-S80 PolarHBondContact O-N 3.29Å; E77-S80 VanDerWaalsContact O-N 3.07Å; N78-S80 VanDerWaalsContact C-N 3.31Å; N78-S80 PolarHBondContact O-N 3.04Å; S80-I83 PolarHBondContact O-N 2.8Å; S80-W84 WeakPolarHBondContact O-CB 3.29Å; S80-W84 PolarHBondContact O-N 3.17Å; S80-N305 WeakPolarHBondContact OG-CB 3.2Å; S80-N305 VanDerWaalsContact OG-CG 3.27Å; S80-N305 PolarHBondContact OG-OD1 2.85Å; S80-L306 PolarHBondContact OG-N 2.94Å; S80-G307 PolarHBondContact OG-N 3.29Å
81	V	96	Very high	93	Very high	77 Å²	77	52.8 Å²	52.8	47%	0.467	28%	0.279	S	S	.	.	H	α-helix	trans	-60.9	-48.8	175.4	174.8	0	0	0	0	110.4	E77 N78 L79 I83 W84 E85	E77-V81 PolarHBondContact O-N 3.28Å; N78-V81 PolarHBondContact O-N 3.4Å; L79-V81 VanDerWaalsContact C-N 3.31Å; L79-V81 PolarHBondContact O-N 3.32Å; V81-I83 VanDerWaalsContact C-N 3.34Å; V81-I83 PolarHBondContact O-N 2.94Å; V81-W84 WeakPolarHBondContact O-CB 3.28Å; V81-W84 PolarHBondContact O-N 2.91Å; V81-W84 VanDerWaalsContact O-N 3.11Å; V81-E85 HydrophobicContact CG1-CG 4.23Å; V81-E85 WeakPolarHBondContact O-CG 3.27Å; V81-E85 PolarHBondContact O-N 3.3Å
82	K	95.2	Very high	93.9	Very high	66 Å²	66	51.6 Å²	51.6	29%	0.287	27%	0.267	S	S	.	.	H	α-helix	trans	-60.6	-41.2	178.5	-67.1	-179.7	-176.3	-179.6	0	112.7	N78 L79 W84 L86 E402 L407	N78-K82 PolarHBondContact O-N 3.22Å; N78-K82 VanDerWaalsContact O-N 3.13Å; L79-K82 PolarHBondContact O-N 3.05Å; K82-W84 VanDerWaalsContact C-N 3.33Å; K82-W84 PolarHBondContact O-N 3.04Å; K82-L86 WeakPolarHBondContact O-CB 3.33Å; K82-L86 PolarHBondContact O-N 2.81Å; K82-E402 VanDerWaalsContact CE-OE1 3.3Å; K82-E402 WeakPolarHBondContact CE-OE1 3.49Å; K82-E402 VanDerWaalsContact NZ-CD 3.28Å; K82-E402 IonicContact NZ-OE1 2.81Å; K82-E402 PolarHBondContact NZ-OE1 3.02Å; K82-E402 IonicContact NZ-OE2 3.59Å; K82-E402 PolarHBondContact NZ-OE2 2.98Å; K82-E402 VanDerWaalsContact NZ-OE2 3.14Å; K82-L407 HydrophobicContact CB-CD1 4.48Å; K82-L407 HydrophobicContact CD-CD1 3.91Å
83	I	96.9	Very high	94.9	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-46	175	-67.4	167.4	0	0	0	110.1	L79 S80 V81 Y87 P223 F227 L306 F310	L79-I83 HydrophobicContact CD1-CD1 4.19Å; L79-I83 HydrophobicContact CD1-CG1 4.23Å; L79-I83 HydrophobicContact CG-CD1 3.96Å; L79-I83 HydrophobicContact CG-CG1 4.46Å; L79-I83 VanDerWaalsContact O-CG1 3.29Å; L79-I83 WeakPolarHBondContact O-CG1 3.46Å; L79-I83 PolarHBondContact O-N 2.87Å; S80-I83 PolarHBondContact O-N 2.8Å; V81-I83 VanDerWaalsContact C-N 3.34Å; V81-I83 PolarHBondContact O-N 2.94Å; I83-Y87 WeakPolarHBondContact O-CB 3.38Å; I83-Y87 PolarHBondContact O-N 3.47Å; I83-P223 HydrophobicContact CG2-CB 4Å; I83-F227 HydrophobicContact CB-CD2 4.07Å; I83-F227 HydrophobicContact CB-CE2 4.42Å; I83-F227 HydrophobicContact CB-CG 4.32Å; I83-F227 HydrophobicContact CD1-CD1 4.3Å; I83-F227 HydrophobicContact CD1-CE1 4.3Å; I83-F227 HydrophobicContact CG1-CD1 3.89Å; I83-F227 HydrophobicContact CG1-CD2 3.61Å; I83-F227 HydrophobicContact CG1-CE1 3.91Å; I83-F227 HydrophobicContact CG1-CE2 3.64Å; I83-F227 HydrophobicContact CG1-CG 3.75Å; I83-F227 HydrophobicContact CG1-CZ 3.79Å; I83-F227 HydrophobicContact CG2-CB 3.94Å; I83-F227 HydrophobicContact CG2-CD2 4.22Å; I83-F227 HydrophobicContact CG2-CG 4.08Å; I83-L306 HydrophobicContact CB-CB 4.26Å; I83-L306 HydrophobicContact CB-CD1 4.29Å; I83-L306 HydrophobicContact CD1-CB 3.91Å; I83-L306 WeakPolarHBondContact CD1-O 3.45Å; I83-L306 HydrophobicContact CG2-CB 4.12Å; I83-L306 HydrophobicContact CG2-CD1 3.9Å; I83-L306 HydrophobicContact CG2-CD2 4.29Å; I83-L306 HydrophobicContact CG2-CG 4.35Å; I83-F310 HydrophobicContact CD1-CB 4.01Å
84	W	97.3	Very high	95.4	Very high	96 Å²	96	52.9 Å²	52.9	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-66.9	-42.4	-179.4	-174.5	-100.7	0	0	0	113	S80 V81 K82 Y87 G88 W219 P223 L306	S80-W84 WeakPolarHBondContact O-CB 3.29Å; S80-W84 PolarHBondContact O-N 3.17Å; V81-W84 WeakPolarHBondContact O-CB 3.28Å; V81-W84 PolarHBondContact O-N 2.91Å; V81-W84 VanDerWaalsContact O-N 3.11Å; K82-W84 VanDerWaalsContact C-N 3.33Å; K82-W84 PolarHBondContact O-N 3.04Å; W84-Y87 HydrophobicContact CE3-CD1 4.15Å; W84-Y87 HydrophobicContact CH2-CE1 4.37Å; W84-Y87 HydrophobicContact CZ3-CD1 4.15Å; W84-Y87 HydrophobicContact CZ3-CE1 4.2Å; W84-Y87 WeakPolarHBondContact O-CB 3.39Å; W84-Y87 PolarHBondContact O-N 3.02Å; W84-G88 PolarHBondContact O-N 3.27Å; W84-W219 HydrophobicContact CE3-CE3 4.35Å; W84-W219 AromaticContact CE3-CZ3 3.86Å; W84-W219 HydrophobicContact CE3-CZ3 3.86Å; W84-W219 HydrophobicContact CH2-CE3 4.4Å; W84-W219 AromaticContact CZ3-CE3 3.66Å; W84-W219 HydrophobicContact CZ3-CE3 3.66Å; W84-W219 AromaticContact CZ3-CZ3 3.62Å; W84-W219 HydrophobicContact CZ3-CZ3 3.62Å; W84-P223 HydrophobicContact CE3-CB 4.48Å; W84-P223 HydrophobicContact CE3-CG 3.86Å; W84-P223 HydrophobicContact CZ3-CG 3.79Å; W84-L306 HydrophobicContact CB-CD1 4.29Å; W84-L306 HydrophobicContact CE3-CD1 4.2Å
85	E	96.1	Very high	95.6	Very high	120 Å²	120	53.5 Å²	53.5	56%	0.561	28%	0.277	S	S	*	.	H	α-helix	trans	-62.2	-46.5	176.5	-73.8	178	163.1	0	0	111.6	V81 Y87 G88 R89	V81-E85 HydrophobicContact CG1-CG 4.23Å; V81-E85 WeakPolarHBondContact O-CG 3.27Å; V81-E85 PolarHBondContact O-N 3.3Å; E85-Y87 VanDerWaalsContact C-N 3.31Å; E85-Y87 PolarHBondContact O-N 2.73Å; E85-G88 PolarHBondContact O-N 3.22Å; E85-R89 WeakPolarHBondContact O-CB 3.3Å; E85-R89 PolarHBondContact O-N 3.42Å
86	L	95.2	Very high	95.7	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-45.2	175.2	-175.9	73.3	0	0	0	110.9	K82 R89 T90 F227 H230	K82-L86 WeakPolarHBondContact O-CB 3.33Å; K82-L86 PolarHBondContact O-N 2.81Å; L86-R89 PolarHBondContact O-N 2.84Å; L86-T90 HydrophobicContact CD1-CG2 3.88Å; L86-T90 HydrophobicContact CG-CG2 4.29Å; L86-T90 WeakPolarHBondContact O-CB 3.33Å; L86-T90 WeakPolarHBondContact O-CG2 3.29Å; L86-T90 PolarHBondContact O-N 3Å; L86-T90 PolarHBondContact O-OG1 2.83Å; L86-F227 HydrophobicContact CD2-CD2 3.55Å; L86-F227 HydrophobicContact CD2-CE2 4.19Å; L86-F227 HydrophobicContact CD2-CG 4.41Å; L86-H230 HydrophobicContact CD2-CB 3.82Å
87	Y	96.7	Very high	95.8	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-48.8	176.1	168.5	-108.4	0	0	0	111.5	E29 I83 W84 E85 R89 T90 K91 R222 P223 I226	E29-Y87 PolarHBondContact OE1-OH 2.9Å; I83-Y87 WeakPolarHBondContact O-CB 3.38Å; I83-Y87 PolarHBondContact O-N 3.47Å; W84-Y87 HydrophobicContact CE3-CD1 4.15Å; W84-Y87 HydrophobicContact CH2-CE1 4.37Å; W84-Y87 HydrophobicContact CZ3-CD1 4.15Å; W84-Y87 HydrophobicContact CZ3-CE1 4.2Å; W84-Y87 WeakPolarHBondContact O-CB 3.39Å; W84-Y87 PolarHBondContact O-N 3.02Å; E85-Y87 VanDerWaalsContact C-N 3.31Å; E85-Y87 PolarHBondContact O-N 2.73Å; Y87-R89 VanDerWaalsContact C-N 3.34Å; Y87-R89 PolarHBondContact O-N 3.41Å; Y87-T90 PolarHBondContact O-N 3.35Å; Y87-K91 HydrophobicContact CD1-CD 4.34Å; Y87-K91 HydrophobicContact CD2-CB 4.21Å; Y87-K91 HydrophobicContact CE1-CD 3.82Å; Y87-K91 HydrophobicContact CE2-CB 3.94Å; Y87-K91 HydrophobicContact CE2-CD 4Å; Y87-K91 WeakPolarHBondContact O-CB 3.39Å; Y87-K91 WeakPolarHBondContact O-CG 3.45Å; Y87-K91 PolarHBondContact O-N 3.01Å; Y87-R222 HydrophobicContact CE2-CB 3.92Å; Y87-R222 PolarHBondContact OH-NE 3.01Å; Y87-R222 PolarHBondContact OH-NH1 3.31Å; Y87-R222 VanDerWaalsContact OH-NH1 3.07Å; Y87-R222 PolarHBondContact OH-NH2 3.4Å; Y87-P223 HydrophobicContact CD1-CB 4.27Å; Y87-P223 HydrophobicContact CD1-CG 3.79Å; Y87-P223 HydrophobicContact CD2-CB 4.26Å; Y87-P223 HydrophobicContact CD2-CG 4.19Å; Y87-P223 HydrophobicContact CE1-CG 4.07Å; Y87-P223 HydrophobicContact CE2-CG 4.48Å; Y87-P223 HydrophobicContact CG-CB 3.9Å; Y87-P223 HydrophobicContact CG-CG 3.86Å; Y87-I226 HydrophobicContact CD2-CB 4.43Å; Y87-I226 HydrophobicContact CD2-CD1 3.79Å; Y87-I226 HydrophobicContact CD2-CG1 4.34Å; Y87-I226 HydrophobicContact CE2-CD1 4Å
88	G	96.1	Very high	95.9	Very high	42 Å²	42	56 Å²	56	43%	0.433	29%	0.286	S	S	.	.	H	α-helix	trans	-58.4	-42.5	178.8	0	0	0	0	0	113.2	W84 E85	W84-G88 PolarHBondContact O-N 3.27Å; E85-G88 PolarHBondContact O-N 3.22Å
89	R	94.4	Very high	96	Very high	93 Å²	93	56.3 Å²	56.3	35%	0.351	28%	0.283	S	S	.	.	H	α-helix	trans	-72.2	-38.3	-179.8	-178.9	171.2	63	-153.7	-0.1	113.5	E85 L86 Y87 L407 G408 N409	E85-R89 WeakPolarHBondContact O-CB 3.3Å; E85-R89 PolarHBondContact O-N 3.42Å; L86-R89 PolarHBondContact O-N 2.84Å; Y87-R89 VanDerWaalsContact C-N 3.34Å; Y87-R89 PolarHBondContact O-N 3.41Å; R89-L407 PolarHBondContact NH2-O 3.04Å; R89-G408 PolarHBondContact NH1-O 3.27Å; R89-G408 PolarHBondContact NH2-O 3.09Å; R89-N409 PolarHBondContact NH1-OD1 3.14Å
90	T	94.3	Very high	96.1	Very high	39 Å²	39	55.9 Å²	55.9	24%	0.239	28%	0.281	C	S	.	.	H	α-helix	trans	-101	-24.2	-167.4	61.4	0	0	0	0	114.3	L86 Y87 S132 N133 I226	L86-T90 HydrophobicContact CD1-CG2 3.88Å; L86-T90 HydrophobicContact CG-CG2 4.29Å; L86-T90 WeakPolarHBondContact O-CB 3.33Å; L86-T90 WeakPolarHBondContact O-CG2 3.29Å; L86-T90 PolarHBondContact O-N 3Å; L86-T90 PolarHBondContact O-OG1 2.83Å; Y87-T90 PolarHBondContact O-N 3.35Å; T90-S132 CarbonylContact O-C 3.59Å; T90-S132 WeakPolarHBondContact O-CA 3.49Å; T90-S132 VanDerWaalsContact O-CB 3.27Å; T90-S132 WeakPolarHBondContact O-CB 2.97Å; T90-N133 PolarHBondContact O-N 2.81Å; T90-N133 VanDerWaalsContact O-N 3.08Å; T90-I226 WeakPolarHBondContact OG1-CG2 3.25Å
91	K	95.9	Very high	96.1	Very high	58 Å²	58	56.3 Å²	56.3	25%	0.252	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	-52.9	146.7	-177.7	70.3	-175.9	-174	-177.8	0	111.8	E29 Y87 S93 N133 I226	E29-K91 IonicContact OE2-NZ 3.82Å; E29-K91 PolarHBondContact OE2-NZ 3.41Å; Y87-K91 HydrophobicContact CD1-CD 4.34Å; Y87-K91 HydrophobicContact CD2-CB 4.21Å; Y87-K91 HydrophobicContact CE1-CD 3.82Å; Y87-K91 HydrophobicContact CE2-CB 3.94Å; Y87-K91 HydrophobicContact CE2-CD 4Å; Y87-K91 WeakPolarHBondContact O-CB 3.39Å; Y87-K91 WeakPolarHBondContact O-CG 3.45Å; Y87-K91 PolarHBondContact O-N 3.01Å; K91-S93 PolarHBondContact O-N 3.42Å; K91-S93 VanDerWaalsContact O-N 3.08Å; K91-N133 PolarHBondContact O-ND2 2.94Å; K91-I226 HydrophobicContact CB-CD1 4.09Å
92	Q	96.6	Very high	96.1	Very high	37 Å²	37	56.3 Å²	56.3	17%	0.173	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-57.3	118.8	176.4	-175.9	175.4	-94.4	0	0	109.8	K96 Y97 S126 G131	Q92-K96 HydrophobicContact CG-CB 4.2Å; Q92-K96 HydrophobicContact CG-CG 4.23Å; Q92-Y97 VanDerWaalsContact NE2-CD2 3.26Å; Q92-S126 PolarHBondContact NE2-O 3.1Å; Q92-G131 WeakPolarHBondContact CB-O 3.48Å; Q92-G131 PolarHBondContact N-O 2.99Å
93	S	96.3	Very high	96.2	Very high	36 Å²	36	53.5 Å²	53.5	25%	0.252	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-71.6	152.7	177.6	62.4	0	0	0	0	111	K91 L95 K96 Y97 N133	K91-S93 PolarHBondContact O-N 3.42Å; K91-S93 VanDerWaalsContact O-N 3.08Å; S93-L95 PolarHBondContact O-N 3.42Å; S93-K96 PolarHBondContact O-N 2.93Å; S93-K96 VanDerWaalsContact O-N 3.15Å; S93-K96 WeakPolarHBondContact OG-CB 3.45Å; S93-K96 PolarHBondContact OG-N 3.12Å; S93-K96 VanDerWaalsContact OG-N 3.08Å; S93-Y97 PolarHBondContact O-N 3.02Å; S93-N133 WeakPolarHBondContact CB-OD1 3.16Å; S93-N133 PolarHBondContact N-OD1 3.31Å; S93-N133 PolarHBondContact OG-OD1 3.31Å
94	P	95.8	Very high	96.2	Very high	83 Å²	83	54.6 Å²	54.6	54%	0.539	28%	0.278	S	S	.	.	H	α-helix	trans	-53.7	-35.9	171.3	-25.3	33.3	0	0	0	112.4	V25 Y97 K98	V25-P94 HydrophobicContact CG1-CG 4.44Å; V25-P94 HydrophobicContact CG2-CB 4.2Å; V25-P94 HydrophobicContact CG2-CG 4.16Å; P94-Y97 PolarHBondContact O-N 2.7Å; P94-K98 WeakPolarHBondContact O-CB 3.5Å; P94-K98 PolarHBondContact O-N 2.76Å
95	L	95.9	Very high	96.2	Very high	110 Å²	110	54 Å²	54	58%	0.576	28%	0.282	S	S	*	.	H	α-helix	trans	-66.8	-46.3	177.6	-178.9	61.4	0	0	0	112.5	S93 Y97 K98 K99	S93-L95 PolarHBondContact O-N 3.42Å; L95-Y97 VanDerWaalsContact C-N 3.29Å; L95-Y97 PolarHBondContact O-N 3.06Å; L95-K98 PolarHBondContact O-N 3.35Å; L95-K99 WeakPolarHBondContact O-CG 3Å; L95-K99 PolarHBondContact O-N 3.47Å
96	K	95.9	Very high	96.2	Very high	36 Å²	36	49.9 Å²	49.9	16%	0.157	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-42.7	175.8	-178.1	73.3	177.7	-164	0	110.6	Q92 S93 K99 K100 N133	Q92-K96 HydrophobicContact CG-CB 4.2Å; Q92-K96 HydrophobicContact CG-CG 4.23Å; S93-K96 PolarHBondContact O-N 2.93Å; S93-K96 VanDerWaalsContact O-N 3.15Å; S93-K96 WeakPolarHBondContact OG-CB 3.45Å; S93-K96 PolarHBondContact OG-N 3.12Å; S93-K96 VanDerWaalsContact OG-N 3.08Å; K96-K99 WeakPolarHBondContact O-CB 3.3Å; K96-K99 PolarHBondContact O-N 3.13Å; K96-K100 PolarHBondContact O-N 2.97Å; K96-K100 VanDerWaalsContact O-N 3.12Å; K96-N133 VanDerWaalsContact CB-OD1 3.28Å; K96-N133 WeakPolarHBondContact CB-OD1 3.33Å; K96-N133 WeakPolarHBondContact CE-O 3.4Å; K96-N133 PolarHBondContact NZ-O 2.65Å
97	Y	96.1	Very high	96.2	Very high	24 Å²	24	49.8 Å²	49.8	9%	0.094	27%	0.268	C	S	.	.	H	α-helix	trans	-64.2	-43.6	177.5	-175.4	-119.7	0	0	0	112.4	L23 Q92 S93 P94 L95 K99 K100 I101 S126	L23-Y97 HydrophobicContact CB-CE1 3.97Å; L23-Y97 HydrophobicContact CD1-CE1 3.47Å; L23-Y97 VanDerWaalsContact CD1-CE1 3.47Å; L23-Y97 HydrophobicContact CD2-CE1 3.61Å; L23-Y97 WeakPolarHBondContact CD2-OH 3.45Å; L23-Y97 HydrophobicContact CG-CE1 3.82Å; Q92-Y97 VanDerWaalsContact NE2-CD2 3.26Å; S93-Y97 PolarHBondContact O-N 3.02Å; P94-Y97 PolarHBondContact O-N 2.7Å; L95-Y97 VanDerWaalsContact C-N 3.29Å; L95-Y97 PolarHBondContact O-N 3.06Å; Y97-K99 VanDerWaalsContact C-N 3.29Å; Y97-K99 PolarHBondContact O-N 3.08Å; Y97-K100 WeakPolarHBondContact O-CA 3.39Å; Y97-K100 WeakPolarHBondContact O-CB 3.3Å; Y97-K100 PolarHBondContact O-N 2.9Å; Y97-I101 HydrophobicContact CD1-CG1 4.46Å; Y97-I101 HydrophobicContact CE1-CD1 4.38Å; Y97-I101 HydrophobicContact CE1-CG1 4.13Å; Y97-I101 HydrophobicContact CE2-CD1 4.14Å; Y97-I101 HydrophobicContact CE2-CG1 4.31Å; Y97-I101 PolarHBondContact O-N 2.84Å; Y97-S126 WeakPolarHBondContact CE2-O 3.49Å
98	K	96.5	Very high	96.2	Very high	141 Å²	141	53.2 Å²	53.2	61%	0.613	28%	0.284	S	S	*	.	H	α-helix	trans	-56.3	-42.3	173.9	-173.9	177.1	-178.6	178.4	0	112	P94 L95 K100 I101 C102	P94-K98 WeakPolarHBondContact O-CB 3.5Å; P94-K98 PolarHBondContact O-N 2.76Å; L95-K98 PolarHBondContact O-N 3.35Å; K98-K100 PolarHBondContact O-N 2.87Å; K98-I101 PolarHBondContact O-N 3.24Å; K98-C102 PolarHBondContact O-N 2.79Å; K98-C102 PolarHBondContact O-SG 3.09Å; K98-C102 VanDerWaalsContact O-SG 3.37Å
99	K	96.9	Very high	96.1	Very high	92 Å²	92	58.4 Å²	58.4	40%	0.4	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-41.9	174.5	-69.6	179.9	178.3	-174.1	0	112.2	L95 K96 Y97 C102 L103 A191 I193	L95-K99 WeakPolarHBondContact O-CG 3Å; L95-K99 PolarHBondContact O-N 3.47Å; K96-K99 WeakPolarHBondContact O-CB 3.3Å; K96-K99 PolarHBondContact O-N 3.13Å; Y97-K99 VanDerWaalsContact C-N 3.29Å; Y97-K99 PolarHBondContact O-N 3.08Å; K99-C102 PolarHBondContact O-N 3.08Å; K99-L103 PolarHBondContact O-N 2.86Å; K99-A191 HydrophobicContact CB-CB 4.04Å; K99-A191 HydrophobicContact CD-CB 4.09Å; K99-A191 HydrophobicContact CG-CB 4.46Å; K99-I193 HydrophobicContact CB-CD1 4.01Å
100	K	97.4	Very high	96.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-42.9	173.9	-71.2	-179.5	173.3	-175.9	0	111.9	K96 Y97 K98 L103 L104 S126 S135 D136 M137 I193	K96-K100 PolarHBondContact O-N 2.97Å; K96-K100 VanDerWaalsContact O-N 3.12Å; Y97-K100 WeakPolarHBondContact O-CA 3.39Å; Y97-K100 WeakPolarHBondContact O-CB 3.3Å; Y97-K100 PolarHBondContact O-N 2.9Å; K98-K100 PolarHBondContact O-N 2.87Å; K100-L103 PolarHBondContact O-N 3.31Å; K100-L104 WeakPolarHBondContact O-CB 3.47Å; K100-L104 PolarHBondContact O-N 3.39Å; K100-S126 WeakPolarHBondContact CD-OG 3.36Å; K100-S126 PolarHBondContact NZ-OG 3.15Å; K100-S135 WeakPolarHBondContact CE-O 3.32Å; K100-S135 PolarHBondContact NZ-O 2.92Å; K100-D136 PolarHBondContact NZ-O 3.04Å; K100-M137 HydrophobicContact CB-CE 4.38Å; K100-M137 HydrophobicContact CB-CG 4.49Å; K100-M137 HydrophobicContact CB-SD 3.76Å; K100-M137 HydrophobicContact CD-CB 4.35Å; K100-M137 HydrophobicContact CD-CG 4.41Å; K100-M137 HydrophobicContact CG-CB 4.39Å; K100-M137 HydrophobicContact CG-CG 4.33Å; K100-M137 HydrophobicContact CG-SD 3.95Å; K100-M137 WeakPolarHBondContact O-CE 3.49Å; K100-I193 HydrophobicContact CG-CD1 3.75Å
101	I	96.5	Very high	96.2	Very high	25 Å²	25	53.7 Å²	53.7	13%	0.128	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-43.1	177.1	-62.2	-63.6	0	0	0	111.8	L23 Y97 K98 L103 L104 N105 I122	L23-I101 HydrophobicContact CD1-CD1 4.08Å; L23-I101 HydrophobicContact CD1-CG1 4.12Å; Y97-I101 HydrophobicContact CD1-CG1 4.46Å; Y97-I101 HydrophobicContact CE1-CD1 4.38Å; Y97-I101 HydrophobicContact CE1-CG1 4.13Å; Y97-I101 HydrophobicContact CE2-CD1 4.14Å; Y97-I101 HydrophobicContact CE2-CG1 4.31Å; Y97-I101 PolarHBondContact O-N 2.84Å; K98-I101 PolarHBondContact O-N 3.24Å; I101-L103 VanDerWaalsContact C-N 3.31Å; I101-L103 PolarHBondContact O-N 3.5Å; I101-L104 WeakPolarHBondContact O-CB 3.49Å; I101-L104 PolarHBondContact O-N 3.3Å; I101-N105 PolarHBondContact O-N 3.32Å; I101-I122 HydrophobicContact CD1-CD1 3.7Å
102	C	96.9	Very high	96.1	Very high	76 Å²	76	53.1 Å²	53.1	51%	0.514	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-43	174.8	-68.3	0	0	0	0	111.8	K98 K99 N105 A106	K98-C102 PolarHBondContact O-N 2.79Å; K98-C102 PolarHBondContact O-SG 3.09Å; K98-C102 VanDerWaalsContact O-SG 3.37Å; K99-C102 PolarHBondContact O-N 3.08Å; C102-N105 PolarHBondContact O-N 3.34Å; C102-A106 PolarHBondContact O-N 3.06Å; C102-A106 VanDerWaalsContact O-N 3.1Å
103	L	97.1	Very high	95.9	Very high	8 Å²	8	54.8 Å²	54.8	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-42.8	175.8	179.7	58.3	0	0	0	112	K99 K100 I101 N105 A106 L107 M137 F170 L171 D188 I193 C195	K99-L103 PolarHBondContact O-N 2.86Å; K100-L103 PolarHBondContact O-N 3.31Å; I101-L103 VanDerWaalsContact C-N 3.31Å; I101-L103 PolarHBondContact O-N 3.5Å; L103-N105 VanDerWaalsContact C-N 3.32Å; L103-N105 PolarHBondContact O-N 3.25Å; L103-A106 PolarHBondContact O-N 3.12Å; L103-L107 HydrophobicContact CD1-CD1 4.12Å; L103-L107 HydrophobicContact CD1-CG 4.1Å; L103-L107 HydrophobicContact CG-CD1 3.95Å; L103-L107 HydrophobicContact CG-CG 4.39Å; L103-L107 WeakPolarHBondContact O-CB 3.36Å; L103-L107 VanDerWaalsContact O-CG 3.3Å; L103-L107 WeakPolarHBondContact O-CG 3.08Å; L103-L107 PolarHBondContact O-N 3.24Å; L103-M137 HydrophobicContact CB-SD 4.43Å; L103-M137 HydrophobicContact CD2-SD 4.01Å; L103-M137 HydrophobicContact CG-SD 4.37Å; L103-F170 HydrophobicContact CD1-CD2 4.23Å; L103-F170 HydrophobicContact CD1-CE2 3.86Å; L103-L171 HydrophobicContact CD1-CD2 4.27Å; L103-D188 HydrophobicContact CD1-CB 3.89Å; L103-D188 HydrophobicContact CD2-CB 3.57Å; L103-D188 HydrophobicContact CG-CB 4.37Å; L103-I193 HydrophobicContact CD2-CB 4.29Å; L103-I193 HydrophobicContact CD2-CG2 4.35Å; L103-C195 VanDerWaalsContact CD2-SG 3.55Å
104	L	96.9	Very high	95.8	Very high	23 Å²	23	54.2 Å²	54.2	12%	0.12	31%	0.306	C	S	.	.	H	α-helix	trans	-54.9	-48.5	175.2	-170.5	74.7	0	0	0	111.1	K100 I101 A106 L107 H108 L120 I122 M137 M139	K100-L104 WeakPolarHBondContact O-CB 3.47Å; K100-L104 PolarHBondContact O-N 3.39Å; I101-L104 WeakPolarHBondContact O-CB 3.49Å; I101-L104 PolarHBondContact O-N 3.3Å; L104-A106 PolarHBondContact O-N 3.44Å; L104-L107 PolarHBondContact O-N 2.98Å; L104-H108 WeakPolarHBondContact O-CB 3.48Å; L104-H108 PolarHBondContact O-N 3.48Å; L104-L120 HydrophobicContact CD1-CD2 3.63Å; L104-L120 HydrophobicContact CD1-CG 3.69Å; L104-L120 HydrophobicContact CG-CD2 4.25Å; L104-I122 HydrophobicContact CB-CD1 4.38Å; L104-I122 HydrophobicContact CD1-CD1 4.35Å; L104-I122 HydrophobicContact CD1-CG1 3.63Å; L104-I122 HydrophobicContact CD2-CD1 3.93Å; L104-I122 HydrophobicContact CD2-CG1 3.79Å; L104-I122 HydrophobicContact CG-CD1 4.45Å; L104-I122 HydrophobicContact CG-CG1 4.19Å; L104-M137 HydrophobicContact CB-CE 3.61Å; L104-M137 HydrophobicContact CD1-CE 3.68Å; L104-M137 HydrophobicContact CG-CE 4.25Å; L104-M139 HydrophobicContact CD1-CG 4.17Å; L104-M139 HydrophobicContact CD1-SD 3.96Å
105	N	96.3	Very high	95.7	Very high	82 Å²	82	51.8 Å²	51.8	44%	0.439	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-42.6	-179.3	-68.7	-17	0	0	0	111.6	I101 C102 L103 H108 M109	I101-N105 PolarHBondContact O-N 3.32Å; C102-N105 PolarHBondContact O-N 3.34Å; L103-N105 VanDerWaalsContact C-N 3.32Å; L103-N105 PolarHBondContact O-N 3.25Å; N105-H108 PolarHBondContact O-N 3.04Å; N105-M109 WeakPolarHBondContact O-CG 3.37Å; N105-M109 PolarHBondContact O-N 3.32Å; N105-M109 VanDerWaalsContact O-N 3.14Å
106	A	95.7	Very high	95.4	Very high	34 Å²	34	54.6 Å²	54.6	28%	0.281	30%	0.297	S	S	.	.	H	α-helix	trans	-63	-43.4	176	0	0	0	0	0	112	C102 L103 L104 M109 V110 F170	C102-A106 PolarHBondContact O-N 3.06Å; C102-A106 VanDerWaalsContact O-N 3.1Å; L103-A106 PolarHBondContact O-N 3.12Å; L104-A106 PolarHBondContact O-N 3.44Å; A106-M109 PolarHBondContact O-N 3.37Å; A106-V110 PolarHBondContact O-N 3.02Å; A106-F170 HydrophobicContact CB-CE2 4.41Å; A106-F170 HydrophobicContact CB-CZ 4.16Å
107	L	96.8	Very high	95	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.016	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-40.4	176	-71.1	170.9	0	0	0	111.8	L103 L104 M109 V110 I111 L120 M139 L165 L171 F186	L103-L107 HydrophobicContact CD1-CD1 4.12Å; L103-L107 HydrophobicContact CD1-CG 4.1Å; L103-L107 HydrophobicContact CG-CD1 3.95Å; L103-L107 HydrophobicContact CG-CG 4.39Å; L103-L107 WeakPolarHBondContact O-CB 3.36Å; L103-L107 VanDerWaalsContact O-CG 3.3Å; L103-L107 WeakPolarHBondContact O-CG 3.08Å; L103-L107 PolarHBondContact O-N 3.24Å; L104-L107 PolarHBondContact O-N 2.98Å; L107-M109 VanDerWaalsContact C-N 3.33Å; L107-M109 PolarHBondContact O-N 2.96Å; L107-V110 PolarHBondContact O-N 3.49Å; L107-V110 VanDerWaalsContact O-N 3.16Å; L107-I111 WeakPolarHBondContact O-CB 3.3Å; L107-I111 WeakPolarHBondContact O-CD1 3.46Å; L107-I111 WeakPolarHBondContact O-CG1 3.47Å; L107-I111 PolarHBondContact O-N 3.34Å; L107-L120 HydrophobicContact CB-CD2 3.82Å; L107-M139 HydrophobicContact CD1-CE 3.69Å; L107-M139 HydrophobicContact CD1-SD 3.59Å; L107-M139 VanDerWaalsContact CD1-SD 3.59Å; L107-L165 HydrophobicContact CD2-CD2 3.81Å; L107-L171 HydrophobicContact CD2-CD1 3.72Å; L107-L171 HydrophobicContact CD2-CD2 4.44Å; L107-F186 HydrophobicContact CD1-CE2 3.98Å; L107-F186 HydrophobicContact CD1-CZ 3.8Å; L107-F186 HydrophobicContact CD2-CE2 4.01Å; L107-F186 HydrophobicContact CD2-CZ 3.99Å
108	H	95.5	Very high	94.8	Very high	76 Å²	76	59 Å²	59	35%	0.352	33%	0.325	S	S	.	.	H	α-helix	trans	-58.3	-44.4	177	-172.8	-100.5	0	0	0	111.1	L104 N105 V110 I111 S112 L120	L104-H108 WeakPolarHBondContact O-CB 3.48Å; L104-H108 PolarHBondContact O-N 3.48Å; N105-H108 PolarHBondContact O-N 3.04Å; H108-V110 VanDerWaalsContact C-N 3.31Å; H108-V110 PolarHBondContact O-N 3.36Å; H108-I111 PolarHBondContact O-N 2.67Å; H108-I111 VanDerWaalsContact O-N 3.17Å; H108-S112 PolarHBondContact O-N 3.46Å; H108-S112 PolarHBondContact O-OG 3.37Å; H108-L120 HydrophobicContact CB-CD2 4.3Å
109	M	94.3	Very high	94.7	Very high	150 Å²	150	53.1 Å²	53.1	74%	0.739	30%	0.304	S	S	*	.	H	α-helix	trans	-57.9	-40.8	175.6	-67.8	-179	72.6	0	0	113	N105 A106 L107	N105-M109 WeakPolarHBondContact O-CG 3.37Å; N105-M109 PolarHBondContact O-N 3.32Å; N105-M109 VanDerWaalsContact O-N 3.14Å; A106-M109 PolarHBondContact O-N 3.37Å; L107-M109 VanDerWaalsContact C-N 3.33Å; L107-M109 PolarHBondContact O-N 2.96Å
110	V	95.2	Very high	94.6	Very high	33 Å²	33	49.4 Å²	49.4	20%	0.2	29%	0.289	C	S	.	.	H	α-helix	trans	-68.1	-42.6	177.5	178.8	0	0	0	0	110.9	A106 L107 H108 G113 L165 C168	A106-V110 PolarHBondContact O-N 3.02Å; L107-V110 PolarHBondContact O-N 3.49Å; L107-V110 VanDerWaalsContact O-N 3.16Å; H108-V110 VanDerWaalsContact C-N 3.31Å; H108-V110 PolarHBondContact O-N 3.36Å; V110-G113 PolarHBondContact O-N 3.25Å; V110-L165 HydrophobicContact CG1-CD2 4.12Å; V110-C168 VanDerWaalsContact CG2-SG 3.53Å
111	I	95.7	Very high	94.5	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-65.7	-42.4	-179.8	-77.4	159.8	0	0	0	111.3	L107 H108 G113 V114 F115 A118 L120 L141 L161	L107-I111 WeakPolarHBondContact O-CB 3.3Å; L107-I111 WeakPolarHBondContact O-CD1 3.46Å; L107-I111 WeakPolarHBondContact O-CG1 3.47Å; L107-I111 PolarHBondContact O-N 3.34Å; H108-I111 PolarHBondContact O-N 2.67Å; H108-I111 VanDerWaalsContact O-N 3.17Å; I111-G113 PolarHBondContact O-N 3.12Å; I111-V114 CarbonylContact O-C 3.54Å; I111-V114 WeakPolarHBondContact O-CA 3.14Å; I111-V114 PolarHBondContact O-N 2.66Å; I111-F115 PolarHBondContact O-N 3.35Å; I111-A118 HydrophobicContact CG2-CB 4.09Å; I111-L120 HydrophobicContact CD1-CD1 3.88Å; I111-L120 HydrophobicContact CD1-CD2 3.73Å; I111-L120 HydrophobicContact CD1-CG 4.26Å; I111-L141 HydrophobicContact CD1-CD1 4.3Å; I111-L141 HydrophobicContact CG2-CD1 3.56Å; I111-L141 HydrophobicContact CG2-CD2 4.48Å; I111-L161 HydrophobicContact CD1-CD2 4.32Å; I111-L161 HydrophobicContact CG1-CD1 3.61Å; I111-L161 HydrophobicContact CG1-CD2 4.04Å; I111-L161 HydrophobicContact CG1-CG 4.47Å
112	S	93.9	Very high	94.5	Very high	45 Å²	45	52.3 Å²	52.3	32%	0.315	30%	0.3	S	S	.	.	H	α-helix	trans	-60.4	-29	177.7	-58.7	0	0	0	0	112.4	H108 V114	H108-S112 PolarHBondContact O-N 3.46Å; H108-S112 PolarHBondContact O-OG 3.37Å; S112-V114 PolarHBondContact O-N 3.07Å
113	G	92.8	Very high	94.5	Very high	73 Å²	73	49.1 Å²	49.1	75%	0.753	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-16.1	171.9	0	0	0	0	0	114.6	V110 I111	V110-G113 PolarHBondContact O-N 3.25Å; I111-G113 PolarHBondContact O-N 3.12Å
114	V	93.8	Very high	94.4	Very high	23 Å²	23	49.6 Å²	49.6	14%	0.139	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-38.7	178	-172.9	0	0	0	0	111.7	I111 S112 R160 L161 S164	I111-V114 CarbonylContact O-C 3.54Å; I111-V114 WeakPolarHBondContact O-CA 3.14Å; I111-V114 PolarHBondContact O-N 2.66Å; S112-V114 PolarHBondContact O-N 3.07Å; V114-R160 HydrophobicContact CG1-CG 4.15Å; V114-L161 HydrophobicContact CG2-CD1 4.39Å; V114-S164 WeakPolarHBondContact CG2-OG 3.04Å
115	F	93.6	Very high	94.4	Very high	32 Å²	32	49.4 Å²	49.4	14%	0.14	29%	0.285	C	S	.	.			trans	-136.2	99.8	-176	-53.7	-72.3	0	0	0	109.9	I111 N117 A118 L141 V143 I157 L161	I111-F115 PolarHBondContact O-N 3.35Å; F115-N117 VanDerWaalsContact C-N 3.31Å; F115-N117 PolarHBondContact O-N 3.13Å; F115-A118 HydrophobicContact CB-CB 3.61Å; F115-A118 PolarHBondContact O-N 3.46Å; F115-L141 HydrophobicContact CD2-CD2 4.35Å; F115-L141 HydrophobicContact CE2-CD2 4.41Å; F115-V143 HydrophobicContact CD2-CG1 4.39Å; F115-V143 HydrophobicContact CG-CG1 4.29Å; F115-I157 HydrophobicContact CE1-CG2 4.27Å; F115-I157 HydrophobicContact CE2-CG2 4.09Å; F115-I157 HydrophobicContact CZ-CG2 3.66Å; F115-L161 HydrophobicContact CE2-CB 4.21Å
116	E	88.8	Confident	94.4	Very high	169 Å²	169	45.7 Å²	45.7	79%	0.79	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.1	-171.4	-172.2	177.8	-173.2	0	0	114.3
117	N	87.8	Confident	94.4	Very high	147 Å²	147	46 Å²	46	79%	0.786	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	23.6	-174.6	-61.2	-50.6	0	0	0	113.2	F115	F115-N117 VanDerWaalsContact C-N 3.31Å; F115-N117 PolarHBondContact O-N 3.13Å
118	A	92.8	Very high	94.4	Very high	7 Å²	7	46.1 Å²	46.1	6%	0.058	26%	0.263	C	S	.	.			trans	-84.3	136.9	-179.6	0	0	0	0	0	111.7	I111 F115 L141 L142 V143	I111-A118 HydrophobicContact CG2-CB 4.09Å; F115-A118 HydrophobicContact CB-CB 3.61Å; F115-A118 PolarHBondContact O-N 3.46Å; A118-L141 HydrophobicContact CB-CD1 3.71Å; A118-L142 CarbonylContact C-O 3.55Å; A118-L142 WeakPolarHBondContact CA-O 3.32Å; A118-L142 WeakPolarHBondContact CB-O 3.4Å; A118-V143 HydrophobicContact CB-CG1 4.11Å
119	G	93.1	Very high	94.4	Very high	16 Å²	16	43.8 Å²	43.8	17%	0.165	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.6	171.5	0	0	0	0	0	111.1	L142	G119-L142 PolarHBondContact N-O 2.81Å; G119-L142 PolarHBondContact O-N 2.89Å
120	L	96	Very high	94.5	Very high	15 Å²	15	36.8 Å²	36.8	8%	0.079	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.4	175.4	-176.3	67.5	0	0	0	110	L104 L107 H108 I111 M139 L141 L197	L104-L120 HydrophobicContact CD1-CD2 3.63Å; L104-L120 HydrophobicContact CD1-CG 3.69Å; L104-L120 HydrophobicContact CG-CD2 4.25Å; L107-L120 HydrophobicContact CB-CD2 3.82Å; H108-L120 HydrophobicContact CB-CD2 4.3Å; I111-L120 HydrophobicContact CD1-CD1 3.88Å; I111-L120 HydrophobicContact CD1-CD2 3.73Å; I111-L120 HydrophobicContact CD1-CG 4.26Å; L120-M139 HydrophobicContact CD1-CB 4.11Å; L120-M139 HydrophobicContact CD1-SD 4.35Å; L120-M139 HydrophobicContact CD2-SD 4.34Å; L120-L141 HydrophobicContact CD1-CB 4.41Å; L120-L141 HydrophobicContact CD1-CD1 4.44Å; L120-L197 HydrophobicContact CD1-CD1 3.68Å
121	Y	95.7	Very high	94.5	Very high	68 Å²	68	35.6 Å²	35.6	27%	0.267	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138	-174.2	-59.8	-94.6	0	0	0	110.9	M139 C140 L142 L205 Y285	Y121-M139 CarbonylContact O-C 3.45Å; Y121-M139 WeakPolarHBondContact O-CA 3.2Å; Y121-C140 PolarHBondContact N-O 2.84Å; Y121-C140 PolarHBondContact O-N 3.09Å; Y121-L142 HydrophobicContact CD2-CD1 3.98Å; Y121-L142 HydrophobicContact CD2-CG 3.99Å; Y121-L142 HydrophobicContact CE2-CB 4.2Å; Y121-L142 HydrophobicContact CE2-CD1 3.53Å; Y121-L142 HydrophobicContact CE2-CG 3.84Å; Y121-L205 HydrophobicContact CD1-CD2 3.79Å; Y121-L205 HydrophobicContact CD2-CD2 3.92Å; Y121-L205 HydrophobicContact CE1-CD2 4.43Å; Y121-L205 HydrophobicContact CG-CD2 3.51Å; Y121-Y285 WeakPolarHBondContact OH-CB 3.37Å
122	I	96.3	Very high	94.4	Very high	18 Å²	18	36.1 Å²	36.1	9%	0.092	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	134.7	165.2	-63.1	179.4	0	0	0	108.2	I101 L104 I127 M137	I101-I122 HydrophobicContact CD1-CD1 3.7Å; L104-I122 HydrophobicContact CB-CD1 4.38Å; L104-I122 HydrophobicContact CD1-CD1 4.35Å; L104-I122 HydrophobicContact CD1-CG1 3.63Å; L104-I122 HydrophobicContact CD2-CD1 3.93Å; L104-I122 HydrophobicContact CD2-CG1 3.79Å; L104-I122 HydrophobicContact CG-CD1 4.45Å; L104-I122 HydrophobicContact CG-CG1 4.19Å; I122-I127 HydrophobicContact CG2-CB 4.2Å; I122-I127 HydrophobicContact CG2-CG2 4Å; I122-M137 HydrophobicContact CD1-CE 3.72Å; I122-M137 HydrophobicContact CG1-CE 3.7Å
123	V	96.3	Very high	94.4	Very high	8 Å²	8	36.8 Å²	36.8	5%	0.048	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	174	174	-61.9	0	0	0	0	110.8	D138 C140 L205 T208	V123-D138 HydrophobicContact CG2-CB 3.66Å; V123-D138 PolarHBondContact N-O 3.46Å; V123-C140 HydrophobicContact CG1-CB 4.01Å; V123-L205 HydrophobicContact CG1-CD1 4.44Å; V123-L205 HydrophobicContact CG1-CG 3.86Å; V123-T208 WeakPolarHBondContact CB-OG1 3.15Å
124	G	95.4	Very high	94.4	Very high	18 Å²	18	41.7 Å²	41.7	19%	0.186	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	67.4	-146.5	171.3	0	0	0	0	0	114.2	S126 I127 N128 T208	G124-S126 PolarHBondContact O-N 3.31Å; G124-I127 PolarHBondContact O-N 3.34Å; G124-I127 VanDerWaalsContact O-N 3.14Å; G124-N128 VanDerWaalsContact O-CB 3.28Å; G124-N128 WeakPolarHBondContact O-CB 3.39Å; G124-N128 PolarHBondContact O-N 3.31Å; G124-N128 PolarHBondContact O-OD1 3.29Å; G124-T208 PolarHBondContact N-OG1 3.22Å
125	S	96.1	Very high	94.4	Very high	20 Å²	20	41 Å²	41	14%	0.14	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-57.1	-26.8	-168.1	-55.1	0	0	0	0	113.5	I127 N128 G131	S125-I127 PolarHBondContact O-N 2.85Å; S125-N128 WeakPolarHBondContact CA-OD1 3.09Å; S125-G131 WeakPolarHBondContact O-CA 3.18Å; S125-G131 PolarHBondContact O-N 2.96Å
126	S	96.7	Very high	94.5	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.021	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-64.6	-27.1	-177.6	-65.4	0	0	0	0	113.8	Q92 Y97 K100 G124 D136	Q92-S126 PolarHBondContact NE2-O 3.1Å; Y97-S126 WeakPolarHBondContact CE2-O 3.49Å; K100-S126 WeakPolarHBondContact CD-OG 3.36Å; K100-S126 PolarHBondContact NZ-OG 3.15Å; G124-S126 PolarHBondContact O-N 3.31Å; S126-D136 PolarHBondContact OG-O 3.48Å; S126-D136 VanDerWaalsContact OG-O 3.09Å
127	I	96	Very high	94.9	Very high	40 Å²	40	34.4 Å²	34.4	21%	0.205	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.2	-6.7	-173.4	-159	176.2	0	0	0	114.1	I122 G124 S125 G129 T208 M289	I122-I127 HydrophobicContact CG2-CB 4.2Å; I122-I127 HydrophobicContact CG2-CG2 4Å; G124-I127 PolarHBondContact O-N 3.34Å; G124-I127 VanDerWaalsContact O-N 3.14Å; S125-I127 PolarHBondContact O-N 2.85Å; I127-G129 PolarHBondContact O-N 3.48Å; I127-T208 HydrophobicContact CG2-CG2 3.24Å; I127-M289 HydrophobicContact CB-CE 4.44Å; I127-M289 HydrophobicContact CD1-CB 4.32Å; I127-M289 HydrophobicContact CD1-CE 4.16Å; I127-M289 HydrophobicContact CD1-CG 4.09Å; I127-M289 HydrophobicContact CG1-CE 3.91Å; I127-M289 HydrophobicContact CG2-CE 3.98Å
128	N	96.5	Very high	95.4	Very high	7 Å²	7	29.4 Å²	29.4	4%	0.037	17%	0.167	C	C	.	.	S	Bend	trans	-76.7	0.8	175.9	73.8	1.9	0	0	0	115.1	G124 S125 F130 T208 L211 A212	G124-N128 VanDerWaalsContact O-CB 3.28Å; G124-N128 WeakPolarHBondContact O-CB 3.39Å; G124-N128 PolarHBondContact O-N 3.31Å; G124-N128 PolarHBondContact O-OD1 3.29Å; S125-N128 WeakPolarHBondContact CA-OD1 3.09Å; N128-F130 VanDerWaalsContact O-CD2 3.24Å; N128-F130 WeakPolarHBondContact O-CD2 3.37Å; N128-F130 WeakPolarHBondContact O-CE2 3.41Å; N128-F130 PolarHBondContact OD1-N 2.82Å; N128-T208 HydrophobicContact CB-CG2 4.15Å; N128-L211 HydrophobicContact CB-CB 3.94Å; N128-L211 CarbonylContact O-C 3.52Å; N128-A212 WeakPolarHBondContact O-CA 3.48Å; N128-A212 PolarHBondContact O-N 3.12Å
129	G	95.2	Very high	95.6	Very high	26 Å²	26	29.1 Å²	29.1	27%	0.268	16%	0.164	S	C	.	.	S	Bend	trans	91.8	-9.4	179.9	0	0	0	0	0	116.2	I127 R222	I127-G129 PolarHBondContact O-N 3.48Å; G129-R222 PolarHBondContact O-NE 2.91Å
130	F	97.1	Very high	95.7	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.018	16%	0.156	C	C	.	.			trans	-110.8	19.1	-175.5	-56.4	-81.8	0	0	0	113.8	N128 L211 A215 V221 L251	N128-F130 VanDerWaalsContact O-CD2 3.24Å; N128-F130 WeakPolarHBondContact O-CD2 3.37Å; N128-F130 WeakPolarHBondContact O-CE2 3.41Å; N128-F130 PolarHBondContact OD1-N 2.82Å; F130-L211 HydrophobicContact CE2-CB 4.28Å; F130-A215 HydrophobicContact CE2-CB 3.88Å; F130-A215 HydrophobicContact CZ-CB 3.93Å; F130-V221 HydrophobicContact CE1-CG1 3.86Å; F130-V221 HydrophobicContact CZ-CG1 3.71Å; F130-L251 HydrophobicContact CB-CD1 3.96Å; F130-L251 HydrophobicContact CB-CD2 4.22Å; F130-L251 HydrophobicContact CD1-CD1 4.44Å; F130-L251 HydrophobicContact CD1-CD2 3.46Å; F130-L251 VanDerWaalsContact CD1-CD2 3.46Å; F130-L251 HydrophobicContact CD2-CD1 3.57Å; F130-L251 HydrophobicContact CD2-CD2 4.02Å; F130-L251 HydrophobicContact CD2-CG 4.41Å; F130-L251 HydrophobicContact CE1-CD2 3.67Å; F130-L251 HydrophobicContact CE2-CD1 4.13Å; F130-L251 HydrophobicContact CE2-CD2 4.22Å; F130-L251 HydrophobicContact CG-CD1 3.73Å; F130-L251 HydrophobicContact CG-CD2 3.63Å; F130-L251 HydrophobicContact CG-CG 4.35Å; F130-L251 HydrophobicContact CZ-CD2 4.04Å
131	G	95	Very high	95.8	Very high	7 Å²	7	27.6 Å²	27.6	7%	0.072	15%	0.152	C	C	.	.			trans	-75.5	148.1	179.9	0	0	0	0	0	114.3	Q92 S125	Q92-G131 WeakPolarHBondContact CB-O 3.48Å; Q92-G131 PolarHBondContact N-O 2.99Å; S125-G131 WeakPolarHBondContact O-CA 3.18Å; S125-G131 PolarHBondContact O-N 2.96Å
132	S	94.3	Very high	95.7	Very high	12 Å²	12	25.4 Å²	25.4	8%	0.084	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-113.2	166.9	170.5	68.3	0	0	0	0	111.2	T90 Q134 S135	T90-S132 CarbonylContact O-C 3.59Å; T90-S132 WeakPolarHBondContact O-CA 3.49Å; T90-S132 VanDerWaalsContact O-CB 3.27Å; T90-S132 WeakPolarHBondContact O-CB 2.97Å; S132-Q134 PolarHBondContact O-N 2.83Å; S132-Q134 PolarHBondContact OG-N 2.99Å; S132-S135 PolarHBondContact N-OG 2.97Å; S132-S135 WeakPolarHBondContact O-CB 3.48Å; S132-S135 PolarHBondContact O-N 2.88Å; S132-S135 PolarHBondContact OG-N 2.78Å; S132-S135 PolarHBondContact OG-OG 3.2Å
133	N	93.3	Very high	95.5	Very high	59 Å²	59	26.4 Å²	26.4	32%	0.316	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.5	173.7	-79	-35.5	0	0	0	113.8	T90 K91 S93 K96	T90-N133 PolarHBondContact O-N 2.81Å; T90-N133 VanDerWaalsContact O-N 3.08Å; K91-N133 PolarHBondContact O-ND2 2.94Å; S93-N133 WeakPolarHBondContact CB-OD1 3.16Å; S93-N133 PolarHBondContact N-OD1 3.31Å; S93-N133 PolarHBondContact OG-OD1 3.31Å; K96-N133 VanDerWaalsContact CB-OD1 3.28Å; K96-N133 WeakPolarHBondContact CB-OD1 3.33Å; K96-N133 WeakPolarHBondContact CE-O 3.4Å; K96-N133 PolarHBondContact NZ-O 2.65Å
134	Q	92.3	Very high	95.1	Very high	176 Å²	176	28.4 Å²	28.4	82%	0.822	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-5.2	175.9	-64.9	176	-14.5	0	0	112.9	S132 D136	S132-Q134 PolarHBondContact O-N 2.83Å; S132-Q134 PolarHBondContact OG-N 2.99Å; Q134-D136 PolarHBondContact O-N 3.32Å
135	S	93.7	Very high	94.3	Very high	10 Å²	10	33.6 Å²	33.6	7%	0.07	20%	0.198	C	C	.	.			trans	-70.1	132.4	-178.5	-69.9	0	0	0	0	111.8	K100 S132	K100-S135 WeakPolarHBondContact CE-O 3.32Å; K100-S135 PolarHBondContact NZ-O 2.92Å; S132-S135 PolarHBondContact N-OG 2.97Å; S132-S135 WeakPolarHBondContact O-CB 3.48Å; S132-S135 PolarHBondContact O-N 2.88Å; S132-S135 PolarHBondContact OG-N 2.78Å; S132-S135 PolarHBondContact OG-OG 3.2Å
136	D	95.8	Very high	93.7	Very high	61 Å²	61	37.8 Å²	37.8	33%	0.326	21%	0.21	S	C	.	.			trans	-53.7	164.4	168.5	-61.1	4	0	0	0	112.1	K100 S126 Q134 D194	K100-D136 PolarHBondContact NZ-O 3.04Å; S126-D136 PolarHBondContact OG-O 3.48Å; S126-D136 VanDerWaalsContact OG-O 3.09Å; Q134-D136 PolarHBondContact O-N 3.32Å; D136-D194 CarbonylContact C-O 3.6Å; D136-D194 WeakPolarHBondContact CA-O 2.96Å
137	M	97.4	Very high	92.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	94.4	172.4	-174.5	176.6	170.6	0	0	109.8	K100 L103 L104 I122 M139 I193 D194 C195 D196	K100-M137 HydrophobicContact CB-CE 4.38Å; K100-M137 HydrophobicContact CB-CG 4.49Å; K100-M137 HydrophobicContact CB-SD 3.76Å; K100-M137 HydrophobicContact CD-CB 4.35Å; K100-M137 HydrophobicContact CD-CG 4.41Å; K100-M137 HydrophobicContact CG-CB 4.39Å; K100-M137 HydrophobicContact CG-CG 4.33Å; K100-M137 HydrophobicContact CG-SD 3.95Å; K100-M137 WeakPolarHBondContact O-CE 3.49Å; L103-M137 HydrophobicContact CB-SD 4.43Å; L103-M137 HydrophobicContact CD2-SD 4.01Å; L103-M137 HydrophobicContact CG-SD 4.37Å; L104-M137 HydrophobicContact CB-CE 3.61Å; L104-M137 HydrophobicContact CD1-CE 3.68Å; L104-M137 HydrophobicContact CG-CE 4.25Å; I122-M137 HydrophobicContact CD1-CE 3.72Å; I122-M137 HydrophobicContact CG1-CE 3.7Å; M137-M139 HydrophobicContact CE-CE 4.48Å; M137-M139 HydrophobicContact CE-CG 4.03Å; M137-M139 HydrophobicContact CE-SD 3.67Å; M137-M139 HydrophobicContact CG-CE 4.34Å; M137-M139 HydrophobicContact CG-CG 4.25Å; M137-M139 HydrophobicContact CG-SD 4.47Å; M137-M139 HydrophobicContact SD-SD 4.44Å; M137-I193 HydrophobicContact CB-CG2 3.62Å; M137-D194 PolarHBondContact N-O 2.84Å; M137-C195 WeakPolarHBondContact O-CA 3.48Å; M137-D196 PolarHBondContact O-N 3.49Å; M137-D196 VanDerWaalsContact O-N 3.09Å
138	D	97.4	Very high	91.8	Very high	43 Å²	43	42.9 Å²	42.9	23%	0.23	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	134.1	171.2	-53.4	-83.2	0	0	0	110.6	V123 D196	V123-D138 HydrophobicContact CG2-CB 3.66Å; V123-D138 PolarHBondContact N-O 3.46Å; D138-D196 CarbonylContact C-O 3.59Å; D138-D196 WeakPolarHBondContact CA-O 3.36Å
139	M	97.7	Very high	90.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	145.7	-179.6	-71.1	171.7	-78.2	0	0	111.6	L104 L107 L120 Y121 M137 F186 C195 D196 L197 N198	L104-M139 HydrophobicContact CD1-CG 4.17Å; L104-M139 HydrophobicContact CD1-SD 3.96Å; L107-M139 HydrophobicContact CD1-CE 3.69Å; L107-M139 HydrophobicContact CD1-SD 3.59Å; L107-M139 VanDerWaalsContact CD1-SD 3.59Å; L120-M139 HydrophobicContact CD1-CB 4.11Å; L120-M139 HydrophobicContact CD1-SD 4.35Å; L120-M139 HydrophobicContact CD2-SD 4.34Å; Y121-M139 CarbonylContact O-C 3.45Å; Y121-M139 WeakPolarHBondContact O-CA 3.2Å; M137-M139 HydrophobicContact CE-CE 4.48Å; M137-M139 HydrophobicContact CE-CG 4.03Å; M137-M139 HydrophobicContact CE-SD 3.67Å; M137-M139 HydrophobicContact CG-CE 4.34Å; M137-M139 HydrophobicContact CG-CG 4.25Å; M137-M139 HydrophobicContact CG-SD 4.47Å; M137-M139 HydrophobicContact SD-SD 4.44Å; M139-F186 HydrophobicContact CE-CE1 4.45Å; M139-F186 HydrophobicContact CE-CE2 4.46Å; M139-F186 HydrophobicContact CE-CZ 3.74Å; M139-C195 HydrophobicContact CE-CB 3.67Å; M139-D196 PolarHBondContact N-O 3.22Å; M139-L197 HydrophobicContact CB-CD1 3.56Å; M139-N198 PolarHBondContact O-N 3.21Å; M139-N198 VanDerWaalsContact O-N 3.08Å; M139-N198 PolarHBondContact O-ND2 3.05Å; M139-N198 VanDerWaalsContact O-ND2 3.08Å
140	C	96.5	Very high	89.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122	171.1	-174.9	0	0	0	0	109.6	Y121 V123 N198 L205	Y121-C140 PolarHBondContact N-O 2.84Å; Y121-C140 PolarHBondContact O-N 3.09Å; V123-C140 HydrophobicContact CG1-CB 4.01Å; C140-N198 PolarHBondContact SG-OD1 2.68Å; C140-N198 VanDerWaalsContact SG-OD1 3.32Å; C140-L205 HydrophobicContact CB-CD1 3.82Å
141	L	96.4	Very high	88.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	116	172	178.7	63.3	0	0	0	109.7	I111 F115 A118 L120 V143 L161 L197 N198 V199 N200	I111-L141 HydrophobicContact CD1-CD1 4.3Å; I111-L141 HydrophobicContact CG2-CD1 3.56Å; I111-L141 HydrophobicContact CG2-CD2 4.48Å; F115-L141 HydrophobicContact CD2-CD2 4.35Å; F115-L141 HydrophobicContact CE2-CD2 4.41Å; A118-L141 HydrophobicContact CB-CD1 3.71Å; L120-L141 HydrophobicContact CD1-CB 4.41Å; L120-L141 HydrophobicContact CD1-CD1 4.44Å; L141-V143 HydrophobicContact CD1-CG1 4.4Å; L141-V143 HydrophobicContact CD2-CG1 3.84Å; L141-V143 HydrophobicContact CG-CG1 3.74Å; L141-L161 HydrophobicContact CD2-CD2 3.7Å; L141-L197 HydrophobicContact CB-CD1 4.1Å; L141-N198 PolarHBondContact N-O 2.95Å; L141-V199 HydrophobicContact CB-CG2 4.14Å; L141-V199 HydrophobicContact CD2-CG2 4.11Å; L141-V199 HydrophobicContact CG-CG2 4.47Å; L141-V199 CarbonylContact O-C 3.5Å; L141-V199 VanDerWaalsContact O-CA 3.3Å; L141-V199 WeakPolarHBondContact O-CA 3.34Å; L141-N200 PolarHBondContact O-N 2.67Å; L141-N200 PolarHBondContact O-OD1 2.86Å
142	L	94.5	Very high	88	Confident	22 Å²	22	62.9 Å²	62.9	12%	0.115	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	109.2	172.7	-61.6	-172.3	0	0	0	109.7	A118 G119 Y121 N200 V202 L205 P284	A118-L142 CarbonylContact C-O 3.55Å; A118-L142 WeakPolarHBondContact CA-O 3.32Å; A118-L142 WeakPolarHBondContact CB-O 3.4Å; G119-L142 PolarHBondContact N-O 2.81Å; G119-L142 PolarHBondContact O-N 2.89Å; Y121-L142 HydrophobicContact CD2-CD1 3.98Å; Y121-L142 HydrophobicContact CD2-CG 3.99Å; Y121-L142 HydrophobicContact CE2-CB 4.2Å; Y121-L142 HydrophobicContact CE2-CD1 3.53Å; Y121-L142 HydrophobicContact CE2-CG 3.84Å; L142-N200 WeakPolarHBondContact CA-OD1 3.16Å; L142-V202 HydrophobicContact CD2-CG1 4.41Å; L142-V202 HydrophobicContact CD2-CG2 4.22Å; L142-L205 HydrophobicContact CD2-CD1 4.39Å; L142-P284 HydrophobicContact CD1-CB 3.53Å; L142-P284 HydrophobicContact CD1-CG 3.96Å
143	V	92.3	Very high	87.8	Confident	38 Å²	38	64.2 Å²	64.2	23%	0.23	33%	0.329	C	S	.	.			trans	-102.9	-16.2	179.2	-61.4	0	0	0	0	113.5	F115 A118 L141 L148 I157 V199 N200	F115-V143 HydrophobicContact CD2-CG1 4.39Å; F115-V143 HydrophobicContact CG-CG1 4.29Å; A118-V143 HydrophobicContact CB-CG1 4.11Å; L141-V143 HydrophobicContact CD1-CG1 4.4Å; L141-V143 HydrophobicContact CD2-CG1 3.84Å; L141-V143 HydrophobicContact CG-CG1 3.74Å; V143-L148 HydrophobicContact CG2-CD1 4.15Å; V143-I157 HydrophobicContact CG1-CG2 4.11Å; V143-I157 HydrophobicContact CG2-CD1 3.84Å; V143-V199 HydrophobicContact CG1-CG1 4.37Å; V143-V199 HydrophobicContact CG2-CG1 3.92Å; V143-N200 PolarHBondContact N-OD1 2.97Å
144	T	86.7	Confident	87.7	Confident	50 Å²	50	61.4 Å²	61.4	31%	0.307	31%	0.314	S	S	.	.			trans	-157.4	156.5	-178.4	-172.2	0	0	0	0	110.4	R146 L148 N200	T144-R146 HydrophobicContact CG2-CG 3.66Å; T144-L148 HydrophobicContact CG2-CD2 3.58Å; T144-L148 HydrophobicContact CG2-CG 4.05Å; T144-N200 WeakPolarHBondContact CG2-ND2 3.27Å; T144-N200 PolarHBondContact O-ND2 3.41Å
145	S	80.4	Confident	87.7	Confident	128 Å²	128	54 Å²	54	90%	0.895	28%	0.281	S	S	*	.	S	Bend	trans	-81.2	-15.8	175.7	54.1	0	0	0	0	113.8
146	R	82.9	Confident	87.7	Confident	107 Å²	107	60.1 Å²	60.1	40%	0.404	31%	0.306	S	S	.	.	S	Bend	trans	-80.4	156.3	176.5	69.5	174.4	177.6	94.7	-2.9	111.4	T144 L148 E153 N200	T144-R146 HydrophobicContact CG2-CG 3.66Å; R146-L148 PolarHBondContact O-N 2.97Å; R146-E153 IonicContact CZ-OE2 2.64Å; R146-E153 VanDerWaalsContact CZ-OE2 3.28Å; R146-E153 IonicContact NH1-OE1 3.14Å; R146-E153 PolarHBondContact NH1-OE1 3.15Å; R146-E153 VanDerWaalsContact NH1-OE1 3.13Å; R146-E153 IonicContact NH1-OE2 3.91Å; R146-E153 PolarHBondContact NH1-OE2 2.88Å; R146-E153 IonicContact NH2-OE2 2.85Å; R146-E153 PolarHBondContact NH2-OE2 3.09Å; R146-N200 PolarHBondContact O-ND2 3.4Å
147	D	75.1	Confident	87.6	Confident	136 Å²	136	58.2 Å²	58.2	73%	0.727	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-61.9	136.7	164.8	-67.5	-37.8	0	0	0	110.3
148	L	77.4	Confident	87.5	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-98	143.5	173.1	-66.5	-173.9	0	0	0	109.6	V143 T144 R146 Q150 E153 I157 V199 N200	V143-L148 HydrophobicContact CG2-CD1 4.15Å; T144-L148 HydrophobicContact CG2-CD2 3.58Å; T144-L148 HydrophobicContact CG2-CG 4.05Å; R146-L148 PolarHBondContact O-N 2.97Å; L148-Q150 VanDerWaalsContact C-N 3.25Å; L148-Q150 PolarHBondContact O-N 3.33Å; L148-E153 HydrophobicContact CB-CB 4.4Å; L148-E153 HydrophobicContact CD2-CB 4.43Å; L148-I157 HydrophobicContact CD1-CD1 3.65Å; L148-V199 HydrophobicContact CD1-CG1 3.7Å; L148-N200 HydrophobicContact CD1-CB 3.75Å; L148-N200 HydrophobicContact CG-CB 3.99Å
149	H	75.1	Confident	87.3	Confident	146 Å²	146	58 Å²	58	68%	0.676	30%	0.298	S	S	*	.			trans	-67.9	90.4	161.2	-69	-70.8	0	0	0	109.2	K151 N152 E153	H149-K151 VanDerWaalsContact C-N 3.26Å; H149-K151 PolarHBondContact O-N 2.84Å; H149-N152 PolarHBondContact O-N 3.08Å; H149-N152 VanDerWaalsContact O-N 3.12Å; H149-E153 HydrophobicContact CB-CG 4.2Å; H149-E153 WeakPolarHBondContact CB-OE1 3.36Å; H149-E153 IonicContact CD2-OE1 3.28Å; H149-E153 PolarHBondContact CD2-OE1 3.47Å; H149-E153 IonicContact CG-OE1 2.65Å; H149-E153 PolarHBondContact N-OE1 3.19Å; H149-E153 PolarHBondContact O-N 3.02Å
150	Q	71.1	Confident	87.2	Confident	44 Å²	44	64.1 Å²	64.1	21%	0.206	32%	0.321	C	S	.	.	I	π-helix	trans	-46.1	-44.5	-169	-73.3	-67.1	-20.8	0	0	113.4	L148 N152 A154 P182 V199 N200	L148-Q150 VanDerWaalsContact C-N 3.25Å; L148-Q150 PolarHBondContact O-N 3.33Å; Q150-N152 PolarHBondContact O-N 3.08Å; Q150-A154 WeakPolarHBondContact O-CB 3.41Å; Q150-A154 PolarHBondContact O-N 2.83Å; Q150-P182 WeakPolarHBondContact O-CD 3.45Å; Q150-P182 WeakPolarHBondContact O-CG 3.34Å; Q150-V199 PolarHBondContact NE2-O 3.2Å; Q150-V199 PolarHBondContact OE1-O 2.92Å; Q150-N200 PolarHBondContact NE2-O 3.08Å; Q150-N200 VanDerWaalsContact NE2-O 3.15Å
151	K	73.7	Confident	87.2	Confident	152 Å²	152	64.1 Å²	64.1	66%	0.661	32%	0.321	S	S	*	.	I	π-helix	trans	-65.2	-41.1	-175.3	-165.8	176.6	-179.7	-177.8	0	113.9	H149 T155	H149-K151 VanDerWaalsContact C-N 3.26Å; H149-K151 PolarHBondContact O-N 2.84Å; K151-T155 VanDerWaalsContact O-CB 3.24Å; K151-T155 WeakPolarHBondContact O-CB 3.38Å; K151-T155 PolarHBondContact O-OG1 3.43Å
152	N	84.1	Confident	87.2	Confident	122 Å²	122	64.6 Å²	64.6	65%	0.652	32%	0.323	S	S	*	.	I	π-helix	trans	-102.3	-51.1	-171.6	-66.5	-12	0	0	0	111.7	H149 Q150 F156	H149-N152 PolarHBondContact O-N 3.08Å; H149-N152 VanDerWaalsContact O-N 3.12Å; Q150-N152 PolarHBondContact O-N 3.08Å; N152-F156 WeakPolarHBondContact O-CB 3.32Å; N152-F156 PolarHBondContact O-N 3.31Å
153	E	90.2	Very high	87.2	Confident	40 Å²	40	69.9 Å²	69.9	19%	0.187	35%	0.347	C	S	.	.	I	π-helix	trans	-71	-46.3	-176.3	-63.4	-171.7	-94.4	0	0	111.5	R146 L148 H149 T155 F156 I157	R146-E153 IonicContact CZ-OE2 2.64Å; R146-E153 VanDerWaalsContact CZ-OE2 3.28Å; R146-E153 IonicContact NH1-OE1 3.14Å; R146-E153 PolarHBondContact NH1-OE1 3.15Å; R146-E153 VanDerWaalsContact NH1-OE1 3.13Å; R146-E153 IonicContact NH1-OE2 3.91Å; R146-E153 PolarHBondContact NH1-OE2 2.88Å; R146-E153 IonicContact NH2-OE2 2.85Å; R146-E153 PolarHBondContact NH2-OE2 3.09Å; L148-E153 HydrophobicContact CB-CB 4.4Å; L148-E153 HydrophobicContact CD2-CB 4.43Å; H149-E153 HydrophobicContact CB-CG 4.2Å; H149-E153 WeakPolarHBondContact CB-OE1 3.36Å; H149-E153 IonicContact CD2-OE1 3.28Å; H149-E153 PolarHBondContact CD2-OE1 3.47Å; H149-E153 IonicContact CG-OE1 2.65Å; H149-E153 PolarHBondContact N-OE1 3.19Å; H149-E153 PolarHBondContact O-N 3.02Å; E153-T155 VanDerWaalsContact C-N 3.35Å; E153-T155 PolarHBondContact O-N 2.84Å; E153-F156 PolarHBondContact O-N 3.38Å; E153-I157 WeakPolarHBondContact O-CD1 3.21Å; E153-I157 VanDerWaalsContact O-CG1 3.27Å; E153-I157 WeakPolarHBondContact O-CG1 3.44Å; E153-I157 PolarHBondContact O-N 3.46Å
154	A	90.9	Very high	87.4	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.348	C	S	.	.	I	π-helix	trans	-65.5	-40.5	178.8	0	0	0	0	0	111	Q150 F156 I157 L158 P182 V199	Q150-A154 WeakPolarHBondContact O-CB 3.41Å; Q150-A154 PolarHBondContact O-N 2.83Å; A154-F156 VanDerWaalsContact C-N 3.32Å; A154-F156 PolarHBondContact O-N 2.76Å; A154-I157 PolarHBondContact O-N 3.32Å; A154-L158 WeakPolarHBondContact O-CB 3.36Å; A154-L158 VanDerWaalsContact O-CG 3.3Å; A154-L158 WeakPolarHBondContact O-CG 3.23Å; A154-L158 PolarHBondContact O-N 2.92Å; A154-P182 HydrophobicContact CB-CG 4.44Å; A154-V199 HydrophobicContact CB-CB 4.21Å
155	T	92.5	Very high	87.8	Confident	21 Å²	21	67.3 Å²	67.3	13%	0.129	33%	0.333	C	S	.	.	H	α-helix	trans	-59.3	-41.6	174	-61.3	0	0	0	0	112	K151 E153 S159 L176 R178 P182	K151-T155 VanDerWaalsContact O-CB 3.24Å; K151-T155 WeakPolarHBondContact O-CB 3.38Å; K151-T155 PolarHBondContact O-OG1 3.43Å; E153-T155 VanDerWaalsContact C-N 3.35Å; E153-T155 PolarHBondContact O-N 2.84Å; T155-S159 VanDerWaalsContact O-CB 3.28Å; T155-S159 WeakPolarHBondContact O-CB 3.45Å; T155-S159 PolarHBondContact O-N 3.22Å; T155-S159 PolarHBondContact O-OG 3.02Å; T155-L176 HydrophobicContact CG2-CD2 4.43Å; T155-R178 HydrophobicContact CG2-CG 4.23Å; T155-P182 WeakPolarHBondContact OG1-CG 3.28Å
156	F	92.5	Very high	88.6	Confident	137 Å²	137	68.4 Å²	68.4	60%	0.601	32%	0.318	S	S	*	.	H	α-helix	trans	-64.3	-46.5	176.7	177.7	-97.9	0	0	0	111.8	N152 E153 A154 S159 R160	N152-F156 WeakPolarHBondContact O-CB 3.32Å; N152-F156 PolarHBondContact O-N 3.31Å; E153-F156 PolarHBondContact O-N 3.38Å; A154-F156 VanDerWaalsContact C-N 3.32Å; A154-F156 PolarHBondContact O-N 2.76Å; F156-S159 PolarHBondContact O-N 2.81Å; F156-R160 PolarHBondContact O-N 3.14Å
157	I	93.8	Very high	89.2	Confident	21 Å²	21	71.5 Å²	71.5	11%	0.108	33%	0.334	C	S	.	.	H	α-helix	trans	-61.6	-47.8	178.7	-67.6	163.1	0	0	0	110.8	F115 V143 L148 E153 A154 S159 R160 L161 V199	F115-I157 HydrophobicContact CE1-CG2 4.27Å; F115-I157 HydrophobicContact CE2-CG2 4.09Å; F115-I157 HydrophobicContact CZ-CG2 3.66Å; V143-I157 HydrophobicContact CG1-CG2 4.11Å; V143-I157 HydrophobicContact CG2-CD1 3.84Å; L148-I157 HydrophobicContact CD1-CD1 3.65Å; E153-I157 WeakPolarHBondContact O-CD1 3.21Å; E153-I157 VanDerWaalsContact O-CG1 3.27Å; E153-I157 WeakPolarHBondContact O-CG1 3.44Å; E153-I157 PolarHBondContact O-N 3.46Å; A154-I157 PolarHBondContact O-N 3.32Å; I157-S159 VanDerWaalsContact C-N 3.35Å; I157-S159 PolarHBondContact O-N 2.77Å; I157-R160 PolarHBondContact O-N 3.07Å; I157-L161 PolarHBondContact O-N 3.27Å; I157-V199 HydrophobicContact CD1-CG1 4.25Å; I157-V199 HydrophobicContact CG2-CG1 4.01Å; I157-V199 HydrophobicContact CG2-CG2 3.89Å
158	L	95.4	Very high	90.2	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-42.7	175.2	-73.5	178.6	0	0	0	111.5	A154 R160 L161 L162 L176 P182 I184 L197 V199	A154-L158 WeakPolarHBondContact O-CB 3.36Å; A154-L158 VanDerWaalsContact O-CG 3.3Å; A154-L158 WeakPolarHBondContact O-CG 3.23Å; A154-L158 PolarHBondContact O-N 2.92Å; L158-R160 VanDerWaalsContact C-N 3.3Å; L158-R160 PolarHBondContact O-N 3.48Å; L158-L161 PolarHBondContact O-N 3.04Å; L158-L162 VanDerWaalsContact O-CB 3.26Å; L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 PolarHBondContact O-N 3.27Å; L158-L176 HydrophobicContact CB-CD1 4Å; L158-L176 HydrophobicContact CD1-CD1 4.11Å; L158-P182 HydrophobicContact CD1-CB 3.7Å; L158-P182 WeakPolarHBondContact CD1-O 3.49Å; L158-I184 HydrophobicContact CB-CD1 3.85Å; L158-I184 HydrophobicContact CB-CG1 3.95Å; L158-I184 HydrophobicContact CD1-CG1 4.34Å; L158-I184 HydrophobicContact CD2-CD1 3.63Å; L158-I184 HydrophobicContact CD2-CG1 3.84Å; L158-I184 HydrophobicContact CG-CD1 4.29Å; L158-I184 HydrophobicContact CG-CG1 4.26Å; L158-I184 WeakPolarHBondContact O-CD1 3.41Å; L158-L197 HydrophobicContact CD2-CG 4.49Å; L158-V199 HydrophobicContact CD2-CG2 3.38Å; L158-V199 HydrophobicContact CG-CG2 3.68Å
159	S	95	Very high	91.1	Very high	40 Å²	40	76.3 Å²	76.3	28%	0.28	34%	0.343	S	S	.	.	H	α-helix	trans	-62.2	-38.5	178.3	-60.7	0	0	0	0	112	T155 F156 I157 L176	T155-S159 VanDerWaalsContact O-CB 3.28Å; T155-S159 WeakPolarHBondContact O-CB 3.45Å; T155-S159 PolarHBondContact O-N 3.22Å; T155-S159 PolarHBondContact O-OG 3.02Å; F156-S159 PolarHBondContact O-N 2.81Å; I157-S159 VanDerWaalsContact C-N 3.35Å; I157-S159 PolarHBondContact O-N 2.77Å; S159-L176 WeakPolarHBondContact OG-CD2 3.42Å
160	R	94.4	Very high	92.1	Very high	127 Å²	127	71.5 Å²	71.5	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-66.6	-46	174.1	-177.4	177.8	175.4	-169.7	-6	111.5	V114 F156 I157 L158 L162 Q163	V114-R160 HydrophobicContact CG1-CG 4.15Å; F156-R160 PolarHBondContact O-N 3.14Å; I157-R160 PolarHBondContact O-N 3.07Å; L158-R160 VanDerWaalsContact C-N 3.3Å; L158-R160 PolarHBondContact O-N 3.48Å; R160-L162 VanDerWaalsContact C-N 3.32Å; R160-L162 PolarHBondContact O-N 3.38Å; R160-Q163 PolarHBondContact O-N 3.38Å
161	L	95.8	Very high	93.4	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-40.5	178.2	-179.6	56.1	0	0	0	112.2	I111 V114 F115 L141 I157 L158 Q163 S164 L165 L197	I111-L161 HydrophobicContact CD1-CD2 4.32Å; I111-L161 HydrophobicContact CG1-CD1 3.61Å; I111-L161 HydrophobicContact CG1-CD2 4.04Å; I111-L161 HydrophobicContact CG1-CG 4.47Å; V114-L161 HydrophobicContact CG2-CD1 4.39Å; F115-L161 HydrophobicContact CE2-CB 4.21Å; L141-L161 HydrophobicContact CD2-CD2 3.7Å; I157-L161 PolarHBondContact O-N 3.27Å; L158-L161 PolarHBondContact O-N 3.04Å; L161-Q163 PolarHBondContact O-N 3.22Å; L161-S164 PolarHBondContact O-N 3.35Å; L161-L165 HydrophobicContact CD1-CD1 4.5Å; L161-L165 HydrophobicContact CD1-CD2 4.43Å; L161-L165 HydrophobicContact CD1-CG 4.13Å; L161-L165 HydrophobicContact CD2-CD1 4.27Å; L161-L165 HydrophobicContact CG-CD1 3.87Å; L161-L165 HydrophobicContact CG-CG 3.99Å; L161-L165 PolarHBondContact O-N 3.34Å; L161-L197 HydrophobicContact CD2-CD2 3.5Å; L161-L197 VanDerWaalsContact CD2-CD2 3.5Å
162	L	96.5	Very high	94.5	Very high	10 Å²	10	65.6 Å²	65.6	5%	0.052	30%	0.296	C	S	.	.	H	α-helix	trans	-56.7	-34	-179.8	-179.6	57.7	0	0	0	112.4	L158 R160 S164 L165 R166 F174 L176 I184	L158-L162 VanDerWaalsContact O-CB 3.26Å; L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 PolarHBondContact O-N 3.27Å; R160-L162 VanDerWaalsContact C-N 3.32Å; R160-L162 PolarHBondContact O-N 3.38Å; L162-S164 VanDerWaalsContact C-N 3.34Å; L162-S164 PolarHBondContact O-N 2.91Å; L162-L165 PolarHBondContact O-N 3.05Å; L162-R166 HydrophobicContact CD1-CG 4.18Å; L162-R166 WeakPolarHBondContact O-CB 3.33Å; L162-R166 VanDerWaalsContact O-CG 3.31Å; L162-R166 WeakPolarHBondContact O-CG 3.26Å; L162-R166 PolarHBondContact O-N 3.03Å; L162-F174 HydrophobicContact CD1-CB 3.91Å; L162-F174 HydrophobicContact CD1-CD1 3.49Å; L162-F174 VanDerWaalsContact CD1-CD1 3.49Å; L162-F174 HydrophobicContact CD1-CE1 4.24Å; L162-F174 HydrophobicContact CD1-CG 3.89Å; L162-L176 HydrophobicContact CD2-CB 4.29Å; L162-I184 HydrophobicContact CB-CD1 4.02Å; L162-I184 HydrophobicContact CD1-CG2 3.97Å
163	Q	95.3	Very high	95.1	Very high	133 Å²	133	64.9 Å²	64.9	62%	0.621	29%	0.292	S	S	*	.	H	α-helix	trans	-63.3	-39.5	175.7	-64.4	177.3	14.2	0	0	112.3	R160 L161	R160-Q163 PolarHBondContact O-N 3.38Å; L161-Q163 PolarHBondContact O-N 3.22Å
164	S	95.7	Very high	95.5	Very high	34 Å²	34	65 Å²	65	24%	0.238	29%	0.291	C	S	.	.	H	α-helix	trans	-73.7	-43.3	175.9	-64.3	0	0	0	0	111.6	V114 L161 L162 R166 K167	V114-S164 WeakPolarHBondContact CG2-OG 3.04Å; L161-S164 PolarHBondContact O-N 3.35Å; L162-S164 VanDerWaalsContact C-N 3.34Å; L162-S164 PolarHBondContact O-N 2.91Å; S164-R166 VanDerWaalsContact C-N 3.28Å; S164-R166 PolarHBondContact O-N 2.96Å; S164-K167 WeakPolarHBondContact O-CB 3.48Å; S164-K167 PolarHBondContact O-N 3.09Å
165	L	97	Very high	95.8	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.6	-36.9	178.3	-66	177.2	0	0	0	112.3	L107 V110 L161 L162 K167 C168 L171 F174 I184 F186 L197	L107-L165 HydrophobicContact CD2-CD2 3.81Å; V110-L165 HydrophobicContact CG1-CD2 4.12Å; L161-L165 HydrophobicContact CD1-CD1 4.5Å; L161-L165 HydrophobicContact CD1-CD2 4.43Å; L161-L165 HydrophobicContact CD1-CG 4.13Å; L161-L165 HydrophobicContact CD2-CD1 4.27Å; L161-L165 HydrophobicContact CG-CD1 3.87Å; L161-L165 HydrophobicContact CG-CG 3.99Å; L161-L165 PolarHBondContact O-N 3.34Å; L162-L165 PolarHBondContact O-N 3.05Å; L165-K167 PolarHBondContact O-N 3.05Å; L165-C168 VanDerWaalsContact O-CB 3.23Å; L165-C168 WeakPolarHBondContact O-CB 3.46Å; L165-C168 PolarHBondContact O-N 3.26Å; L165-L171 HydrophobicContact CB-CD1 4.27Å; L165-L171 HydrophobicContact CD2-CD1 3.98Å; L165-F174 HydrophobicContact CB-CE1 3.78Å; L165-F174 HydrophobicContact CB-CZ 4.24Å; L165-F174 WeakPolarHBondContact O-CZ 3.27Å; L165-I184 HydrophobicContact CD1-CD1 4.35Å; L165-F186 HydrophobicContact CD1-CE1 4.31Å; L165-L197 HydrophobicContact CD1-CD2 4.41Å
166	R	96.6	Very high	95.9	Very high	152 Å²	152	69.5 Å²	69.5	57%	0.574	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.7	176.3	-80.3	175.3	173	164.9	-2.7	114.3	L162 S164 C168 F174	L162-R166 HydrophobicContact CD1-CG 4.18Å; L162-R166 WeakPolarHBondContact O-CB 3.33Å; L162-R166 VanDerWaalsContact O-CG 3.31Å; L162-R166 WeakPolarHBondContact O-CG 3.26Å; L162-R166 PolarHBondContact O-N 3.03Å; S164-R166 VanDerWaalsContact C-N 3.28Å; S164-R166 PolarHBondContact O-N 2.96Å; R166-C168 VanDerWaalsContact C-N 3.31Å; R166-F174 HydrophobicContact CG-CD2 3.84Å; R166-F174 HydrophobicContact CG-CE2 3.94Å; R166-F174 HydrophobicContact CG-CG 4.15Å; R166-F174 HydrophobicContact CG-CZ 4.32Å
167	K	95.7	Very high	96	Very high	171 Å²	171	66 Å²	66	74%	0.743	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-15.6	174.9	-60.5	177.7	-177	-179.2	0	112.3	S164 L165 R169	S164-K167 WeakPolarHBondContact O-CB 3.48Å; S164-K167 PolarHBondContact O-N 3.09Å; L165-K167 PolarHBondContact O-N 3.05Å; K167-R169 PolarHBondContact O-N 3.47Å
168	C	96.1	Very high	95.8	Very high	17 Å²	17	73.9 Å²	73.9	12%	0.115	33%	0.333	C	S	.	.			trans	-79.1	108.5	-179.7	-60	0	0	0	0	110.7	V110 L165 R166 F170 L171	V110-C168 VanDerWaalsContact CG2-SG 3.53Å; L165-C168 VanDerWaalsContact O-CB 3.23Å; L165-C168 WeakPolarHBondContact O-CB 3.46Å; L165-C168 PolarHBondContact O-N 3.26Å; R166-C168 VanDerWaalsContact C-N 3.31Å; C168-F170 HydrophobicContact CB-CD1 3.89Å; C168-F170 HydrophobicContact CB-CE1 3.52Å; C168-F170 HydrophobicContact CB-CZ 3.95Å; C168-F170 PolarHBondContact O-N 3.04Å; C168-F170 VanDerWaalsContact O-N 3.08Å; C168-L171 HydrophobicContact CB-CB 4.33Å; C168-L171 HydrophobicContact CB-CD1 3.89Å; C168-L171 HydrophobicContact CB-CG 3.99Å; C168-L171 PolarHBondContact O-N 3.44Å
169	R	95.8	Very high	95.3	Very high	235 Å²	235	76.3 Å²	76.3	89%	0.887	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-19	-179.2	-72.5	-178.7	162.3	159.7	-4.2	115.1	K167 L171	K167-R169 PolarHBondContact O-N 3.47Å; R169-L171 VanDerWaalsContact C-N 3.32Å
170	F	96.4	Very high	94.6	Very high	45 Å²	45	80.3 Å²	80.3	20%	0.197	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-9	177.4	65.3	-89.5	0	0	0	113.2	L103 A106 C168 K189 Y190	L103-F170 HydrophobicContact CD1-CD2 4.23Å; L103-F170 HydrophobicContact CD1-CE2 3.86Å; A106-F170 HydrophobicContact CB-CE2 4.41Å; A106-F170 HydrophobicContact CB-CZ 4.16Å; C168-F170 HydrophobicContact CB-CD1 3.89Å; C168-F170 HydrophobicContact CB-CE1 3.52Å; C168-F170 HydrophobicContact CB-CZ 3.95Å; C168-F170 PolarHBondContact O-N 3.04Å; C168-F170 VanDerWaalsContact O-N 3.08Å; F170-K189 VanDerWaalsContact O-CB 3.29Å; F170-K189 WeakPolarHBondContact O-CB 3.45Å; F170-K189 PolarHBondContact O-N 3.3Å; F170-Y190 HydrophobicContact CB-CD2 3.76Å; F170-Y190 HydrophobicContact CB-CE2 3.53Å
171	L	97.7	Very high	94.3	Very high	11 Å²	11	76.3 Å²	76.3	6%	0.058	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.8	-178.6	-59.4	-178.3	0	0	0	111.4	L103 L107 L165 C168 R169 F174 F186 R187 D188	L103-L171 HydrophobicContact CD1-CD2 4.27Å; L107-L171 HydrophobicContact CD2-CD1 3.72Å; L107-L171 HydrophobicContact CD2-CD2 4.44Å; L165-L171 HydrophobicContact CB-CD1 4.27Å; L165-L171 HydrophobicContact CD2-CD1 3.98Å; C168-L171 HydrophobicContact CB-CB 4.33Å; C168-L171 HydrophobicContact CB-CD1 3.89Å; C168-L171 HydrophobicContact CB-CG 3.99Å; C168-L171 PolarHBondContact O-N 3.44Å; R169-L171 VanDerWaalsContact C-N 3.32Å; L171-F174 HydrophobicContact CB-CE1 4.14Å; L171-F174 HydrophobicContact CB-CE2 4.21Å; L171-F174 HydrophobicContact CB-CZ 3.44Å; L171-F174 VanDerWaalsContact CB-CZ 3.44Å; L171-F174 HydrophobicContact CD1-CE1 4.41Å; L171-F174 HydrophobicContact CD1-CZ 4.28Å; L171-F186 HydrophobicContact CD1-CD2 4.29Å; L171-F186 HydrophobicContact CD1-CE2 4.29Å; L171-F186 HydrophobicContact CD2-CD2 3.78Å; L171-F186 HydrophobicContact CD2-CE2 3.88Å; L171-F186 HydrophobicContact CG-CD2 4.48Å; L171-R187 WeakPolarHBondContact CA-O 3.4Å; L171-D188 HydrophobicContact CD2-CB 4.43Å
172	H	97.5	Very high	94.2	Very high	62 Å²	62	76.3 Å²	76.3	29%	0.287	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	-176.3	175.4	69.2	102.3	0	0	0	112.4	F174 R187	H172-F174 PolarHBondContact O-N 3.23Å; H172-R187 PolarHBondContact CD2-O 2.82Å; H172-R187 PolarHBondContact N-O 3.14Å; H172-R187 PolarHBondContact O-N 2.95Å
173	N	97.2	Very high	94.1	Very high	106 Å²	106	77.9 Å²	77.9	57%	0.567	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.4	43.9	177.7	-64.8	4.9	0	0	0	115	T175 R187	N173-T175 PolarHBondContact O-N 3.39Å; N173-R187 HydrophobicContact CB-CB 4.45Å
174	F	97.6	Very high	94.2	Very high	42 Å²	42	71.5 Å²	71.5	18%	0.184	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.7	-177.7	-64.1	-81.9	0	0	0	113.6	L162 L165 R166 L171 H172 I184 K185 F186	L162-F174 HydrophobicContact CD1-CB 3.91Å; L162-F174 HydrophobicContact CD1-CD1 3.49Å; L162-F174 VanDerWaalsContact CD1-CD1 3.49Å; L162-F174 HydrophobicContact CD1-CE1 4.24Å; L162-F174 HydrophobicContact CD1-CG 3.89Å; L165-F174 HydrophobicContact CB-CE1 3.78Å; L165-F174 HydrophobicContact CB-CZ 4.24Å; L165-F174 WeakPolarHBondContact O-CZ 3.27Å; R166-F174 HydrophobicContact CG-CD2 3.84Å; R166-F174 HydrophobicContact CG-CE2 3.94Å; R166-F174 HydrophobicContact CG-CG 4.15Å; R166-F174 HydrophobicContact CG-CZ 4.32Å; L171-F174 HydrophobicContact CB-CE1 4.14Å; L171-F174 HydrophobicContact CB-CE2 4.21Å; L171-F174 HydrophobicContact CB-CZ 3.44Å; L171-F174 VanDerWaalsContact CB-CZ 3.44Å; L171-F174 HydrophobicContact CD1-CE1 4.41Å; L171-F174 HydrophobicContact CD1-CZ 4.28Å; H172-F174 PolarHBondContact O-N 3.23Å; F174-I184 HydrophobicContact CD1-CG2 4.46Å; F174-K185 CarbonylContact C-O 3.59Å; F174-K185 VanDerWaalsContact CA-O 3.28Å; F174-K185 WeakPolarHBondContact CA-O 3.44Å; F174-F186 HydrophobicContact CD1-CB 3.55Å; F174-F186 HydrophobicContact CD1-CG 4.35Å; F174-F186 HydrophobicContact CE1-CB 3.66Å; F174-F186 HydrophobicContact CE1-CG 4.15Å; F174-F186 HydrophobicContact CG-CB 4.34Å
175	T	97	Very high	94.3	Very high	78 Å²	78	72.3 Å²	72.3	48%	0.479	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	129.9	170.7	-56.4	0	0	0	0	110.4	N173 I177 I184 K185	N173-T175 PolarHBondContact O-N 3.39Å; T175-I177 HydrophobicContact CG2-CG1 4.07Å; T175-I184 CarbonylContact O-C 3.53Å; T175-I184 WeakPolarHBondContact O-CA 3.29Å; T175-K185 PolarHBondContact N-O 3.1Å; T175-K185 PolarHBondContact O-N 3.04Å
176	L	95.9	Very high	94.4	Very high	39 Å²	39	72.5 Å²	72.5	20%	0.204	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	109.3	171.5	177	64.2	0	0	0	109.6	T155 L158 S159 L162 R178 I184	T155-L176 HydrophobicContact CG2-CD2 4.43Å; L158-L176 HydrophobicContact CB-CD1 4Å; L158-L176 HydrophobicContact CD1-CD1 4.11Å; S159-L176 WeakPolarHBondContact OG-CD2 3.42Å; L162-L176 HydrophobicContact CD2-CB 4.29Å; L176-R178 HydrophobicContact CG-CG 4.44Å; L176-I184 HydrophobicContact CD1-CG1 3.86Å
177	I	93.7	Very high	94.5	Very high	62 Å²	62	69.5 Å²	69.5	32%	0.318	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	117.8	178.1	-57.4	177.7	0	0	0	108.9	T175 A179 P182 I183 K185	T175-I177 HydrophobicContact CG2-CG1 4.07Å; I177-A179 HydrophobicContact CG2-CB 4.15Å; I177-A179 PolarHBondContact O-N 3.31Å; I177-P182 VanDerWaalsContact O-CA 3.29Å; I177-P182 WeakPolarHBondContact O-CA 3.41Å; I177-I183 PolarHBondContact N-O 3.3Å; I177-I183 PolarHBondContact O-N 2.91Å; I177-I183 VanDerWaalsContact O-N 3.09Å; I177-K185 HydrophobicContact CD1-CD 3.67Å; I177-K185 VanDerWaalsContact CD1-CE 3.44Å; I177-K185 HydrophobicContact CD1-CG 3.93Å
178	R	89.6	Confident	94.5	Very high	188 Å²	188	61.9 Å²	61.9	71%	0.709	29%	0.289	S	S	*	.			trans	-94	63.8	-179.2	-62.7	-177.8	-179.6	132.7	-2.5	111.7	T155 L176	T155-R178 HydrophobicContact CG2-CG 4.23Å; L176-R178 HydrophobicContact CG-CG 4.44Å
179	A	84.5	Confident	94.5	Very high	50 Å²	50	67.5 Å²	67.5	41%	0.413	31%	0.311	S	S	.	.	S	Bend	trans	-90.9	-170.1	177	0	0	0	0	0	112.3	I177 V181	I177-A179 HydrophobicContact CG2-CB 4.15Å; I177-A179 PolarHBondContact O-N 3.31Å; A179-V181 PolarHBondContact O-N 3.34Å
180	K	80.7	Confident	94.4	Very high	125 Å²	125	64.7 Å²	64.7	54%	0.543	30%	0.302	S	S	.	.	S	Bend	trans	-55.6	-40.1	172.8	179.2	176	176.2	174.9	0	111.4	E349	K180-E349 IonicContact NZ-OE1 3.62Å; K180-E349 PolarHBondContact NZ-OE1 2.85Å
181	V	88.4	Confident	94.2	Very high	43 Å²	43	63.5 Å²	63.5	26%	0.261	30%	0.301	S	S	.	.	S	Bend	trans	-112.3	106.4	166.4	-179	0	0	0	0	106.5	A179 N198 N201	A179-V181 PolarHBondContact O-N 3.34Å; V181-N198 HydrophobicContact CG1-CB 4.05Å; V181-N201 HydrophobicContact CG1-CB 4.12Å
182	P	92.9	Very high	94	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.311	C	S	.	.			trans	-64	142	177.3	-25.6	37	0	0	0	112.2	Q150 A154 T155 L158 I177	Q150-P182 WeakPolarHBondContact O-CD 3.45Å; Q150-P182 WeakPolarHBondContact O-CG 3.34Å; A154-P182 HydrophobicContact CB-CG 4.44Å; T155-P182 WeakPolarHBondContact OG1-CG 3.28Å; L158-P182 HydrophobicContact CD1-CB 3.7Å; L158-P182 WeakPolarHBondContact CD1-O 3.49Å; I177-P182 VanDerWaalsContact O-CA 3.29Å; I177-P182 WeakPolarHBondContact O-CA 3.41Å
183	I	95.5	Very high	94	Very high	42 Å²	42	61.4 Å²	61.4	22%	0.215	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	135.7	-177.6	-61.7	172.3	0	0	0	109.4	I177 K185 D196 L197 N198	I177-I183 PolarHBondContact N-O 3.3Å; I177-I183 PolarHBondContact O-N 2.91Å; I177-I183 VanDerWaalsContact O-N 3.09Å; I183-K185 HydrophobicContact CG2-CG 4.27Å; I183-D196 HydrophobicContact CG2-CB 3.88Å; I183-L197 CarbonylContact C-O 3.58Å; I183-L197 WeakPolarHBondContact CA-O 3.33Å; I183-N198 HydrophobicContact CG1-CB 4.3Å
184	I	97.3	Very high	94	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122.1	160.6	-58	167.4	0	0	0	107.7	L158 L162 L165 F174 T175 L176 F186 L197	L158-I184 HydrophobicContact CB-CD1 3.85Å; L158-I184 HydrophobicContact CB-CG1 3.95Å; L158-I184 HydrophobicContact CD1-CG1 4.34Å; L158-I184 HydrophobicContact CD2-CD1 3.63Å; L158-I184 HydrophobicContact CD2-CG1 3.84Å; L158-I184 HydrophobicContact CG-CD1 4.29Å; L158-I184 HydrophobicContact CG-CG1 4.26Å; L158-I184 WeakPolarHBondContact O-CD1 3.41Å; L162-I184 HydrophobicContact CB-CD1 4.02Å; L162-I184 HydrophobicContact CD1-CG2 3.97Å; L165-I184 HydrophobicContact CD1-CD1 4.35Å; F174-I184 HydrophobicContact CD1-CG2 4.46Å; T175-I184 CarbonylContact O-C 3.53Å; T175-I184 WeakPolarHBondContact O-CA 3.29Å; L176-I184 HydrophobicContact CD1-CG1 3.86Å; I184-F186 HydrophobicContact CG2-CD1 3.87Å; I184-L197 PolarHBondContact N-O 2.87Å; I184-L197 PolarHBondContact O-N 3.06Å
185	K	98	Very high	94	Very high	51 Å²	51	57.3 Å²	57.3	22%	0.222	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	138.7	165.2	-56.9	-162.9	163.2	-95.7	0	110	F174 T175 I177 I183 C195 D196	F174-K185 CarbonylContact C-O 3.59Å; F174-K185 VanDerWaalsContact CA-O 3.28Å; F174-K185 WeakPolarHBondContact CA-O 3.44Å; T175-K185 PolarHBondContact N-O 3.1Å; T175-K185 PolarHBondContact O-N 3.04Å; I177-K185 HydrophobicContact CD1-CD 3.67Å; I177-K185 VanDerWaalsContact CD1-CE 3.44Å; I177-K185 HydrophobicContact CD1-CG 3.93Å; I183-K185 HydrophobicContact CG2-CG 4.27Å; K185-C195 VanDerWaalsContact CA-O 3.29Å; K185-C195 WeakPolarHBondContact CA-O 3.45Å; K185-D196 WeakPolarHBondContact CG-OD1 3.24Å; K185-D196 IonicContact NZ-OD1 3.13Å; K185-D196 PolarHBondContact NZ-OD1 2.62Å; K185-D196 IonicContact NZ-OD2 3.65Å; K185-D196 PolarHBondContact NZ-OD2 3.09Å
186	F	98.2	Very high	94.1	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	168.7	172.3	58.5	-90.2	0	0	0	110	L107 M139 L165 L171 F174 I184 C195 L197	L107-F186 HydrophobicContact CD1-CE2 3.98Å; L107-F186 HydrophobicContact CD1-CZ 3.8Å; L107-F186 HydrophobicContact CD2-CE2 4.01Å; L107-F186 HydrophobicContact CD2-CZ 3.99Å; M139-F186 HydrophobicContact CE-CE1 4.45Å; M139-F186 HydrophobicContact CE-CE2 4.46Å; M139-F186 HydrophobicContact CE-CZ 3.74Å; L165-F186 HydrophobicContact CD1-CE1 4.31Å; L171-F186 HydrophobicContact CD1-CD2 4.29Å; L171-F186 HydrophobicContact CD1-CE2 4.29Å; L171-F186 HydrophobicContact CD2-CD2 3.78Å; L171-F186 HydrophobicContact CD2-CE2 3.88Å; L171-F186 HydrophobicContact CG-CD2 4.48Å; F174-F186 HydrophobicContact CD1-CB 3.55Å; F174-F186 HydrophobicContact CD1-CG 4.35Å; F174-F186 HydrophobicContact CE1-CB 3.66Å; F174-F186 HydrophobicContact CE1-CG 4.15Å; F174-F186 HydrophobicContact CG-CB 4.34Å; I184-F186 HydrophobicContact CG2-CD1 3.87Å; F186-C195 HydrophobicContact CD1-CB 4.25Å; F186-C195 HydrophobicContact CD2-CB 3.71Å; F186-C195 HydrophobicContact CE1-CB 3.98Å; F186-C195 HydrophobicContact CE2-CB 3.39Å; F186-C195 HydrophobicContact CG-CB 4.15Å; F186-C195 HydrophobicContact CZ-CB 3.56Å; F186-C195 PolarHBondContact N-O 3.47Å; F186-C195 WeakPolarHBondContact O-CB 3.39Å; F186-C195 PolarHBondContact O-N 3.03Å; F186-L197 HydrophobicContact CE1-CB 3.99Å; F186-L197 HydrophobicContact CE1-CD2 4.46Å
187	R	98.1	Very high	94.1	Very high	89 Å²	89	52.8 Å²	52.8	34%	0.336	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.1	179.2	-167.2	173.5	-169	-177.3	-1.1	111.3	L171 H172 N173 I193 D194	L171-R187 WeakPolarHBondContact CA-O 3.4Å; H172-R187 PolarHBondContact CD2-O 2.82Å; H172-R187 PolarHBondContact N-O 3.14Å; H172-R187 PolarHBondContact O-N 2.95Å; N173-R187 HydrophobicContact CB-CB 4.45Å; R187-I193 WeakPolarHBondContact CA-O 3.22Å; R187-D194 VanDerWaalsContact CD-OD1 3.25Å; R187-D194 WeakPolarHBondContact CD-OD1 3.28Å; R187-D194 WeakPolarHBondContact CG-OD1 3.34Å; R187-D194 IonicContact NE-OD1 3.73Å; R187-D194 IonicContact NE-OD2 2.66Å
188	D	97.2	Very high	94.3	Very high	11 Å²	11	50.5 Å²	50.5	6%	0.059	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	123	167	175.5	52	0	0	0	110.5	L103 L171 Y190 A191 G192 I193	L103-D188 HydrophobicContact CD1-CB 3.89Å; L103-D188 HydrophobicContact CD2-CB 3.57Å; L103-D188 HydrophobicContact CG-CB 4.37Å; L171-D188 HydrophobicContact CD2-CB 4.43Å; D188-Y190 VanDerWaalsContact C-N 3.34Å; D188-Y190 PolarHBondContact O-N 2.95Å; D188-A191 WeakPolarHBondContact OD2-CA 3.32Å; D188-A191 WeakPolarHBondContact OD2-CB 3.3Å; D188-A191 PolarHBondContact OD2-N 3.07Å; D188-G192 VanDerWaalsContact O-CA 3.3Å; D188-G192 WeakPolarHBondContact O-CA 3.41Å; D188-G192 PolarHBondContact O-N 3.01Å; D188-I193 PolarHBondContact N-O 3.45Å
189	K	95.9	Very high	94.5	Very high	134 Å²	134	41.6 Å²	41.6	58%	0.583	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-37.5	-175.4	-174.5	177.7	178.5	180	0	112.2	F170	F170-K189 VanDerWaalsContact O-CB 3.29Å; F170-K189 WeakPolarHBondContact O-CB 3.45Å; F170-K189 PolarHBondContact O-N 3.3Å
190	Y	92.9	Very high	94.9	Very high	177 Å²	177	39.7 Å²	39.7	69%	0.694	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-41.3	-169.2	-61.4	-59.9	0	0	0	113.1	F170 D188	F170-Y190 HydrophobicContact CB-CD2 3.76Å; F170-Y190 HydrophobicContact CB-CE2 3.53Å; D188-Y190 VanDerWaalsContact C-N 3.34Å; D188-Y190 PolarHBondContact O-N 2.95Å
191	A	92	Very high	95.4	Very high	20 Å²	20	35.9 Å²	35.9	17%	0.165	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-12.4	177.1	0	0	0	0	0	113.1	K99 D188 I193	K99-A191 HydrophobicContact CB-CB 4.04Å; K99-A191 HydrophobicContact CD-CB 4.09Å; K99-A191 HydrophobicContact CG-CB 4.46Å; D188-A191 WeakPolarHBondContact OD2-CA 3.32Å; D188-A191 WeakPolarHBondContact OD2-CB 3.3Å; D188-A191 PolarHBondContact OD2-N 3.07Å; A191-I193 VanDerWaalsContact C-N 3.3Å; A191-I193 HydrophobicContact CB-CB 4.49Å; A191-I193 HydrophobicContact CB-CD1 3.45Å; A191-I193 VanDerWaalsContact CB-CD1 3.45Å; A191-I193 HydrophobicContact CB-CG1 3.7Å; A191-I193 PolarHBondContact O-N 3.14Å
192	G	94.9	Very high	95.6	Very high	27 Å²	27	34.8 Å²	34.8	28%	0.278	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	38.6	-176.7	0	0	0	0	0	112	D188	D188-G192 VanDerWaalsContact O-CA 3.3Å; D188-G192 WeakPolarHBondContact O-CA 3.41Å; D188-G192 PolarHBondContact O-N 3.01Å
193	I	96.4	Very high	95.6	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.7	-176.1	-62.9	169.6	0	0	0	109	K99 K100 L103 M137 R187 D188 A191	K99-I193 HydrophobicContact CB-CD1 4.01Å; K100-I193 HydrophobicContact CG-CD1 3.75Å; L103-I193 HydrophobicContact CD2-CB 4.29Å; L103-I193 HydrophobicContact CD2-CG2 4.35Å; M137-I193 HydrophobicContact CB-CG2 3.62Å; R187-I193 WeakPolarHBondContact CA-O 3.22Å; D188-I193 PolarHBondContact N-O 3.45Å; A191-I193 VanDerWaalsContact C-N 3.3Å; A191-I193 HydrophobicContact CB-CB 4.49Å; A191-I193 HydrophobicContact CB-CD1 3.45Å; A191-I193 VanDerWaalsContact CB-CD1 3.45Å; A191-I193 HydrophobicContact CB-CG1 3.7Å; A191-I193 PolarHBondContact O-N 3.14Å
194	D	97.5	Very high	95.6	Very high	61 Å²	61	35.8 Å²	35.8	33%	0.326	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	137.2	167.6	-63.1	-68.6	0	0	0	109.8	D136 M137 R187	D136-D194 CarbonylContact C-O 3.6Å; D136-D194 WeakPolarHBondContact CA-O 2.96Å; M137-D194 PolarHBondContact N-O 2.84Å; R187-D194 VanDerWaalsContact CD-OD1 3.25Å; R187-D194 WeakPolarHBondContact CD-OD1 3.28Å; R187-D194 WeakPolarHBondContact CG-OD1 3.34Å; R187-D194 IonicContact NE-OD1 3.73Å; R187-D194 IonicContact NE-OD2 2.66Å
195	C	98.1	Very high	95.4	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.1	-169.7	-62.8	0	0	0	0	111	L103 M137 M139 K185 F186	L103-C195 VanDerWaalsContact CD2-SG 3.55Å; M137-C195 WeakPolarHBondContact O-CA 3.48Å; M139-C195 HydrophobicContact CE-CB 3.67Å; K185-C195 VanDerWaalsContact CA-O 3.29Å; K185-C195 WeakPolarHBondContact CA-O 3.45Å; F186-C195 HydrophobicContact CD1-CB 4.25Å; F186-C195 HydrophobicContact CD2-CB 3.71Å; F186-C195 HydrophobicContact CE1-CB 3.98Å; F186-C195 HydrophobicContact CE2-CB 3.39Å; F186-C195 HydrophobicContact CG-CB 4.15Å; F186-C195 HydrophobicContact CZ-CB 3.56Å; F186-C195 PolarHBondContact N-O 3.47Å; F186-C195 WeakPolarHBondContact O-CB 3.39Å; F186-C195 PolarHBondContact O-N 3.03Å
196	D	97.6	Very high	95.4	Very high	21 Å²	21	34.3 Å²	34.3	11%	0.112	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	115.7	175.1	-80	6.8	0	0	0	109	M137 D138 M139 I183 K185	M137-D196 PolarHBondContact O-N 3.49Å; M137-D196 VanDerWaalsContact O-N 3.09Å; D138-D196 CarbonylContact C-O 3.59Å; D138-D196 WeakPolarHBondContact CA-O 3.36Å; M139-D196 PolarHBondContact N-O 3.22Å; I183-D196 HydrophobicContact CG2-CB 3.88Å; K185-D196 WeakPolarHBondContact CG-OD1 3.24Å; K185-D196 IonicContact NZ-OD1 3.13Å; K185-D196 PolarHBondContact NZ-OD1 2.62Å; K185-D196 IonicContact NZ-OD2 3.65Å; K185-D196 PolarHBondContact NZ-OD2 3.09Å
197	L	97.8	Very high	95.3	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.5	-179	-178.3	65.1	0	0	0	111.5	L120 M139 L141 L158 L161 L165 I183 I184 F186	L120-L197 HydrophobicContact CD1-CD1 3.68Å; M139-L197 HydrophobicContact CB-CD1 3.56Å; L141-L197 HydrophobicContact CB-CD1 4.1Å; L158-L197 HydrophobicContact CD2-CG 4.49Å; L161-L197 HydrophobicContact CD2-CD2 3.5Å; L161-L197 VanDerWaalsContact CD2-CD2 3.5Å; L165-L197 HydrophobicContact CD1-CD2 4.41Å; I183-L197 CarbonylContact C-O 3.58Å; I183-L197 WeakPolarHBondContact CA-O 3.33Å; I184-L197 PolarHBondContact N-O 2.87Å; I184-L197 PolarHBondContact O-N 3.06Å; F186-L197 HydrophobicContact CE1-CB 3.99Å; F186-L197 HydrophobicContact CE1-CD2 4.46Å
198	N	96	Very high	95.2	Very high	14 Å²	14	30.9 Å²	30.9	8%	0.075	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	170.5	170.3	64.4	70.1	0	0	0	111.1	M139 C140 L141 V181 I183 N201	M139-N198 PolarHBondContact O-N 3.21Å; M139-N198 VanDerWaalsContact O-N 3.08Å; M139-N198 PolarHBondContact O-ND2 3.05Å; M139-N198 VanDerWaalsContact O-ND2 3.08Å; C140-N198 PolarHBondContact SG-OD1 2.68Å; C140-N198 VanDerWaalsContact SG-OD1 3.32Å; L141-N198 PolarHBondContact N-O 2.95Å; V181-N198 HydrophobicContact CG1-CB 4.05Å; I183-N198 HydrophobicContact CG1-CB 4.3Å; N198-N201 HydrophobicContact CB-CB 4.34Å; N198-N201 WeakPolarHBondContact OD1-CB 3.47Å
199	V	95.1	Very high	95.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.5	178.4	175.2	0	0	0	0	110	L141 V143 L148 Q150 A154 I157 L158 N201	L141-V199 HydrophobicContact CB-CG2 4.14Å; L141-V199 HydrophobicContact CD2-CG2 4.11Å; L141-V199 HydrophobicContact CG-CG2 4.47Å; L141-V199 CarbonylContact O-C 3.5Å; L141-V199 VanDerWaalsContact O-CA 3.3Å; L141-V199 WeakPolarHBondContact O-CA 3.34Å; V143-V199 HydrophobicContact CG1-CG1 4.37Å; V143-V199 HydrophobicContact CG2-CG1 3.92Å; L148-V199 HydrophobicContact CD1-CG1 3.7Å; Q150-V199 PolarHBondContact NE2-O 3.2Å; Q150-V199 PolarHBondContact OE1-O 2.92Å; A154-V199 HydrophobicContact CB-CB 4.21Å; I157-V199 HydrophobicContact CD1-CG1 4.25Å; I157-V199 HydrophobicContact CG2-CG1 4.01Å; I157-V199 HydrophobicContact CG2-CG2 3.89Å; L158-V199 HydrophobicContact CD2-CG2 3.38Å; L158-V199 HydrophobicContact CG-CG2 3.68Å; V199-N201 PolarHBondContact O-N 2.91Å
200	N	92.8	Very high	95.3	Very high	10 Å²	10	24.4 Å²	24.4	5%	0.053	13%	0.131	C	C	.	.	S	Bend	trans	50.3	27.2	176.5	-79.4	45.4	0	0	0	113.9	L141 L142 V143 T144 R146 L148 Q150 V202	L141-N200 PolarHBondContact O-N 2.67Å; L141-N200 PolarHBondContact O-OD1 2.86Å; L142-N200 WeakPolarHBondContact CA-OD1 3.16Å; V143-N200 PolarHBondContact N-OD1 2.97Å; T144-N200 WeakPolarHBondContact CG2-ND2 3.27Å; T144-N200 PolarHBondContact O-ND2 3.41Å; R146-N200 PolarHBondContact O-ND2 3.4Å; L148-N200 HydrophobicContact CD1-CB 3.75Å; L148-N200 HydrophobicContact CG-CB 3.99Å; Q150-N200 PolarHBondContact NE2-O 3.08Å; Q150-N200 VanDerWaalsContact NE2-O 3.15Å; N200-V202 WeakPolarHBondContact O-CG2 3.36Å; N200-V202 PolarHBondContact O-N 2.98Å
201	N	91.8	Very high	95.5	Very high	45 Å²	45	16.2 Å²	16.2	24%	0.241	10%	0.099	C	C	.	.			trans	-82.8	68.4	169.9	-173.5	27.7	0	0	0	109.4	V181 N198 V199 I203 G204	V181-N201 HydrophobicContact CG1-CB 4.12Å; N198-N201 HydrophobicContact CB-CB 4.34Å; N198-N201 WeakPolarHBondContact OD1-CB 3.47Å; V199-N201 PolarHBondContact O-N 2.91Å; N201-I203 VanDerWaalsContact C-N 3.25Å; N201-I203 PolarHBondContact O-N 2.96Å; N201-G204 PolarHBondContact O-N 3.4Å
202	V	92.5	Very high	95.8	Very high	20 Å²	20	15.5 Å²	15.5	12%	0.121	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-32.5	-165.6	-151.2	0	0	0	0	112.5	L142 N200 G204 L205 Y206 P284	L142-V202 HydrophobicContact CD2-CG1 4.41Å; L142-V202 HydrophobicContact CD2-CG2 4.22Å; N200-V202 WeakPolarHBondContact O-CG2 3.36Å; N200-V202 PolarHBondContact O-N 2.98Å; V202-G204 PolarHBondContact O-N 2.98Å; V202-G204 VanDerWaalsContact O-N 3.09Å; V202-L205 HydrophobicContact CG1-CD1 4.15Å; V202-L205 WeakPolarHBondContact O-CB 3.19Å; V202-L205 WeakPolarHBondContact O-CD1 3.17Å; V202-L205 PolarHBondContact O-N 2.66Å; V202-Y206 HydrophobicContact CB-CE2 4.23Å; V202-Y206 HydrophobicContact CG1-CD2 4.41Å; V202-Y206 HydrophobicContact CG1-CE2 3.63Å; V202-Y206 VanDerWaalsContact O-CD2 3.22Å; V202-Y206 WeakPolarHBondContact O-CD2 3.49Å; V202-P284 HydrophobicContact CG1-CB 3.95Å; V202-P284 HydrophobicContact CG1-CG 3.15Å
203	I	93	Very high	95.9	Very high	47 Å²	47	14.3 Å²	14.3	24%	0.241	8%	0.081	C	C	.	.	H	α-helix	trans	-50.5	-35.9	173.9	-62.4	169.8	0	0	0	111.7	N201 L205 Y206 N207 Y280	N201-I203 VanDerWaalsContact C-N 3.25Å; N201-I203 PolarHBondContact O-N 2.96Å; I203-L205 VanDerWaalsContact C-N 3.27Å; I203-L205 PolarHBondContact O-N 3.13Å; I203-Y206 PolarHBondContact O-N 2.9Å; I203-N207 WeakPolarHBondContact CG2-ND2 3.45Å; I203-N207 WeakPolarHBondContact O-CB 3.1Å; I203-N207 PolarHBondContact O-N 3.25Å; I203-N207 PolarHBondContact O-ND2 3.48Å; I203-Y280 HydrophobicContact CG1-CE2 3.81Å; I203-Y280 WeakPolarHBondContact CG1-OH 3.44Å
204	G	94	Very high	95.9	Very high	16 Å²	16	14.3 Å²	14.3	17%	0.165	8%	0.08	C	C	.	.	H	α-helix	trans	-60.3	-34.4	176.6	0	0	0	0	0	113.4	N201 V202 T208	N201-G204 PolarHBondContact O-N 3.4Å; V202-G204 PolarHBondContact O-N 2.98Å; V202-G204 VanDerWaalsContact O-N 3.09Å; G204-T208 VanDerWaalsContact O-CB 3.3Å; G204-T208 WeakPolarHBondContact O-CB 3.32Å; G204-T208 PolarHBondContact O-N 2.81Å; G204-T208 PolarHBondContact O-OG1 3.05Å
205	L	94.8	Very high	95.9	Very high	9 Å²	9	11.6 Å²	11.6	5%	0.047	7%	0.067	C	C	.	.	H	α-helix	trans	-69.7	-49.7	177.2	-67.6	96.9	0	0	0	111.3	Y121 V123 C140 L142 V202 I203 N207 T208 H209 P284 L287	Y121-L205 HydrophobicContact CD1-CD2 3.79Å; Y121-L205 HydrophobicContact CD2-CD2 3.92Å; Y121-L205 HydrophobicContact CE1-CD2 4.43Å; Y121-L205 HydrophobicContact CG-CD2 3.51Å; V123-L205 HydrophobicContact CG1-CD1 4.44Å; V123-L205 HydrophobicContact CG1-CG 3.86Å; C140-L205 HydrophobicContact CB-CD1 3.82Å; L142-L205 HydrophobicContact CD2-CD1 4.39Å; V202-L205 HydrophobicContact CG1-CD1 4.15Å; V202-L205 WeakPolarHBondContact O-CB 3.19Å; V202-L205 WeakPolarHBondContact O-CD1 3.17Å; V202-L205 PolarHBondContact O-N 2.66Å; I203-L205 VanDerWaalsContact C-N 3.27Å; I203-L205 PolarHBondContact O-N 3.13Å; L205-N207 VanDerWaalsContact C-N 3.32Å; L205-N207 PolarHBondContact O-N 2.98Å; L205-T208 WeakPolarHBondContact O-CB 3.37Å; L205-T208 PolarHBondContact O-N 3.01Å; L205-T208 VanDerWaalsContact O-N 3.11Å; L205-H209 PolarHBondContact O-N 3.38Å; L205-P284 HydrophobicContact CD2-CB 4.16Å; L205-L287 HydrophobicContact CB-CD1 3.82Å
206	Y	96.3	Very high	95.8	Very high	11 Å²	11	14.7 Å²	14.7	4%	0.043	8%	0.08	C	C	.	.	H	α-helix	trans	-61.2	-41	179.7	-61.2	-82.6	0	0	0	112.1	V202 I203 T208 H209 L210 Y280 I282 L287 F366	V202-Y206 HydrophobicContact CB-CE2 4.23Å; V202-Y206 HydrophobicContact CG1-CD2 4.41Å; V202-Y206 HydrophobicContact CG1-CE2 3.63Å; V202-Y206 VanDerWaalsContact O-CD2 3.22Å; V202-Y206 WeakPolarHBondContact O-CD2 3.49Å; I203-Y206 PolarHBondContact O-N 2.9Å; Y206-T208 VanDerWaalsContact C-N 3.35Å; Y206-T208 PolarHBondContact O-N 3.48Å; Y206-H209 PolarHBondContact O-N 3.2Å; Y206-L210 WeakPolarHBondContact O-CB 3.41Å; Y206-L210 PolarHBondContact O-N 3.21Å; Y206-Y280 HydrophobicContact CD1-CD2 4.28Å; Y206-Y280 AromaticContact CD2-CD2 3.48Å; Y206-Y280 HydrophobicContact CD2-CD2 3.48Å; Y206-Y280 VanDerWaalsContact CD2-CD2 3.48Å; Y206-Y280 AromaticContact CD2-CE2 3.29Å; Y206-Y280 HydrophobicContact CD2-CE2 3.29Å; Y206-Y280 HydrophobicContact CE1-CD2 4.42Å; Y206-Y280 AromaticContact CE2-CD2 3.62Å; Y206-Y280 HydrophobicContact CE2-CD2 3.62Å; Y206-Y280 AromaticContact CE2-CE2 3.39Å; Y206-Y280 HydrophobicContact CE2-CE2 3.39Å; Y206-Y280 HydrophobicContact CE2-CG 4.41Å; Y206-Y280 AromaticContact CE2-CZ 4Å; Y206-Y280 AromaticContact CG-CD2 3.83Å; Y206-Y280 HydrophobicContact CG-CD2 3.83Å; Y206-Y280 HydrophobicContact CG-CE2 4.09Å; Y206-Y280 PolarHBondContact OH-O 2.86Å; Y206-I282 WeakPolarHBondContact CE1-O 3.46Å; Y206-I282 PolarHBondContact OH-O 2.93Å; Y206-L287 HydrophobicContact CD1-CD1 3.96Å; Y206-L287 HydrophobicContact CD1-CD2 3.9Å; Y206-L287 HydrophobicContact CD1-CG 4.5Å; Y206-L287 HydrophobicContact CE1-CD1 4.09Å; Y206-L287 HydrophobicContact CE1-CD2 3.95Å; Y206-L287 HydrophobicContact CE1-CG 4.39Å; Y206-L287 HydrophobicContact CG-CD1 4.35Å; Y206-F366 VanDerWaalsContact C-CE2 3.4Å; Y206-F366 WeakPolarHBondContact O-CE2 3.3Å
207	N	96.8	Very high	95.8	Very high	15 Å²	15	14.3 Å²	14.3	8%	0.08	8%	0.079	C	C	.	.	H	α-helix	trans	-61.6	-43.1	173.2	-85.5	-37.9	0	0	0	113.2	I203 L205 H209 L210 L211 Y248 E364 P365	I203-N207 WeakPolarHBondContact CG2-ND2 3.45Å; I203-N207 WeakPolarHBondContact O-CB 3.1Å; I203-N207 PolarHBondContact O-N 3.25Å; I203-N207 PolarHBondContact O-ND2 3.48Å; L205-N207 VanDerWaalsContact C-N 3.32Å; L205-N207 PolarHBondContact O-N 2.98Å; N207-H209 VanDerWaalsContact C-N 3.31Å; N207-L210 PolarHBondContact O-N 2.89Å; N207-L211 VanDerWaalsContact O-CB 3.32Å; N207-L211 WeakPolarHBondContact O-CB 3.38Å; N207-L211 VanDerWaalsContact O-CG 3.28Å; N207-L211 WeakPolarHBondContact O-CG 3.47Å; N207-L211 PolarHBondContact O-N 3.48Å; N207-Y248 HydrophobicContact CB-CE2 4.11Å; N207-Y248 PolarHBondContact ND2-OH 3.44Å; N207-Y248 PolarHBondContact OD1-OH 3.18Å; N207-E364 PolarHBondContact ND2-OE1 3.07Å; N207-E364 PolarHBondContact OD1-OE1 3.48Å; N207-P365 WeakPolarHBondContact OD1-CG 3.38Å
208	T	97	Very high	95.8	Very high	7 Å²	7	15 Å²	15	4%	0.043	8%	0.082	C	C	.	.	H	α-helix	trans	-62.1	-44.6	178	-61	0	0	0	0	110.5	V123 G124 I127 N128 G204 L205 Y206 A212 M289	V123-T208 WeakPolarHBondContact CB-OG1 3.15Å; G124-T208 PolarHBondContact N-OG1 3.22Å; I127-T208 HydrophobicContact CG2-CG2 3.24Å; N128-T208 HydrophobicContact CB-CG2 4.15Å; G204-T208 VanDerWaalsContact O-CB 3.3Å; G204-T208 WeakPolarHBondContact O-CB 3.32Å; G204-T208 PolarHBondContact O-N 2.81Å; G204-T208 PolarHBondContact O-OG1 3.05Å; L205-T208 WeakPolarHBondContact O-CB 3.37Å; L205-T208 PolarHBondContact O-N 3.01Å; L205-T208 VanDerWaalsContact O-N 3.11Å; Y206-T208 VanDerWaalsContact C-N 3.35Å; Y206-T208 PolarHBondContact O-N 3.48Å; T208-A212 VanDerWaalsContact O-CB 3.26Å; T208-A212 WeakPolarHBondContact O-CB 3.15Å; T208-A212 PolarHBondContact O-N 3.2Å; T208-M289 HydrophobicContact CG2-CE 4Å
209	H	96.8	Very high	95.8	Very high	8 Å²	8	21 Å²	21	4%	0.037	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-51.2	176.3	175.5	-114.1	0	0	0	111.9	L205 Y206 N207 L211 A212 M213 F278 D288 M289	L205-H209 PolarHBondContact O-N 3.38Å; Y206-H209 PolarHBondContact O-N 3.2Å; N207-H209 VanDerWaalsContact C-N 3.31Å; H209-L211 PolarHBondContact O-N 2.87Å; H209-A212 WeakPolarHBondContact O-CB 3.39Å; H209-A212 PolarHBondContact O-N 3.13Å; H209-M213 WeakPolarHBondContact O-CG 3.31Å; H209-M213 PolarHBondContact O-N 3.24Å; H209-F278 AromaticContact CE1-CD1 3.93Å; H209-F278 AromaticContact CE1-CE1 3.65Å; H209-F278 AromaticContact ND1-CD1 3.87Å; H209-F278 AromaticContact ND1-CE1 3.84Å; H209-D288 PolarHBondContact NE2-O 3.26Å; H209-M289 HydrophobicContact CB-SD 3.91Å
210	L	97.3	Very high	96	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-58.8	-48.8	179.4	-179.4	61.4	0	0	0	111.9	Y206 N207 A212 M213 Y214 L270 Q271 F278 I330 P365 F366	Y206-L210 WeakPolarHBondContact O-CB 3.41Å; Y206-L210 PolarHBondContact O-N 3.21Å; N207-L210 PolarHBondContact O-N 2.89Å; L210-A212 VanDerWaalsContact C-N 3.32Å; L210-A212 PolarHBondContact O-N 3.1Å; L210-M213 PolarHBondContact O-N 3.4Å; L210-Y214 HydrophobicContact CD1-CD2 3.95Å; L210-Y214 HydrophobicContact CD1-CE2 3.48Å; L210-Y214 VanDerWaalsContact CD1-CE2 3.48Å; L210-Y214 HydrophobicContact CD2-CE2 4.2Å; L210-Y214 HydrophobicContact CG-CD2 3.88Å; L210-Y214 HydrophobicContact CG-CE2 3.63Å; L210-Y214 VanDerWaalsContact O-CD2 3.27Å; L210-Y214 WeakPolarHBondContact O-CD2 3.43Å; L210-Y214 PolarHBondContact O-N 3.25Å; L210-L270 HydrophobicContact CD1-CB 4.24Å; L210-Q271 HydrophobicContact CD1-CG 4.18Å; L210-Q271 HydrophobicContact CD2-CG 4.32Å; L210-F278 HydrophobicContact CB-CD1 4.35Å; L210-F278 HydrophobicContact CD1-CB 4.47Å; L210-F278 HydrophobicContact CD1-CD1 3.52Å; L210-F278 HydrophobicContact CD1-CE1 3.79Å; L210-F278 HydrophobicContact CD1-CG 3.91Å; L210-F278 HydrophobicContact CD1-CZ 4.4Å; L210-I330 HydrophobicContact CD2-CD1 3.91Å; L210-P365 HydrophobicContact CD2-CB 3.78Å; L210-P365 HydrophobicContact CD2-CG 3.76Å; L210-F366 HydrophobicContact CB-CE2 4.07Å; L210-F366 HydrophobicContact CB-CZ 4.05Å; L210-F366 HydrophobicContact CD2-CE2 3.85Å; L210-F366 HydrophobicContact CD2-CZ 3.98Å
211	L	97.9	Very high	96.3	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-63.8	-37	177.5	-70.9	-179.8	0	0	0	112.3	N128 F130 N207 H209 M213 Y214 A215 Y248 L251 I255	N128-L211 HydrophobicContact CB-CB 3.94Å; N128-L211 CarbonylContact O-C 3.52Å; F130-L211 HydrophobicContact CE2-CB 4.28Å; N207-L211 VanDerWaalsContact O-CB 3.32Å; N207-L211 WeakPolarHBondContact O-CB 3.38Å; N207-L211 VanDerWaalsContact O-CG 3.28Å; N207-L211 WeakPolarHBondContact O-CG 3.47Å; N207-L211 PolarHBondContact O-N 3.48Å; H209-L211 PolarHBondContact O-N 2.87Å; L211-M213 VanDerWaalsContact C-N 3.29Å; L211-M213 PolarHBondContact O-N 3.28Å; L211-Y214 PolarHBondContact O-N 3.23Å; L211-A215 WeakPolarHBondContact O-CB 3.39Å; L211-A215 PolarHBondContact O-N 3.48Å; L211-Y248 HydrophobicContact CD1-CD2 3.77Å; L211-Y248 HydrophobicContact CD1-CE2 3.86Å; L211-L251 HydrophobicContact CD1-CD1 4.14Å; L211-L251 HydrophobicContact CD2-CB 4.43Å; L211-I255 HydrophobicContact CD2-CD1 3.33Å
212	A	97.1	Very high	96.6	Very high	6 Å²	6	21.6 Å²	21.6	5%	0.05	10%	0.102	C	C	.	.	H	α-helix	trans	-62.1	-37.8	174.4	0	0	0	0	0	112.1	N128 T208 H209 L210 A215 K216 M289	N128-A212 WeakPolarHBondContact O-CA 3.48Å; N128-A212 PolarHBondContact O-N 3.12Å; T208-A212 VanDerWaalsContact O-CB 3.26Å; T208-A212 WeakPolarHBondContact O-CB 3.15Å; T208-A212 PolarHBondContact O-N 3.2Å; H209-A212 WeakPolarHBondContact O-CB 3.39Å; H209-A212 PolarHBondContact O-N 3.13Å; L210-A212 VanDerWaalsContact C-N 3.32Å; L210-A212 PolarHBondContact O-N 3.1Å; A212-A215 PolarHBondContact O-N 2.85Å; A212-K216 WeakPolarHBondContact O-CG 3.43Å; A212-K216 PolarHBondContact O-N 2.93Å; A212-M289 HydrophobicContact CB-CE 3.47Å; A212-M289 VanDerWaalsContact CB-CE 3.47Å
213	M	97	Very high	96.9	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-70.9	-43.3	176.3	-63.6	-54.5	145.7	0	0	111.4	H209 L210 L211 A215 K216 V217 L270 F278 D288 M289 L293 W295	H209-M213 WeakPolarHBondContact O-CG 3.31Å; H209-M213 PolarHBondContact O-N 3.24Å; L210-M213 PolarHBondContact O-N 3.4Å; L211-M213 VanDerWaalsContact C-N 3.29Å; L211-M213 PolarHBondContact O-N 3.28Å; M213-A215 VanDerWaalsContact C-N 3.28Å; M213-A215 PolarHBondContact O-N 3.06Å; M213-K216 PolarHBondContact O-N 3.32Å; M213-K216 HydrophobicContact SD-CD 4.2Å; M213-V217 WeakPolarHBondContact O-CG2 3.31Å; M213-V217 PolarHBondContact O-N 2.94Å; M213-L270 HydrophobicContact CB-CD1 3.85Å; M213-F278 HydrophobicContact CB-CE1 3.86Å; M213-F278 HydrophobicContact CB-CZ 3.65Å; M213-F278 HydrophobicContact CG-CE1 3.69Å; M213-F278 HydrophobicContact CG-CZ 3.69Å; M213-D288 WeakPolarHBondContact CE-O 3.47Å; M213-M289 WeakPolarHBondContact CE-O 3.32Å; M213-L293 HydrophobicContact CB-CD1 4.32Å; M213-W295 HydrophobicContact SD-CH2 3.8Å; M213-W295 HydrophobicContact SD-CZ2 4.3Å
214	Y	97.7	Very high	97.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-56.8	-41.1	172	-82.8	-64.2	0	0	0	113	L210 L211 K216 V217 I255 Q259 L267 P268 L270 I330	L210-Y214 HydrophobicContact CD1-CD2 3.95Å; L210-Y214 HydrophobicContact CD1-CE2 3.48Å; L210-Y214 VanDerWaalsContact CD1-CE2 3.48Å; L210-Y214 HydrophobicContact CD2-CE2 4.2Å; L210-Y214 HydrophobicContact CG-CD2 3.88Å; L210-Y214 HydrophobicContact CG-CE2 3.63Å; L210-Y214 VanDerWaalsContact O-CD2 3.27Å; L210-Y214 WeakPolarHBondContact O-CD2 3.43Å; L210-Y214 PolarHBondContact O-N 3.25Å; L211-Y214 PolarHBondContact O-N 3.23Å; Y214-K216 PolarHBondContact O-N 2.84Å; Y214-K216 VanDerWaalsContact O-N 3.16Å; Y214-V217 PolarHBondContact O-N 3.2Å; Y214-I255 HydrophobicContact CD1-CG2 4.08Å; Y214-I255 HydrophobicContact CD2-CD1 3.89Å; Y214-I255 HydrophobicContact CD2-CG2 4.42Å; Y214-I255 HydrophobicContact CE1-CG2 3.85Å; Y214-I255 HydrophobicContact CE2-CG2 4.23Å; Y214-I255 HydrophobicContact CG-CD1 3.98Å; Y214-I255 HydrophobicContact CG-CG1 4.4Å; Y214-I255 HydrophobicContact CG-CG2 4.36Å; Y214-Q259 PolarHBondContact OH-NE2 3.37Å; Y214-L267 HydrophobicContact CD1-CD1 3.96Å; Y214-L267 HydrophobicContact CD1-CD2 4.21Å; Y214-L267 HydrophobicContact CD1-CG 4.49Å; Y214-P268 WeakPolarHBondContact CE1-O 3.39Å; Y214-L270 HydrophobicContact CD1-CD1 3.66Å; Y214-L270 HydrophobicContact CD1-CG 4.01Å; Y214-L270 HydrophobicContact CD2-CD1 3.97Å; Y214-L270 HydrophobicContact CE1-CB 4.21Å; Y214-L270 HydrophobicContact CE1-CD1 3.76Å; Y214-L270 HydrophobicContact CE1-CG 3.63Å; Y214-L270 HydrophobicContact CE2-CB 4.34Å; Y214-L270 HydrophobicContact CE2-CD1 4.04Å; Y214-L270 HydrophobicContact CE2-CG 4.37Å; Y214-L270 HydrophobicContact CG-CD1 3.77Å; Y214-L270 PolarHBondContact OH-N 3.02Å; Y214-I330 HydrophobicContact CE2-CD1 3.93Å
215	A	97.1	Very high	97.3	Very high	5 Å²	5	17.9 Å²	17.9	4%	0.041	8%	0.079	C	C	.	.	H	α-helix	trans	-63.7	-17.6	178	0	0	0	0	0	114	F130 L211 A212 M213 R222	F130-A215 HydrophobicContact CE2-CB 3.88Å; F130-A215 HydrophobicContact CZ-CB 3.93Å; L211-A215 WeakPolarHBondContact O-CB 3.39Å; L211-A215 PolarHBondContact O-N 3.48Å; A212-A215 PolarHBondContact O-N 2.85Å; M213-A215 VanDerWaalsContact C-N 3.28Å; M213-A215 PolarHBondContact O-N 3.06Å; A215-R222 HydrophobicContact CB-CG 3.83Å; A215-R222 VanDerWaalsContact O-CD 3.32Å; A215-R222 WeakPolarHBondContact O-CD 3.41Å
216	K	96	Very high	97.4	Very high	65 Å²	65	18 Å²	18	28%	0.283	8%	0.079	S	C	.	.	H	α-helix	trans	-96.1	-17.9	178	-67.9	173.4	-171.6	175.6	0	113.7	A212 M213 Y214 M289 W295	A212-K216 WeakPolarHBondContact O-CG 3.43Å; A212-K216 PolarHBondContact O-N 2.93Å; M213-K216 PolarHBondContact O-N 3.32Å; M213-K216 HydrophobicContact SD-CD 4.2Å; Y214-K216 PolarHBondContact O-N 2.84Å; Y214-K216 VanDerWaalsContact O-N 3.16Å; K216-M289 PolarHBondContact NZ-O 2.9Å; K216-W295 HydrophobicContact CB-CE3 4.34Å; K216-W295 HydrophobicContact CB-CH2 3.64Å; K216-W295 HydrophobicContact CB-CZ2 4.18Å; K216-W295 HydrophobicContact CB-CZ3 3.72Å; K216-W295 HydrophobicContact CD-CH2 3.81Å; K216-W295 HydrophobicContact CD-CZ2 3.85Å; K216-W295 HydrophobicContact CG-CH2 4.41Å
217	V	97	Very high	97.5	Very high	14 Å²	14	17.5 Å²	17.5	9%	0.085	8%	0.078	C	C	.	.	H	α-helix	trans	-63.4	-47.2	-175.6	172.8	0	0	0	0	111.7	M213 Y214 L267 P268 L270 W295 L298	M213-V217 WeakPolarHBondContact O-CG2 3.31Å; M213-V217 PolarHBondContact O-N 2.94Å; Y214-V217 PolarHBondContact O-N 3.2Å; V217-L267 HydrophobicContact CB-CD2 3.65Å; V217-L267 HydrophobicContact CG1-CD2 3.63Å; V217-L267 HydrophobicContact CG2-CD2 4.35Å; V217-P268 HydrophobicContact CG1-CG 4.33Å; V217-L270 HydrophobicContact CG2-CD1 4.21Å; V217-L270 HydrophobicContact CG2-CD2 4.15Å; V217-W295 HydrophobicContact CG2-CZ3 4.21Å; V217-L298 HydrophobicContact CG1-CB 4.17Å; V217-L298 HydrophobicContact CG2-CD1 4.39Å
218	D	97.8	Very high	97.6	Very high	16 Å²	16	16.8 Å²	16.8	9%	0.086	7%	0.074	C	C	.	.			trans	-139.9	136.9	-178.2	-171.5	-65.2	0	0	0	110.5	R220 V221 V266	D218-R220 PolarHBondContact O-N 3.47Å; D218-R220 VanDerWaalsContact OD1-CB 3.27Å; D218-R220 WeakPolarHBondContact OD1-CB 3.32Å; D218-R220 WeakPolarHBondContact OD1-CG 3.45Å; D218-R220 IonicContact OD1-CZ 3.5Å; D218-R220 PolarHBondContact OD1-N 3.48Å; D218-R220 IonicContact OD1-NE 3.42Å; D218-R220 PolarHBondContact OD1-NE 3.39Å; D218-R220 IonicContact OD1-NH2 2.75Å; D218-R220 IonicContact OD2-CZ 2.77Å; D218-R220 IonicContact OD2-NE 2.81Å; D218-R220 PolarHBondContact OD2-NE 3.39Å; D218-R220 IonicContact OD2-NH2 3.02Å; D218-R220 PolarHBondContact OD2-NH2 2.96Å; D218-V221 HydrophobicContact CB-CG2 3.97Å; D218-V221 WeakPolarHBondContact O-CB 3.44Å; D218-V221 WeakPolarHBondContact O-CG2 3.47Å; D218-V221 PolarHBondContact O-N 3.42Å; D218-V266 HydrophobicContact CB-CG1 3.93Å
219	W	97.3	Very high	97.6	Very high	139 Å²	139	17.9 Å²	17.9	53%	0.527	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.6	-175.1	71.4	-90.7	0	0	0	113	W84 V221 P223 L306	W84-W219 HydrophobicContact CE3-CE3 4.35Å; W84-W219 AromaticContact CE3-CZ3 3.86Å; W84-W219 HydrophobicContact CE3-CZ3 3.86Å; W84-W219 HydrophobicContact CH2-CE3 4.4Å; W84-W219 AromaticContact CZ3-CE3 3.66Å; W84-W219 HydrophobicContact CZ3-CE3 3.66Å; W84-W219 AromaticContact CZ3-CZ3 3.62Å; W84-W219 HydrophobicContact CZ3-CZ3 3.62Å; W219-V221 VanDerWaalsContact C-N 3.28Å; W219-V221 PolarHBondContact O-N 3.25Å; W219-P223 WeakPolarHBondContact O-CD 3.5Å; W219-L306 HydrophobicContact CH2-CD1 4.25Å; W219-L306 HydrophobicContact CH2-CG 4.19Å; W219-L306 HydrophobicContact CZ3-CD1 3.94Å; W219-L306 HydrophobicContact CZ3-CD2 4.43Å; W219-L306 HydrophobicContact CZ3-CG 4.18Å
220	R	98.4	Very high	97.5	Very high	14 Å²	14	19.5 Å²	19.5	5%	0.053	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22	-178.7	-64.3	169.4	-70.2	-177.2	-7.1	112.7	D218 P223 L224 N302 N304 L306 L309	D218-R220 PolarHBondContact O-N 3.47Å; D218-R220 VanDerWaalsContact OD1-CB 3.27Å; D218-R220 WeakPolarHBondContact OD1-CB 3.32Å; D218-R220 WeakPolarHBondContact OD1-CG 3.45Å; D218-R220 IonicContact OD1-CZ 3.5Å; D218-R220 PolarHBondContact OD1-N 3.48Å; D218-R220 IonicContact OD1-NE 3.42Å; D218-R220 PolarHBondContact OD1-NE 3.39Å; D218-R220 IonicContact OD1-NH2 2.75Å; D218-R220 IonicContact OD2-CZ 2.77Å; D218-R220 IonicContact OD2-NE 2.81Å; D218-R220 PolarHBondContact OD2-NE 3.39Å; D218-R220 IonicContact OD2-NH2 3.02Å; D218-R220 PolarHBondContact OD2-NH2 2.96Å; R220-P223 WeakPolarHBondContact O-CD 3.22Å; R220-L224 HydrophobicContact CB-CD1 4.38Å; R220-L224 WeakPolarHBondContact O-CB 3.31Å; R220-L224 WeakPolarHBondContact O-CD1 3.27Å; R220-L224 VanDerWaalsContact O-CG 3.25Å; R220-L224 WeakPolarHBondContact O-CG 3.45Å; R220-L224 PolarHBondContact O-N 2.93Å; R220-L224 VanDerWaalsContact O-N 3.13Å; R220-N302 PolarHBondContact NH1-O 3Å; R220-N302 PolarHBondContact NH1-OD1 3.44Å; R220-N302 PolarHBondContact NH2-O 3.32Å; R220-N304 WeakPolarHBondContact CD-O 3.46Å; R220-N304 PolarHBondContact NH1-O 3.18Å; R220-L306 HydrophobicContact CB-CD2 3.81Å; R220-L306 HydrophobicContact CG-CD2 4.09Å; R220-L309 HydrophobicContact CB-CD1 4.05Å; R220-L309 HydrophobicContact CG-CD1 4.38Å
221	V	98.4	Very high	97.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.4	-46	-173.6	177.2	0	0	0	0	111.9	F130 D218 W219 L224 G225 L258 L267	F130-V221 HydrophobicContact CE1-CG1 3.86Å; F130-V221 HydrophobicContact CZ-CG1 3.71Å; D218-V221 HydrophobicContact CB-CG2 3.97Å; D218-V221 WeakPolarHBondContact O-CB 3.44Å; D218-V221 WeakPolarHBondContact O-CG2 3.47Å; D218-V221 PolarHBondContact O-N 3.42Å; W219-V221 VanDerWaalsContact C-N 3.28Å; W219-V221 PolarHBondContact O-N 3.25Å; V221-L224 PolarHBondContact O-N 3.41Å; V221-G225 PolarHBondContact O-N 3.41Å; V221-L258 HydrophobicContact CG2-CD1 4.11Å; V221-L267 HydrophobicContact CG2-CD1 4.13Å; V221-L267 HydrophobicContact CG2-CD2 3.75Å; V221-L267 HydrophobicContact CG2-CG 4.13Å
222	R	98.2	Very high	97.5	Very high	55 Å²	55	19.2 Å²	19.2	21%	0.208	8%	0.084	C	C	.	.	H	α-helix	trans	-67.6	-49.2	-176.6	-67.4	168.5	64.5	-146.5	-0.7	112.3	E29 Y87 G129 A215 L224 G225 I226	E29-R222 IonicContact OE1-CZ 3.07Å; E29-R222 IonicContact OE1-NH1 3.88Å; E29-R222 PolarHBondContact OE1-NH1 3.33Å; Y87-R222 HydrophobicContact CE2-CB 3.92Å; Y87-R222 PolarHBondContact OH-NE 3.01Å; Y87-R222 PolarHBondContact OH-NH1 3.31Å; Y87-R222 VanDerWaalsContact OH-NH1 3.07Å; Y87-R222 PolarHBondContact OH-NH2 3.4Å; G129-R222 PolarHBondContact O-NE 2.91Å; A215-R222 HydrophobicContact CB-CG 3.83Å; A215-R222 VanDerWaalsContact O-CD 3.32Å; A215-R222 WeakPolarHBondContact O-CD 3.41Å; R222-L224 PolarHBondContact O-N 3.27Å; R222-G225 PolarHBondContact O-N 3.45Å; R222-I226 PolarHBondContact O-N 3.49Å; R222-I226 VanDerWaalsContact O-N 3.08Å
223	P	98.3	Very high	97.4	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-56.1	-46.5	172.4	-23.6	31.6	0	0	0	112.8	I83 W84 Y87 W219 R220 G225 I226 F227 L306	I83-P223 HydrophobicContact CG2-CB 4Å; W84-P223 HydrophobicContact CE3-CB 4.48Å; W84-P223 HydrophobicContact CE3-CG 3.86Å; W84-P223 HydrophobicContact CZ3-CG 3.79Å; Y87-P223 HydrophobicContact CD1-CB 4.27Å; Y87-P223 HydrophobicContact CD1-CG 3.79Å; Y87-P223 HydrophobicContact CD2-CB 4.26Å; Y87-P223 HydrophobicContact CD2-CG 4.19Å; Y87-P223 HydrophobicContact CE1-CG 4.07Å; Y87-P223 HydrophobicContact CE2-CG 4.48Å; Y87-P223 HydrophobicContact CG-CB 3.9Å; Y87-P223 HydrophobicContact CG-CG 3.86Å; W219-P223 WeakPolarHBondContact O-CD 3.5Å; R220-P223 WeakPolarHBondContact O-CD 3.22Å; P223-G225 PolarHBondContact O-N 2.93Å; P223-I226 PolarHBondContact O-N 3.29Å; P223-F227 VanDerWaalsContact O-CB 3.25Å; P223-F227 WeakPolarHBondContact O-CB 3.41Å; P223-F227 PolarHBondContact O-N 2.83Å; P223-L306 HydrophobicContact CB-CD1 4.12Å; P223-L306 HydrophobicContact CB-CD2 3.93Å; P223-L306 HydrophobicContact CG-CD2 4.39Å
224	L	98.6	Very high	97.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.8	-44.9	177.8	-74.8	169.7	0	0	0	112.2	R220 V221 R222 I226 F227 I228 L254 L258 L306 L309 F310	R220-L224 HydrophobicContact CB-CD1 4.38Å; R220-L224 WeakPolarHBondContact O-CB 3.31Å; R220-L224 WeakPolarHBondContact O-CD1 3.27Å; R220-L224 VanDerWaalsContact O-CG 3.25Å; R220-L224 WeakPolarHBondContact O-CG 3.45Å; R220-L224 PolarHBondContact O-N 2.93Å; R220-L224 VanDerWaalsContact O-N 3.13Å; V221-L224 PolarHBondContact O-N 3.41Å; R222-L224 PolarHBondContact O-N 3.27Å; L224-I226 PolarHBondContact O-N 3.45Å; L224-F227 PolarHBondContact O-N 2.97Å; L224-I228 WeakPolarHBondContact O-CB 3.3Å; L224-I228 VanDerWaalsContact O-CG1 3.32Å; L224-I228 WeakPolarHBondContact O-CG1 3.46Å; L224-I228 PolarHBondContact O-N 2.58Å; L224-L254 HydrophobicContact CB-CD1 4.16Å; L224-L254 HydrophobicContact CB-CD2 3.87Å; L224-L254 HydrophobicContact CD1-CD1 4.39Å; L224-L258 HydrophobicContact CD1-CD1 4.5Å; L224-L258 HydrophobicContact CD1-CD2 4.41Å; L224-L306 HydrophobicContact CD1-CD2 4.37Å; L224-L306 HydrophobicContact CD2-CD2 4.28Å; L224-L306 HydrophobicContact CG-CD2 3.81Å; L224-L309 HydrophobicContact CD1-CB 3.74Å; L224-L309 HydrophobicContact CD1-CD1 3.78Å; L224-L309 HydrophobicContact CD1-CG 4.41Å; L224-L309 HydrophobicContact CD2-CB 4.24Å; L224-F310 HydrophobicContact CD2-CB 4.01Å
225	G	98.3	Very high	97.3	Very high	4 Å²	4	26.8 Å²	26.8	4%	0.041	12%	0.124	C	C	.	.	H	α-helix	trans	-63	-40.9	-179.8	0	0	0	0	0	113	V221 R222 P223 K229	V221-G225 PolarHBondContact O-N 3.41Å; R222-G225 PolarHBondContact O-N 3.45Å; P223-G225 PolarHBondContact O-N 2.93Å; G225-K229 WeakPolarHBondContact O-CB 3.44Å; G225-K229 PolarHBondContact O-N 2.69Å
226	I	96.9	Very high	97.2	Very high	11 Å²	11	30 Å²	30	6%	0.056	14%	0.14	C	C	.	.	H	α-helix	trans	-69.3	-42.6	175.2	-66.3	-166.2	0	0	0	110.9	Y87 T90 K91 R222 P223 L224 K229 H230	Y87-I226 HydrophobicContact CD2-CB 4.43Å; Y87-I226 HydrophobicContact CD2-CD1 3.79Å; Y87-I226 HydrophobicContact CD2-CG1 4.34Å; Y87-I226 HydrophobicContact CE2-CD1 4Å; T90-I226 WeakPolarHBondContact OG1-CG2 3.25Å; K91-I226 HydrophobicContact CB-CD1 4.09Å; R222-I226 PolarHBondContact O-N 3.49Å; R222-I226 VanDerWaalsContact O-N 3.08Å; P223-I226 PolarHBondContact O-N 3.29Å; L224-I226 PolarHBondContact O-N 3.45Å; I226-K229 WeakPolarHBondContact O-CB 3.18Å; I226-K229 PolarHBondContact O-N 3.07Å; I226-H230 PolarHBondContact O-N 3.23Å
227	F	97.4	Very high	97.2	Very high	1 Å²	1	27 Å²	27	0%	0.004	13%	0.127	C	C	.	.	H	α-helix	trans	-65.8	-44.5	-179.7	-172.8	-95.7	0	0	0	112.7	L79 I83 L86 P223 L224 K229 H230 W231 F310 L401 M405 L407	L79-F227 HydrophobicContact CD1-CZ 4.25Å; I83-F227 HydrophobicContact CB-CD2 4.07Å; I83-F227 HydrophobicContact CB-CE2 4.42Å; I83-F227 HydrophobicContact CB-CG 4.32Å; I83-F227 HydrophobicContact CD1-CD1 4.3Å; I83-F227 HydrophobicContact CD1-CE1 4.3Å; I83-F227 HydrophobicContact CG1-CD1 3.89Å; I83-F227 HydrophobicContact CG1-CD2 3.61Å; I83-F227 HydrophobicContact CG1-CE1 3.91Å; I83-F227 HydrophobicContact CG1-CE2 3.64Å; I83-F227 HydrophobicContact CG1-CG 3.75Å; I83-F227 HydrophobicContact CG1-CZ 3.79Å; I83-F227 HydrophobicContact CG2-CB 3.94Å; I83-F227 HydrophobicContact CG2-CD2 4.22Å; I83-F227 HydrophobicContact CG2-CG 4.08Å; L86-F227 HydrophobicContact CD2-CD2 3.55Å; L86-F227 HydrophobicContact CD2-CE2 4.19Å; L86-F227 HydrophobicContact CD2-CG 4.41Å; P223-F227 VanDerWaalsContact O-CB 3.25Å; P223-F227 WeakPolarHBondContact O-CB 3.41Å; P223-F227 PolarHBondContact O-N 2.83Å; L224-F227 PolarHBondContact O-N 2.97Å; F227-K229 VanDerWaalsContact C-N 3.31Å; F227-K229 PolarHBondContact O-N 3.29Å; F227-H230 PolarHBondContact O-N 3.09Å; F227-H230 VanDerWaalsContact O-N 3.16Å; F227-W231 WeakPolarHBondContact O-CB 3.3Å; F227-W231 PolarHBondContact O-N 3.28Å; F227-F310 AromaticContact CD1-CD2 3.79Å; F227-F310 HydrophobicContact CD1-CD2 3.79Å; F227-F310 AromaticContact CD1-CE2 3.86Å; F227-F310 HydrophobicContact CD1-CE2 3.86Å; F227-F310 HydrophobicContact CD1-CG 4.15Å; F227-F310 HydrophobicContact CD1-CZ 4.29Å; F227-F310 AromaticContact CE1-CD1 3.9Å; F227-F310 HydrophobicContact CE1-CD1 3.9Å; F227-F310 AromaticContact CE1-CD2 3.87Å; F227-F310 HydrophobicContact CE1-CD2 3.87Å; F227-F310 AromaticContact CE1-CE1 3.77Å; F227-F310 HydrophobicContact CE1-CE1 3.77Å; F227-F310 AromaticContact CE1-CE2 3.76Å; F227-F310 HydrophobicContact CE1-CE2 3.76Å; F227-F310 AromaticContact CE1-CG 3.93Å; F227-F310 HydrophobicContact CE1-CG 3.93Å; F227-F310 AromaticContact CE1-CZ 3.71Å; F227-F310 HydrophobicContact CE1-CZ 3.71Å; F227-L401 HydrophobicContact CE1-CD1 4.39Å; F227-L401 HydrophobicContact CZ-CD1 3.96Å; F227-M405 HydrophobicContact CD1-CE 4.44Å; F227-M405 HydrophobicContact CD2-CE 4.27Å; F227-M405 HydrophobicContact CE1-CE 3.92Å; F227-M405 HydrophobicContact CE1-SD 4.24Å; F227-M405 HydrophobicContact CE2-CE 3.73Å; F227-M405 HydrophobicContact CZ-CE 3.52Å; F227-M405 HydrophobicContact CZ-SD 3.98Å; F227-L407 HydrophobicContact CE2-CD2 3.69Å; F227-L407 HydrophobicContact CZ-CD2 4.3Å
228	I	98.1	Very high	97.2	Very high	1 Å²	1	28 Å²	28	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-38.1	176.3	-73.3	166.3	0	0	0	111.1	L224 W231 A232 L250 L254 F310 F313	L224-I228 WeakPolarHBondContact O-CB 3.3Å; L224-I228 VanDerWaalsContact O-CG1 3.32Å; L224-I228 WeakPolarHBondContact O-CG1 3.46Å; L224-I228 PolarHBondContact O-N 2.58Å; I228-W231 HydrophobicContact CG2-CE3 4.19Å; I228-A232 VanDerWaalsContact O-CB 3.3Å; I228-A232 WeakPolarHBondContact O-CB 3.43Å; I228-A232 PolarHBondContact O-N 2.76Å; I228-L250 HydrophobicContact CG2-CB 4.24Å; I228-L250 HydrophobicContact CG2-CD2 4.11Å; I228-L254 HydrophobicContact CD1-CB 4.22Å; I228-L254 HydrophobicContact CD1-CD1 3.66Å; I228-L254 HydrophobicContact CD1-CD2 4.15Å; I228-L254 HydrophobicContact CD1-CG 4.21Å; I228-F310 HydrophobicContact CG1-CD2 3.9Å; I228-F310 HydrophobicContact CG1-CE2 3.99Å; I228-F313 HydrophobicContact CD1-CD1 3.91Å; I228-F313 HydrophobicContact CD1-CD2 4.03Å; I228-F313 HydrophobicContact CD1-CE1 3.94Å; I228-F313 HydrophobicContact CD1-CE2 4.04Å; I228-F313 HydrophobicContact CD1-CG 3.97Å; I228-F313 HydrophobicContact CD1-CZ 4.01Å; I228-F313 HydrophobicContact CG1-CD1 4.29Å; I228-F313 HydrophobicContact CG1-CE1 4.16Å; I228-F313 HydrophobicContact CG2-CE1 4.1Å; I228-F313 HydrophobicContact CG2-CZ 3.99Å
229	K	97	Very high	96.9	Very high	30 Å²	30	29.4 Å²	29.4	13%	0.13	14%	0.139	C	C	.	.	H	α-helix	trans	-59.4	-49.4	172.6	-178.7	-164.6	169.5	-165	0	110.7	G225 I226 F227 A232 Q233 T247	G225-K229 WeakPolarHBondContact O-CB 3.44Å; G225-K229 PolarHBondContact O-N 2.69Å; I226-K229 WeakPolarHBondContact O-CB 3.18Å; I226-K229 PolarHBondContact O-N 3.07Å; F227-K229 VanDerWaalsContact C-N 3.31Å; F227-K229 PolarHBondContact O-N 3.29Å; K229-A232 PolarHBondContact O-N 3.46Å; K229-Q233 VanDerWaalsContact O-CG 3.32Å; K229-Q233 WeakPolarHBondContact O-CG 3.48Å; K229-Q233 PolarHBondContact O-N 3.21Å; K229-T247 HydrophobicContact CD-CG2 4.02Å; K229-T247 HydrophobicContact CG-CG2 4.29Å
230	H	95.7	Very high	96.6	Very high	41 Å²	41	24.8 Å²	24.8	19%	0.19	13%	0.13	C	C	.	.	H	α-helix	trans	-62	-46	179.3	-173.2	66.5	0	0	0	112.1	L86 I226 F227 A232 Q233 C234 E406	L86-H230 HydrophobicContact CD2-CB 3.82Å; I226-H230 PolarHBondContact O-N 3.23Å; F227-H230 PolarHBondContact O-N 3.09Å; F227-H230 VanDerWaalsContact O-N 3.16Å; H230-A232 VanDerWaalsContact C-N 3.34Å; H230-A232 PolarHBondContact O-N 3.49Å; H230-Q233 WeakPolarHBondContact O-CB 3.45Å; H230-Q233 PolarHBondContact O-N 3.03Å; H230-Q233 VanDerWaalsContact O-N 3.1Å; H230-C234 PolarHBondContact O-N 3.27Å; H230-C234 PolarHBondContact O-SG 2.88Å; H230-E406 PolarHBondContact NE2-O 2.87Å
231	W	97.4	Very high	96.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-52.9	-50.6	172.8	164.9	74.8	0	0	0	111.7	F227 I228 Q233 C234 M235 I237 F310 F313 I314 F388 T391 M405	F227-W231 WeakPolarHBondContact O-CB 3.3Å; F227-W231 PolarHBondContact O-N 3.28Å; I228-W231 HydrophobicContact CG2-CE3 4.19Å; W231-Q233 VanDerWaalsContact C-N 3.25Å; W231-Q233 PolarHBondContact O-N 3.24Å; W231-C234 PolarHBondContact O-N 2.68Å; W231-M235 HydrophobicContact CG-CG 4.46Å; W231-M235 WeakPolarHBondContact O-CB 3.28Å; W231-M235 VanDerWaalsContact O-CG 3.27Å; W231-M235 WeakPolarHBondContact O-CG 3.32Å; W231-M235 PolarHBondContact O-N 3.34Å; W231-I237 HydrophobicContact CH2-CD1 3.66Å; W231-I237 HydrophobicContact CZ2-CD1 4.24Å; W231-I237 HydrophobicContact CZ3-CD1 3.87Å; W231-F310 HydrophobicContact CB-CZ 4.49Å; W231-F310 HydrophobicContact CD2-CE2 4.49Å; W231-F310 HydrophobicContact CD2-CZ 4.44Å; W231-F310 HydrophobicContact CG-CE2 4.32Å; W231-F310 HydrophobicContact CG-CZ 4.07Å; W231-F313 HydrophobicContact CZ3-CE1 4.22Å; W231-I314 HydrophobicContact CD2-CD1 4.39Å; W231-I314 HydrophobicContact CH2-CD1 3.92Å; W231-I314 HydrophobicContact CZ2-CD1 3.59Å; W231-I314 HydrophobicContact CZ3-CD1 4.43Å; W231-F388 AromaticContact CH2-CD1 3.87Å; W231-F388 HydrophobicContact CH2-CD1 3.87Å; W231-F388 HydrophobicContact CH2-CD2 4Å; W231-F388 AromaticContact CH2-CE1 3.58Å; W231-F388 HydrophobicContact CH2-CE1 3.58Å; W231-F388 AromaticContact CH2-CE2 3.72Å; W231-F388 HydrophobicContact CH2-CE2 3.72Å; W231-F388 HydrophobicContact CH2-CG 4.06Å; W231-F388 AromaticContact CH2-CZ 3.5Å; W231-F388 HydrophobicContact CH2-CZ 3.5Å; W231-F388 VanDerWaalsContact CH2-CZ 3.5Å; W231-F388 HydrophobicContact CZ2-CD1 4.3Å; W231-F388 HydrophobicContact CZ2-CE1 4.39Å; W231-F388 HydrophobicContact CZ2-CG 4.46Å; W231-F388 HydrophobicContact CZ3-CE1 4.18Å; W231-F388 HydrophobicContact CZ3-CE2 4.36Å; W231-F388 AromaticContact CZ3-CZ 3.9Å; W231-F388 HydrophobicContact CZ3-CZ 3.9Å; W231-T391 PolarHBondContact NE1-OG1 3.42Å; W231-M405 VanDerWaalsContact CA-CE 3.49Å; W231-M405 HydrophobicContact CB-CE 3.57Å; W231-M405 HydrophobicContact CB-CG 4.49Å; W231-M405 HydrophobicContact CB-SD 3.6Å; W231-M405 VanDerWaalsContact CD1-SD 3.54Å; W231-M405 HydrophobicContact CG-SD 3.96Å
232	A	97.4	Very high	95.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.3	-30.4	-179.6	0	0	0	0	0	112.9	I228 K229 H230 D236 I237 H238 L250	I228-A232 VanDerWaalsContact O-CB 3.3Å; I228-A232 WeakPolarHBondContact O-CB 3.43Å; I228-A232 PolarHBondContact O-N 2.76Å; K229-A232 PolarHBondContact O-N 3.46Å; H230-A232 VanDerWaalsContact C-N 3.34Å; H230-A232 PolarHBondContact O-N 3.49Å; A232-D236 PolarHBondContact O-N 3.36Å; A232-I237 HydrophobicContact CB-CD1 4.2Å; A232-I237 HydrophobicContact CB-CG1 3.86Å; A232-I237 WeakPolarHBondContact O-CG1 3.45Å; A232-I237 PolarHBondContact O-N 3.16Å; A232-H238 HydrophobicContact CB-CB 3.89Å; A232-H238 PolarHBondContact O-N 3.42Å; A232-L250 HydrophobicContact CB-CD1 3.47Å; A232-L250 VanDerWaalsContact CB-CD1 3.47Å; A232-L250 HydrophobicContact CB-CD2 4.05Å; A232-L250 HydrophobicContact CB-CG 4.42Å
233	Q	95.5	Very high	95.4	Very high	84 Å²	84	36.2 Å²	36.2	39%	0.393	18%	0.182	S	C	.	.	H	α-helix	trans	-69.1	-49	172.9	-70.7	173.3	-54.9	0	0	111.4	K229 H230 W231 M235 D236 H238	K229-Q233 VanDerWaalsContact O-CG 3.32Å; K229-Q233 WeakPolarHBondContact O-CG 3.48Å; K229-Q233 PolarHBondContact O-N 3.21Å; H230-Q233 WeakPolarHBondContact O-CB 3.45Å; H230-Q233 PolarHBondContact O-N 3.03Å; H230-Q233 VanDerWaalsContact O-N 3.1Å; W231-Q233 VanDerWaalsContact C-N 3.25Å; W231-Q233 PolarHBondContact O-N 3.24Å; Q233-M235 VanDerWaalsContact C-N 3.26Å; Q233-M235 PolarHBondContact O-N 3.15Å; Q233-D236 PolarHBondContact O-N 2.89Å; Q233-H238 HydrophobicContact CB-CB 4.49Å; Q233-H238 HydrophobicContact CG-CB 3.78Å; Q233-H238 WeakPolarHBondContact CG-ND1 3.37Å
234	C	95.9	Very high	95.3	Very high	49 Å²	49	37.1 Å²	37.1	33%	0.331	19%	0.186	S	C	.	.	H	α-helix	trans	-62.6	-33.3	177.2	-63.6	0	0	0	0	112.6	H230 W231 D236 I404 M405	H230-C234 PolarHBondContact O-N 3.27Å; H230-C234 PolarHBondContact O-SG 2.88Å; W231-C234 PolarHBondContact O-N 2.68Å; C234-D236 PolarHBondContact O-N 2.9Å; C234-I404 VanDerWaalsContact CB-O 3.24Å; C234-I404 WeakPolarHBondContact CB-O 3.32Å; C234-M405 HydrophobicContact CB-CG 4.12Å
235	M	96.1	Very high	95.2	Very high	33 Å²	33	37.1 Å²	37.1	16%	0.163	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	2.1	176.4	-65.5	-60.1	-73.2	0	0	113.9	W231 Q233 I237 A387 K390 I404	W231-M235 HydrophobicContact CG-CG 4.46Å; W231-M235 WeakPolarHBondContact O-CB 3.28Å; W231-M235 VanDerWaalsContact O-CG 3.27Å; W231-M235 WeakPolarHBondContact O-CG 3.32Å; W231-M235 PolarHBondContact O-N 3.34Å; Q233-M235 VanDerWaalsContact C-N 3.26Å; Q233-M235 PolarHBondContact O-N 3.15Å; M235-I237 HydrophobicContact CB-CD1 4.46Å; M235-I237 HydrophobicContact CB-CG1 4.05Å; M235-I237 PolarHBondContact O-N 3.02Å; M235-A387 HydrophobicContact CB-CB 4.01Å; M235-A387 HydrophobicContact CE-CB 3.54Å; M235-A387 HydrophobicContact CG-CB 4.39Å; M235-K390 HydrophobicContact CE-CB 4.42Å; M235-K390 HydrophobicContact CE-CD 4.26Å; M235-I404 HydrophobicContact SD-CB 3.72Å; M235-I404 HydrophobicContact SD-CD1 3.98Å; M235-I404 HydrophobicContact SD-CG1 4.39Å; M235-I404 HydrophobicContact SD-CG2 4.13Å
236	D	95.3	Very high	95.1	Very high	72 Å²	72	38.1 Å²	38.1	39%	0.385	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	32.7	-178.1	-162.4	41.9	0	0	0	113.6	A232 Q233 C234 R242 R244	A232-D236 PolarHBondContact O-N 3.36Å; Q233-D236 PolarHBondContact O-N 2.89Å; C234-D236 PolarHBondContact O-N 2.9Å; D236-R242 IonicContact OD1-CZ 3.64Å; D236-R242 IonicContact OD1-NH1 3.57Å; D236-R242 PolarHBondContact OD1-NH1 3.47Å; D236-R242 IonicContact OD1-NH2 3.34Å; D236-R242 IonicContact OD2-NH2 2.76Å; D236-R244 VanDerWaalsContact O-CD 3.27Å; D236-R244 WeakPolarHBondContact O-CD 3.43Å; D236-R244 PolarHBondContact O-NE 2.93Å; D236-R244 VanDerWaalsContact O-NE 3.14Å; D236-R244 PolarHBondContact O-NH1 3.38Å; D236-R244 VanDerWaalsContact O-NH1 3.12Å; D236-R244 PolarHBondContact O-NH2 3.28Å; D236-R244 IonicContact OD1-CZ 3.75Å; D236-R244 IonicContact OD1-NH1 2.67Å; D236-R244 PolarHBondContact OD1-NH1 2.59Å; D236-R244 IonicContact OD1-NH2 2.7Å; D236-R244 IonicContact OD2-CZ 2.89Å; D236-R244 VanDerWaalsContact OD2-CZ 3.28Å; D236-R244 IonicContact OD2-NH1 3.97Å; D236-R244 PolarHBondContact OD2-NH1 2.82Å; D236-R244 IonicContact OD2-NH2 3.02Å; D236-R244 PolarHBondContact OD2-NH2 3.14Å
237	I	96.6	Very high	95.1	Very high	2 Å²	2	39 Å²	39	1%	0.01	20%	0.198	C	C	.	.			trans	-111.6	1.1	176.3	62.5	165.5	0	0	0	113	W231 A232 M235 R244 L245 I384 A387	W231-I237 HydrophobicContact CH2-CD1 3.66Å; W231-I237 HydrophobicContact CZ2-CD1 4.24Å; W231-I237 HydrophobicContact CZ3-CD1 3.87Å; A232-I237 HydrophobicContact CB-CD1 4.2Å; A232-I237 HydrophobicContact CB-CG1 3.86Å; A232-I237 WeakPolarHBondContact O-CG1 3.45Å; A232-I237 PolarHBondContact O-N 3.16Å; M235-I237 HydrophobicContact CB-CD1 4.46Å; M235-I237 HydrophobicContact CB-CG1 4.05Å; M235-I237 PolarHBondContact O-N 3.02Å; I237-R244 VanDerWaalsContact O-CB 3.29Å; I237-R244 WeakPolarHBondContact O-CB 3.39Å; I237-L245 HydrophobicContact CD1-CD1 4.31Å; I237-L245 WeakPolarHBondContact O-CB 3.42Å; I237-L245 PolarHBondContact O-N 3.03Å; I237-L245 VanDerWaalsContact O-N 3.07Å; I237-I384 HydrophobicContact CB-CG1 4.1Å; I237-I384 HydrophobicContact CG2-CG1 4.12Å; I237-A387 HydrophobicContact CD1-CB 3.91Å; I237-A387 HydrophobicContact CG2-CB 3.84Å
238	H	96.1	Very high	95	Very high	35 Å²	35	41.3 Å²	41.3	16%	0.162	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-103.7	121.6	171.2	176.9	-87	0	0	0	109.7	A232 Q233 L245 T247	A232-H238 HydrophobicContact CB-CB 3.89Å; A232-H238 PolarHBondContact O-N 3.42Å; Q233-H238 HydrophobicContact CB-CB 4.49Å; Q233-H238 HydrophobicContact CG-CB 3.78Å; Q233-H238 WeakPolarHBondContact CG-ND1 3.37Å; H238-L245 WeakPolarHBondContact CA-O 3.38Å; H238-T247 PolarHBondContact NE2-OG1 3.39Å
239	D	92.8	Very high	95	Very high	47 Å²	47	41.2 Å²	41.2	25%	0.251	21%	0.207	S	C	.	.			trans	158	100.2	165.9	-179.3	-9.2	0	0	0	108	Q241 R242 G243 R244 L245	D239-Q241 PolarHBondContact O-N 3.2Å; D239-Q241 WeakPolarHBondContact OD1-CA 3.49Å; D239-Q241 WeakPolarHBondContact OD1-CB 3.33Å; D239-Q241 PolarHBondContact OD1-N 3Å; D239-R242 HydrophobicContact CB-CB 4.14Å; D239-R242 HydrophobicContact CB-CG 4.37Å; D239-R242 PolarHBondContact O-N 3.49Å; D239-R242 PolarHBondContact OD1-N 3.11Å; D239-R242 WeakPolarHBondContact OD2-CD 3.48Å; D239-R242 WeakPolarHBondContact OD2-CG 3.25Å; D239-G243 PolarHBondContact O-N 2.94Å; D239-R244 VanDerWaalsContact O-CB 3.32Å; D239-R244 WeakPolarHBondContact O-CB 3.07Å; D239-R244 PolarHBondContact O-N 3.37Å; D239-L245 PolarHBondContact N-O 2.83Å; D239-L245 VanDerWaalsContact N-O 3.09Å
240	A	91	Very high	95.1	Very high	42 Å²	42	40 Å²	40	35%	0.347	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.2	-178.3	0	0	0	0	0	113.2	R242 G243	A240-R242 VanDerWaalsContact C-N 3.33Å; A240-G243 PolarHBondContact O-N 3.02Å; A240-G243 VanDerWaalsContact O-N 3.13Å
241	Q	88.1	Confident	95.2	Very high	162 Å²	162	38.2 Å²	38.2	76%	0.757	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-33.7	179.2	-58.8	-174.1	-8.1	0	0	110.9	D239 G243	D239-Q241 PolarHBondContact O-N 3.2Å; D239-Q241 WeakPolarHBondContact OD1-CA 3.49Å; D239-Q241 WeakPolarHBondContact OD1-CB 3.33Å; D239-Q241 PolarHBondContact OD1-N 3Å; Q241-G243 PolarHBondContact O-N 3.38Å
242	R	90.6	Very high	95.3	Very high	138 Å²	138	38.3 Å²	38.3	52%	0.521	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	11.3	171.2	-66.9	171.7	74.2	-167.7	-1.1	113.5	D236 D239 A240 R244	D236-R242 IonicContact OD1-CZ 3.64Å; D236-R242 IonicContact OD1-NH1 3.57Å; D236-R242 PolarHBondContact OD1-NH1 3.47Å; D236-R242 IonicContact OD1-NH2 3.34Å; D236-R242 IonicContact OD2-NH2 2.76Å; D239-R242 HydrophobicContact CB-CB 4.14Å; D239-R242 HydrophobicContact CB-CG 4.37Å; D239-R242 PolarHBondContact O-N 3.49Å; D239-R242 PolarHBondContact OD1-N 3.11Å; D239-R242 WeakPolarHBondContact OD2-CD 3.48Å; D239-R242 WeakPolarHBondContact OD2-CG 3.25Å; A240-R242 VanDerWaalsContact C-N 3.33Å; R242-R244 HydrophobicContact CB-CG 4.46Å; R242-R244 VanDerWaalsContact CZ-CZ 3.47Å
243	G	91.3	Very high	95.3	Very high	8 Å²	8	38.4 Å²	38.4	8%	0.082	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	18.9	178	0	0	0	0	0	114.7	D239 A240 Q241 S374 I375 I380	D239-G243 PolarHBondContact O-N 2.94Å; A240-G243 PolarHBondContact O-N 3.02Å; A240-G243 VanDerWaalsContact O-N 3.13Å; Q241-G243 PolarHBondContact O-N 3.38Å; G243-S374 VanDerWaalsContact CA-O 3.26Å; G243-S374 WeakPolarHBondContact CA-O 3.48Å; G243-I375 WeakPolarHBondContact O-CA 3.45Å; G243-I375 WeakPolarHBondContact O-CG1 3.24Å; G243-I380 WeakPolarHBondContact O-CG2 3.41Å
244	R	94.9	Very high	95.5	Very high	19 Å²	19	34.5 Å²	34.5	7%	0.072	18%	0.176	C	C	.	.	S	Bend	trans	-104.6	-169.1	-177.9	-53.4	174.3	173.6	160.2	-12.9	112	D236 I237 D239 R242 S246 S374 I380	D236-R244 VanDerWaalsContact O-CD 3.27Å; D236-R244 WeakPolarHBondContact O-CD 3.43Å; D236-R244 PolarHBondContact O-NE 2.93Å; D236-R244 VanDerWaalsContact O-NE 3.14Å; D236-R244 PolarHBondContact O-NH1 3.38Å; D236-R244 VanDerWaalsContact O-NH1 3.12Å; D236-R244 PolarHBondContact O-NH2 3.28Å; D236-R244 IonicContact OD1-CZ 3.75Å; D236-R244 IonicContact OD1-NH1 2.67Å; D236-R244 PolarHBondContact OD1-NH1 2.59Å; D236-R244 IonicContact OD1-NH2 2.7Å; D236-R244 IonicContact OD2-CZ 2.89Å; D236-R244 VanDerWaalsContact OD2-CZ 3.28Å; D236-R244 IonicContact OD2-NH1 3.97Å; D236-R244 PolarHBondContact OD2-NH1 2.82Å; D236-R244 IonicContact OD2-NH2 3.02Å; D236-R244 PolarHBondContact OD2-NH2 3.14Å; I237-R244 VanDerWaalsContact O-CB 3.29Å; I237-R244 WeakPolarHBondContact O-CB 3.39Å; D239-R244 VanDerWaalsContact O-CB 3.32Å; D239-R244 WeakPolarHBondContact O-CB 3.07Å; D239-R244 PolarHBondContact O-N 3.37Å; R242-R244 HydrophobicContact CB-CG 4.46Å; R242-R244 VanDerWaalsContact CZ-CZ 3.47Å; R244-S246 PolarHBondContact O-N 2.86Å; R244-S374 PolarHBondContact O-OG 3.34Å; R244-I380 HydrophobicContact CB-CG2 4.38Å; R244-I380 HydrophobicContact CG-CD1 4.1Å; R244-I380 HydrophobicContact CG-CG2 3.87Å
245	L	96.6	Very high	95.6	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-66.1	133.1	179.7	-68.1	161.5	0	0	0	110.2	I237 H238 D239 C249 L250 M253 I362 I375 I384	I237-L245 HydrophobicContact CD1-CD1 4.31Å; I237-L245 WeakPolarHBondContact O-CB 3.42Å; I237-L245 PolarHBondContact O-N 3.03Å; I237-L245 VanDerWaalsContact O-N 3.07Å; H238-L245 WeakPolarHBondContact CA-O 3.38Å; D239-L245 PolarHBondContact N-O 2.83Å; D239-L245 VanDerWaalsContact N-O 3.09Å; L245-C249 HydrophobicContact CD2-CB 3.89Å; L245-L250 HydrophobicContact CB-CD2 4.2Å; L245-L250 HydrophobicContact CB-CG 4.18Å; L245-L250 HydrophobicContact CD1-CD2 3.8Å; L245-M253 HydrophobicContact CD1-SD 4.39Å; L245-M253 HydrophobicContact CD2-SD 3.89Å; L245-I362 HydrophobicContact CD2-CD1 4.49Å; L245-I375 HydrophobicContact CD2-CD1 3.6Å; L245-I375 HydrophobicContact CG-CD1 3.96Å; L245-I384 HydrophobicContact CD1-CD1 4.22Å; L245-I384 HydrophobicContact CD1-CG1 4.25Å; L245-I384 HydrophobicContact CD1-CG2 4.07Å; L245-I384 HydrophobicContact CG-CD1 4.03Å
246	S	96.1	Very high	95.7	Very high	25 Å²	25	30.6 Å²	30.6	18%	0.175	15%	0.153	C	C	.	.			trans	-82.3	159.9	167	70.8	0	0	0	0	110.2	R244 Y248 C249 L250	R244-S246 PolarHBondContact O-N 2.86Å; S246-Y248 PolarHBondContact O-N 3.3Å; S246-Y248 PolarHBondContact OG-N 3.08Å; S246-C249 WeakPolarHBondContact O-CB 3.26Å; S246-C249 PolarHBondContact O-N 2.89Å; S246-C249 VanDerWaalsContact O-N 3.09Å; S246-C249 PolarHBondContact OG-N 3.46Å; S246-C249 PolarHBondContact OG-SG 3.02Å; S246-L250 PolarHBondContact O-N 3.5Å
247	T	96.3	Very high	95.9	Very high	28 Å²	28	27.8 Å²	27.8	17%	0.172	14%	0.137	C	C	.	.	H	α-helix	trans	-52.8	-40.9	169.6	-51.3	0	0	0	0	110.9	K229 H238 C249 L250 L251	K229-T247 HydrophobicContact CD-CG2 4.02Å; K229-T247 HydrophobicContact CG-CG2 4.29Å; H238-T247 PolarHBondContact NE2-OG1 3.39Å; T247-C249 PolarHBondContact O-N 2.89Å; T247-L250 PolarHBondContact O-N 3.02Å; T247-L251 HydrophobicContact CG2-CD1 4.28Å; T247-L251 HydrophobicContact CG2-CG 4.46Å; T247-L251 WeakPolarHBondContact O-CG 3.39Å; T247-L251 PolarHBondContact O-N 3.42Å
248	Y	97.2	Very high	96	Very high	50 Å²	50	27.7 Å²	27.7	20%	0.196	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-44.4	177.9	-179.9	-111.7	0	0	0	112.3	N207 L211 S246 L250 L251 L252 E364 P365 A371	N207-Y248 HydrophobicContact CB-CE2 4.11Å; N207-Y248 PolarHBondContact ND2-OH 3.44Å; N207-Y248 PolarHBondContact OD1-OH 3.18Å; L211-Y248 HydrophobicContact CD1-CD2 3.77Å; L211-Y248 HydrophobicContact CD1-CE2 3.86Å; S246-Y248 PolarHBondContact O-N 3.3Å; S246-Y248 PolarHBondContact OG-N 3.08Å; Y248-L250 PolarHBondContact O-N 3.31Å; Y248-L251 PolarHBondContact O-N 2.96Å; Y248-L252 HydrophobicContact CD1-CD1 4.14Å; Y248-L252 HydrophobicContact CE1-CD1 3.54Å; Y248-L252 HydrophobicContact CE1-CG 4.27Å; Y248-L252 HydrophobicContact CE2-CD1 4.34Å; Y248-L252 HydrophobicContact CE2-CD2 4.26Å; Y248-L252 HydrophobicContact CE2-CG 4.27Å; Y248-L252 WeakPolarHBondContact O-CG 3.47Å; Y248-L252 PolarHBondContact O-N 3.47Å; Y248-E364 HydrophobicContact CE1-CG 4.35Å; Y248-E364 PolarHBondContact OH-OE1 2.93Å; Y248-P365 WeakPolarHBondContact OH-CD 3.3Å; Y248-A371 HydrophobicContact CD1-CB 4.05Å; Y248-A371 HydrophobicContact CE1-CB 3.78Å
249	C	98	Very high	96	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.7	-44.9	174.8	-70.9	0	0	0	0	112.1	L245 S246 T247 L251 L252 M253 I362 A371	L245-C249 HydrophobicContact CD2-CB 3.89Å; S246-C249 WeakPolarHBondContact O-CB 3.26Å; S246-C249 PolarHBondContact O-N 2.89Å; S246-C249 VanDerWaalsContact O-N 3.09Å; S246-C249 PolarHBondContact OG-N 3.46Å; S246-C249 PolarHBondContact OG-SG 3.02Å; T247-C249 PolarHBondContact O-N 2.89Å; C249-L251 VanDerWaalsContact C-N 3.33Å; C249-L251 PolarHBondContact O-N 2.88Å; C249-L252 PolarHBondContact O-N 2.64Å; C249-M253 VanDerWaalsContact O-CG 3.28Å; C249-M253 WeakPolarHBondContact O-CG 3.35Å; C249-M253 PolarHBondContact O-N 2.8Å; C249-I362 HydrophobicContact CB-CD1 3.75Å; C249-A371 PolarHBondContact SG-O 3.31Å
250	L	98.4	Very high	96.1	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-61.5	-40.1	178	-68.5	170.6	0	0	0	112.2	I228 A232 L245 S246 T247 Y248 M253 L254	I228-L250 HydrophobicContact CG2-CB 4.24Å; I228-L250 HydrophobicContact CG2-CD2 4.11Å; A232-L250 HydrophobicContact CB-CD1 3.47Å; A232-L250 VanDerWaalsContact CB-CD1 3.47Å; A232-L250 HydrophobicContact CB-CD2 4.05Å; A232-L250 HydrophobicContact CB-CG 4.42Å; L245-L250 HydrophobicContact CB-CD2 4.2Å; L245-L250 HydrophobicContact CB-CG 4.18Å; L245-L250 HydrophobicContact CD1-CD2 3.8Å; S246-L250 PolarHBondContact O-N 3.5Å; T247-L250 PolarHBondContact O-N 3.02Å; Y248-L250 PolarHBondContact O-N 3.31Å; L250-M253 WeakPolarHBondContact O-CB 3.41Å; L250-M253 PolarHBondContact O-N 3.37Å; L250-L254 PolarHBondContact O-N 3.09Å
251	L	98.5	Very high	96.3	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-67.2	-40.9	177.2	-66.9	176.8	0	0	0	112	F130 L211 T247 Y248 C249 M253 L254 I255	F130-L251 HydrophobicContact CB-CD1 3.96Å; F130-L251 HydrophobicContact CB-CD2 4.22Å; F130-L251 HydrophobicContact CD1-CD1 4.44Å; F130-L251 HydrophobicContact CD1-CD2 3.46Å; F130-L251 VanDerWaalsContact CD1-CD2 3.46Å; F130-L251 HydrophobicContact CD2-CD1 3.57Å; F130-L251 HydrophobicContact CD2-CD2 4.02Å; F130-L251 HydrophobicContact CD2-CG 4.41Å; F130-L251 HydrophobicContact CE1-CD2 3.67Å; F130-L251 HydrophobicContact CE2-CD1 4.13Å; F130-L251 HydrophobicContact CE2-CD2 4.22Å; F130-L251 HydrophobicContact CG-CD1 3.73Å; F130-L251 HydrophobicContact CG-CD2 3.63Å; F130-L251 HydrophobicContact CG-CG 4.35Å; F130-L251 HydrophobicContact CZ-CD2 4.04Å; L211-L251 HydrophobicContact CD1-CD1 4.14Å; L211-L251 HydrophobicContact CD2-CB 4.43Å; T247-L251 HydrophobicContact CG2-CD1 4.28Å; T247-L251 HydrophobicContact CG2-CG 4.46Å; T247-L251 WeakPolarHBondContact O-CG 3.39Å; T247-L251 PolarHBondContact O-N 3.42Å; Y248-L251 PolarHBondContact O-N 2.96Å; C249-L251 VanDerWaalsContact C-N 3.33Å; C249-L251 PolarHBondContact O-N 2.88Å; L251-M253 VanDerWaalsContact C-N 3.32Å; L251-M253 PolarHBondContact O-N 2.95Å; L251-L254 PolarHBondContact O-N 3.24Å; L251-I255 WeakPolarHBondContact O-CB 3.44Å; L251-I255 VanDerWaalsContact O-CG1 3.27Å; L251-I255 WeakPolarHBondContact O-CG1 3.43Å; L251-I255 PolarHBondContact O-N 3.27Å
252	L	98.5	Very high	96.7	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-63.5	-39.6	173.7	-66.8	-176.2	0	0	0	111.7	Y248 C249 I255 H256 I330 I362 A371	Y248-L252 HydrophobicContact CD1-CD1 4.14Å; Y248-L252 HydrophobicContact CE1-CD1 3.54Å; Y248-L252 HydrophobicContact CE1-CG 4.27Å; Y248-L252 HydrophobicContact CE2-CD1 4.34Å; Y248-L252 HydrophobicContact CE2-CD2 4.26Å; Y248-L252 HydrophobicContact CE2-CG 4.27Å; Y248-L252 WeakPolarHBondContact O-CG 3.47Å; Y248-L252 PolarHBondContact O-N 3.47Å; C249-L252 PolarHBondContact O-N 2.64Å; L252-I255 PolarHBondContact O-N 3.5Å; L252-H256 VanDerWaalsContact O-CB 3.26Å; L252-H256 WeakPolarHBondContact O-CB 3.45Å; L252-H256 PolarHBondContact O-N 3.28Å; L252-I330 HydrophobicContact CD2-CD1 3.6Å; L252-I330 HydrophobicContact CD2-CG1 4.15Å; L252-I330 HydrophobicContact CD2-CG2 4.24Å; L252-I362 HydrophobicContact CB-CG2 3.71Å; L252-I362 HydrophobicContact CD1-CG2 3.54Å; L252-I362 HydrophobicContact CG-CG2 4.3Å; L252-A371 HydrophobicContact CD1-CB 4.14Å
253	M	98.5	Very high	96.9	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-61.6	-43.8	174.1	-73.3	173.6	69.5	0	0	112.2	L245 C249 L250 L251 Y257 F313 Y317 F323 I328 I362 F388	L245-M253 HydrophobicContact CD1-SD 4.39Å; L245-M253 HydrophobicContact CD2-SD 3.89Å; C249-M253 VanDerWaalsContact O-CG 3.28Å; C249-M253 WeakPolarHBondContact O-CG 3.35Å; C249-M253 PolarHBondContact O-N 2.8Å; L250-M253 WeakPolarHBondContact O-CB 3.41Å; L250-M253 PolarHBondContact O-N 3.37Å; L251-M253 VanDerWaalsContact C-N 3.32Å; L251-M253 PolarHBondContact O-N 2.95Å; M253-Y257 PolarHBondContact O-N 3.15Å; M253-F313 HydrophobicContact CB-CE2 4.14Å; M253-F313 HydrophobicContact CB-CZ 4.46Å; M253-Y317 WeakPolarHBondContact CA-OH 3.36Å; M253-Y317 HydrophobicContact CB-CE2 3.97Å; M253-Y317 WeakPolarHBondContact CB-OH 3.38Å; M253-Y317 HydrophobicContact CE-CD1 3.97Å; M253-Y317 HydrophobicContact CE-CD2 3.99Å; M253-Y317 HydrophobicContact CE-CE1 3.93Å; M253-Y317 HydrophobicContact CE-CE2 3.96Å; M253-Y317 HydrophobicContact CE-CG 4Å; M253-Y317 PolarHBondContact O-OH 3.37Å; M253-F323 HydrophobicContact CE-CZ 4.38Å; M253-I328 HydrophobicContact CG-CD1 3.58Å; M253-I328 HydrophobicContact SD-CD1 4.37Å; M253-I362 HydrophobicContact CG-CD1 3.88Å; M253-I362 HydrophobicContact SD-CD1 4.06Å; M253-F388 HydrophobicContact CE-CE2 4.01Å; M253-F388 HydrophobicContact CE-CZ 3.69Å
254	L	98.7	Very high	97.2	Very high	2 Å²	2	19 Å²	19	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-63.4	-50	176.8	172.3	60.4	0	0	0	111	L224 I228 L250 L251 H256 Y257 L258 F313	L224-L254 HydrophobicContact CB-CD1 4.16Å; L224-L254 HydrophobicContact CB-CD2 3.87Å; L224-L254 HydrophobicContact CD1-CD1 4.39Å; I228-L254 HydrophobicContact CD1-CB 4.22Å; I228-L254 HydrophobicContact CD1-CD1 3.66Å; I228-L254 HydrophobicContact CD1-CD2 4.15Å; I228-L254 HydrophobicContact CD1-CG 4.21Å; L250-L254 PolarHBondContact O-N 3.09Å; L251-L254 PolarHBondContact O-N 3.24Å; L254-H256 VanDerWaalsContact C-N 3.31Å; L254-H256 PolarHBondContact O-N 2.85Å; L254-Y257 PolarHBondContact O-N 2.84Å; L254-L258 HydrophobicContact CD1-CD1 3.72Å; L254-L258 HydrophobicContact CD1-CD2 4.41Å; L254-L258 HydrophobicContact CD1-CG 3.84Å; L254-L258 HydrophobicContact CG-CD1 3.95Å; L254-L258 HydrophobicContact CG-CG 4.4Å; L254-L258 WeakPolarHBondContact O-CG 3.44Å; L254-L258 PolarHBondContact O-N 3.16Å; L254-F313 HydrophobicContact CB-CE2 4.39Å; L254-F313 HydrophobicContact CD1-CD2 4.37Å
255	I	98.6	Very high	97.3	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.7	-45.2	-179.6	-68.8	164.6	0	0	0	110.1	L211 Y214 L251 L252 Y257 L258 Q259 L267 I330	L211-I255 HydrophobicContact CD2-CD1 3.33Å; Y214-I255 HydrophobicContact CD1-CG2 4.08Å; Y214-I255 HydrophobicContact CD2-CD1 3.89Å; Y214-I255 HydrophobicContact CD2-CG2 4.42Å; Y214-I255 HydrophobicContact CE1-CG2 3.85Å; Y214-I255 HydrophobicContact CE2-CG2 4.23Å; Y214-I255 HydrophobicContact CG-CD1 3.98Å; Y214-I255 HydrophobicContact CG-CG1 4.4Å; Y214-I255 HydrophobicContact CG-CG2 4.36Å; L251-I255 WeakPolarHBondContact O-CB 3.44Å; L251-I255 VanDerWaalsContact O-CG1 3.27Å; L251-I255 WeakPolarHBondContact O-CG1 3.43Å; L251-I255 PolarHBondContact O-N 3.27Å; L252-I255 PolarHBondContact O-N 3.5Å; I255-Y257 PolarHBondContact O-N 2.89Å; I255-L258 PolarHBondContact O-N 2.81Å; I255-Q259 HydrophobicContact CG2-CG 4.12Å; I255-Q259 WeakPolarHBondContact O-CB 3.33Å; I255-Q259 WeakPolarHBondContact O-CG 3.24Å; I255-Q259 PolarHBondContact O-N 2.85Å; I255-L267 HydrophobicContact CB-CD1 4.27Å; I255-L267 HydrophobicContact CG1-CD1 4.01Å; I255-L267 HydrophobicContact CG2-CD1 4.08Å; I255-I330 HydrophobicContact CB-CG2 3.9Å; I255-I330 HydrophobicContact CG2-CB 3.95Å; I255-I330 HydrophobicContact CG2-CD1 4.48Å; I255-I330 HydrophobicContact CG2-CG2 3.59Å
256	H	98.3	Very high	97.4	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.3	-46.7	176.1	176.2	75.6	0	0	0	112.8	L252 L254 Q259 T260 Y316 Y317 F321 I328 T329 I330	L252-H256 VanDerWaalsContact O-CB 3.26Å; L252-H256 WeakPolarHBondContact O-CB 3.45Å; L252-H256 PolarHBondContact O-N 3.28Å; L254-H256 VanDerWaalsContact C-N 3.31Å; L254-H256 PolarHBondContact O-N 2.85Å; H256-Q259 PolarHBondContact O-N 3.28Å; H256-T260 PolarHBondContact CE1-OG1 2.81Å; H256-T260 WeakPolarHBondContact O-CB 3.47Å; H256-T260 PolarHBondContact O-N 2.98Å; H256-T260 PolarHBondContact O-OG1 3.49Å; H256-Y316 AromaticContact CD2-CE1 3.91Å; H256-Y316 AromaticContact NE2-CZ 4Å; H256-Y316 PolarHBondContact NE2-OH 3.31Å; H256-Y316 VanDerWaalsContact NE2-OH 3.07Å; H256-Y317 PolarHBondContact CD2-OH 3.18Å; H256-F321 AromaticContact NE2-CE2 3.87Å; H256-I328 HydrophobicContact CB-CG2 3.58Å; H256-T329 PolarHBondContact ND1-O 3.07Å; H256-I330 HydrophobicContact CB-CG2 4.27Å
257	Y	98.4	Very high	97.5	Very high	14 Å²	14	20 Å²	20	6%	0.055	11%	0.113	C	C	.	.	H	α-helix	trans	-59.6	-49.3	176.7	163.3	-104.3	0	0	0	111.3	M253 L254 I255 Q259 T260 A261 C262 L309 G312 F313 Y316	M253-Y257 PolarHBondContact O-N 3.15Å; L254-Y257 PolarHBondContact O-N 2.84Å; I255-Y257 PolarHBondContact O-N 2.89Å; Y257-Q259 PolarHBondContact O-N 2.83Å; Y257-T260 PolarHBondContact O-N 3.22Å; Y257-A261 HydrophobicContact CD2-CB 3.81Å; Y257-A261 HydrophobicContact CE2-CB 4.23Å; Y257-A261 PolarHBondContact O-N 3.41Å; Y257-C262 HydrophobicContact CE1-CB 4.13Å; Y257-C262 HydrophobicContact CE2-CB 4.23Å; Y257-C262 PolarHBondContact O-N 3.42Å; Y257-L309 VanDerWaalsContact CE1-O 3.32Å; Y257-L309 WeakPolarHBondContact CE1-O 3.44Å; Y257-G312 WeakPolarHBondContact CE2-O 3.49Å; Y257-G312 VanDerWaalsContact OH-CA 3.3Å; Y257-G312 WeakPolarHBondContact OH-CA 3.48Å; Y257-F313 HydrophobicContact CD1-CB 3.78Å; Y257-F313 HydrophobicContact CD1-CD2 4.13Å; Y257-F313 HydrophobicContact CD1-CG 4.48Å; Y257-F313 HydrophobicContact CE1-CB 3.89Å; Y257-F313 HydrophobicContact CG-CB 4.16Å; Y257-F313 HydrophobicContact CG-CD2 4.13Å; Y257-F313 VanDerWaalsContact CZ-N 3.29Å; Y257-Y316 HydrophobicContact CD2-CD1 4.12Å; Y257-Y316 AromaticContact CD2-CG 3.99Å; Y257-Y316 HydrophobicContact CD2-CG 3.99Å
258	L	98.4	Very high	97.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67	-22.5	-179.4	-67.8	-179.2	0	0	0	113.7	V221 L224 L254 I255 P265 V266 L267 L309	V221-L258 HydrophobicContact CG2-CD1 4.11Å; L224-L258 HydrophobicContact CD1-CD1 4.5Å; L224-L258 HydrophobicContact CD1-CD2 4.41Å; L254-L258 HydrophobicContact CD1-CD1 3.72Å; L254-L258 HydrophobicContact CD1-CD2 4.41Å; L254-L258 HydrophobicContact CD1-CG 3.84Å; L254-L258 HydrophobicContact CG-CD1 3.95Å; L254-L258 HydrophobicContact CG-CG 4.4Å; L254-L258 WeakPolarHBondContact O-CG 3.44Å; L254-L258 PolarHBondContact O-N 3.16Å; I255-L258 PolarHBondContact O-N 2.81Å; L258-P265 CarbonylContact O-C 3.57Å; L258-V266 HydrophobicContact CB-CB 4.14Å; L258-V266 HydrophobicContact CD1-CG1 4.41Å; L258-V266 HydrophobicContact CD2-CB 3.96Å; L258-V266 HydrophobicContact CD2-CG1 4.33Å; L258-V266 HydrophobicContact CD2-CG2 4.05Å; L258-V266 HydrophobicContact CG-CB 4.46Å; L258-V266 PolarHBondContact O-N 3.02Å; L258-L267 HydrophobicContact CB-CB 4.16Å; L258-L267 HydrophobicContact CB-CD1 3.89Å; L258-L267 HydrophobicContact CB-CG 3.93Å; L258-L267 HydrophobicContact CD1-CD1 3.85Å; L258-L267 HydrophobicContact CD1-CG 4.19Å; L258-L267 PolarHBondContact O-N 3.36Å; L258-L267 VanDerWaalsContact O-N 3.1Å; L258-L309 HydrophobicContact CD2-CD1 4.47Å; L258-L309 HydrophobicContact CD2-CD2 4.08Å
259	Q	97.3	Very high	97.5	Very high	11 Å²	11	17.5 Å²	17.5	5%	0.051	10%	0.103	C	C	.	.	H	α-helix	trans	-87.7	-36.8	176.8	-75	176.5	-42.4	0	0	113.6	Y214 I255 H256 Y257 L267 P268 I330	Y214-Q259 PolarHBondContact OH-NE2 3.37Å; I255-Q259 HydrophobicContact CG2-CG 4.12Å; I255-Q259 WeakPolarHBondContact O-CB 3.33Å; I255-Q259 WeakPolarHBondContact O-CG 3.24Å; I255-Q259 PolarHBondContact O-N 2.85Å; H256-Q259 PolarHBondContact O-N 3.28Å; Y257-Q259 PolarHBondContact O-N 2.83Å; Q259-L267 WeakPolarHBondContact CA-O 3.37Å; Q259-L267 HydrophobicContact CG-CB 3.69Å; Q259-L267 WeakPolarHBondContact CG-O 3.49Å; Q259-P268 PolarHBondContact NE2-O 2.73Å; Q259-I330 PolarHBondContact NE2-O 2.54Å; Q259-I330 VanDerWaalsContact OE1-CA 3.3Å; Q259-I330 PolarHBondContact OE1-O 2.81Å
260	T	94.6	Very high	97.5	Very high	27 Å²	27	17.5 Å²	17.5	17%	0.166	10%	0.103	C	C	.	.	H	α-helix	trans	-121.4	-28.5	-161.6	67.9	0	0	0	0	115.2	H256 Y257 N333	H256-T260 PolarHBondContact CE1-OG1 2.81Å; H256-T260 WeakPolarHBondContact O-CB 3.47Å; H256-T260 PolarHBondContact O-N 2.98Å; H256-T260 PolarHBondContact O-OG1 3.49Å; Y257-T260 PolarHBondContact O-N 3.22Å; T260-N333 VanDerWaalsContact CG2-C 3.42Å; T260-N333 WeakPolarHBondContact CG2-O 2.96Å
261	A	95.3	Very high	97.3	Very high	27 Å²	27	18.4 Å²	18.4	22%	0.223	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-31.6	-172.2	0	0	0	0	0	112.8	Y257 I263 Y316	Y257-A261 HydrophobicContact CD2-CB 3.81Å; Y257-A261 HydrophobicContact CE2-CB 4.23Å; Y257-A261 PolarHBondContact O-N 3.41Å; A261-I263 PolarHBondContact O-N 3.04Å; A261-Y316 HydrophobicContact CB-CD1 4.33Å; A261-Y316 HydrophobicContact CB-CD2 3.37Å; A261-Y316 HydrophobicContact CB-CE1 4.28Å; A261-Y316 HydrophobicContact CB-CE2 3.31Å; A261-Y316 HydrophobicContact CB-CG 3.88Å
262	C	96	Very high	97.2	Very high	4 Å²	4	23.7 Å²	23.7	3%	0.027	13%	0.132	C	C	.	.	S	Bend	trans	-72.2	121.5	169.9	-172.4	0	0	0	0	109.4	Y257 P264 P265 N302 L309	Y257-C262 HydrophobicContact CE1-CB 4.13Å; Y257-C262 HydrophobicContact CE2-CB 4.23Å; Y257-C262 PolarHBondContact O-N 3.42Å; C262-P264 CarbonylContact C-O 3.45Å; C262-P264 CarbonylContact O-C 3.46Å; C262-P265 WeakPolarHBondContact O-CA 3.29Å; C262-N302 PolarHBondContact SG-ND2 2.76Å; C262-L309 WeakPolarHBondContact SG-CD2 3.03Å
263	I	95.6	Very high	97	Very high	130 Å²	130	29.3 Å²	29.3	67%	0.667	16%	0.156	S	C	*	.	S	Bend	trans	-121.5	125.3	-178.8	-57.4	-62.3	0	0	0	109.7	A261	A261-I263 PolarHBondContact O-N 3.04Å
264	P	96.9	Very high	96.9	Very high	50 Å²	50	31.1 Å²	31.1	33%	0.325	16%	0.164	S	C	.	.	S	Bend	cis	-60.1	155.3	-9.1	-20.6	33	0	0	0	112.4	C262 V266 T301 N302	C262-P264 CarbonylContact C-O 3.45Å; C262-P264 CarbonylContact O-C 3.46Å; P264-V266 PolarHBondContact O-N 3.46Å; P264-T301 WeakPolarHBondContact CB-OG1 3.31Å; P264-N302 HydrophobicContact CB-CB 4.25Å; P264-N302 VanDerWaalsContact O-CB 3.29Å; P264-N302 WeakPolarHBondContact O-CB 3.38Å; P264-N302 PolarHBondContact O-ND2 2.91Å
265	P	97.3	Very high	96.7	Very high	61 Å²	61	34.3 Å²	34.3	40%	0.396	19%	0.185	S	C	.	.			trans	-65.8	133.3	-179.8	26.6	-34.3	0	0	0	111.4	L258 C262 S300	L258-P265 CarbonylContact O-C 3.57Å; C262-P265 WeakPolarHBondContact O-CA 3.29Å; P265-S300 WeakPolarHBondContact O-CB 3.33Å; P265-S300 PolarHBondContact O-OG 2.87Å
266	V	98.2	Very high	96.4	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	22%	0.218	C	C	.	.	S	Bend	trans	-78	-34	175	174.3	0	0	0	0	110.8	D218 L258 P264 S300 N302 L309	D218-V266 HydrophobicContact CB-CG1 3.93Å; L258-V266 HydrophobicContact CB-CB 4.14Å; L258-V266 HydrophobicContact CD1-CG1 4.41Å; L258-V266 HydrophobicContact CD2-CB 3.96Å; L258-V266 HydrophobicContact CD2-CG1 4.33Å; L258-V266 HydrophobicContact CD2-CG2 4.05Å; L258-V266 HydrophobicContact CG-CB 4.46Å; L258-V266 PolarHBondContact O-N 3.02Å; P264-V266 PolarHBondContact O-N 3.46Å; V266-S300 WeakPolarHBondContact CA-OG 3.1Å; V266-N302 HydrophobicContact CG2-CB 3.81Å; V266-L309 HydrophobicContact CG2-CD1 4.29Å; V266-L309 HydrophobicContact CG2-CD2 3.9Å
267	L	98	Very high	96.1	Very high	3 Å²	3	44 Å²	44	2%	0.016	23%	0.234	C	C	.	.	S	Bend	trans	-117.9	139.7	-178.5	-72	-179.2	0	0	0	111.5	Y214 V217 V221 I255 L258 Q259	Y214-L267 HydrophobicContact CD1-CD1 3.96Å; Y214-L267 HydrophobicContact CD1-CD2 4.21Å; Y214-L267 HydrophobicContact CD1-CG 4.49Å; V217-L267 HydrophobicContact CB-CD2 3.65Å; V217-L267 HydrophobicContact CG1-CD2 3.63Å; V217-L267 HydrophobicContact CG2-CD2 4.35Å; V221-L267 HydrophobicContact CG2-CD1 4.13Å; V221-L267 HydrophobicContact CG2-CD2 3.75Å; V221-L267 HydrophobicContact CG2-CG 4.13Å; I255-L267 HydrophobicContact CB-CD1 4.27Å; I255-L267 HydrophobicContact CG1-CD1 4.01Å; I255-L267 HydrophobicContact CG2-CD1 4.08Å; L258-L267 HydrophobicContact CB-CB 4.16Å; L258-L267 HydrophobicContact CB-CD1 3.89Å; L258-L267 HydrophobicContact CB-CG 3.93Å; L258-L267 HydrophobicContact CD1-CD1 3.85Å; L258-L267 HydrophobicContact CD1-CG 4.19Å; L258-L267 PolarHBondContact O-N 3.36Å; L258-L267 VanDerWaalsContact O-N 3.1Å; Q259-L267 WeakPolarHBondContact CA-O 3.37Å; Q259-L267 HydrophobicContact CG-CB 3.69Å; Q259-L267 WeakPolarHBondContact CG-O 3.49Å
268	P	97	Very high	95.9	Very high	21 Å²	21	43.8 Å²	43.8	14%	0.136	23%	0.233	C	C	.	.			trans	-83.3	172.1	169.2	34.9	-32.9	0	0	0	111.1	Y214 V217 Q259 L270 K273 L298	Y214-P268 WeakPolarHBondContact CE1-O 3.39Å; V217-P268 HydrophobicContact CG1-CG 4.33Å; Q259-P268 PolarHBondContact NE2-O 2.73Å; P268-L270 HydrophobicContact CG-CD2 4.03Å; P268-L270 PolarHBondContact O-N 3.39Å; P268-K273 HydrophobicContact CB-CD 3.85Å; P268-K273 HydrophobicContact CG-CD 4.5Å; P268-L298 HydrophobicContact CB-CD2 4.5Å; P268-L298 HydrophobicContact CG-CB 4.46Å; P268-L298 HydrophobicContact CG-CD2 3.94Å
269	N	97	Very high	95.4	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.027	25%	0.247	C	C	.	.			trans	-82.5	103.5	163.5	-177.2	-6.3	0	0	0	110.7	Q271 E272 K273 R331 N333	N269-Q271 PolarHBondContact OD1-N 3.27Å; N269-E272 HydrophobicContact CB-CB 3.95Å; N269-E272 VanDerWaalsContact CG-CB 3.41Å; N269-E272 VanDerWaalsContact ND2-CB 3.29Å; N269-E272 WeakPolarHBondContact ND2-CB 3.39Å; N269-E272 PolarHBondContact ND2-OE2 2.83Å; N269-E272 PolarHBondContact O-N 3.2Å; N269-E272 PolarHBondContact OD1-N 3.49Å; N269-K273 WeakPolarHBondContact O-CB 3.38Å; N269-K273 PolarHBondContact O-N 2.81Å; N269-R331 VanDerWaalsContact ND2-C 3.34Å; N269-R331 PolarHBondContact ND2-O 3.47Å; N269-N333 WeakPolarHBondContact CB-OD1 3.23Å
270	L	97	Very high	95	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.1	-37.2	-177.3	-70.9	-176.2	0	0	0	112.4	L210 M213 Y214 V217 P268 E272 K273 F274 F278 L293 L298	L210-L270 HydrophobicContact CD1-CB 4.24Å; M213-L270 HydrophobicContact CB-CD1 3.85Å; Y214-L270 HydrophobicContact CD1-CD1 3.66Å; Y214-L270 HydrophobicContact CD1-CG 4.01Å; Y214-L270 HydrophobicContact CD2-CD1 3.97Å; Y214-L270 HydrophobicContact CE1-CB 4.21Å; Y214-L270 HydrophobicContact CE1-CD1 3.76Å; Y214-L270 HydrophobicContact CE1-CG 3.63Å; Y214-L270 HydrophobicContact CE2-CB 4.34Å; Y214-L270 HydrophobicContact CE2-CD1 4.04Å; Y214-L270 HydrophobicContact CE2-CG 4.37Å; Y214-L270 HydrophobicContact CG-CD1 3.77Å; Y214-L270 PolarHBondContact OH-N 3.02Å; V217-L270 HydrophobicContact CG2-CD1 4.21Å; V217-L270 HydrophobicContact CG2-CD2 4.15Å; P268-L270 HydrophobicContact CG-CD2 4.03Å; P268-L270 PolarHBondContact O-N 3.39Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.95Å; L270-K273 PolarHBondContact O-N 3.04Å; L270-F274 HydrophobicContact CD2-CD2 4.08Å; L270-F274 HydrophobicContact CD2-CE2 4.03Å; L270-F274 PolarHBondContact O-N 2.93Å; L270-F278 HydrophobicContact CB-CD2 3.99Å; L270-F278 HydrophobicContact CB-CE2 3.64Å; L270-F278 HydrophobicContact CB-CZ 4.15Å; L270-F278 HydrophobicContact CD1-CE2 4.34Å; L270-F278 HydrophobicContact CD1-CZ 4.06Å; L270-F278 HydrophobicContact CG-CE2 4.4Å; L270-F278 VanDerWaalsContact O-CD2 3.31Å; L270-F278 WeakPolarHBondContact O-CD2 3.38Å; L270-L293 HydrophobicContact CD2-CD1 3.9Å; L270-L298 HydrophobicContact CD2-CD1 4.11Å
271	Q	95.9	Very high	94.7	Very high	24 Å²	24	54.2 Å²	54.2	11%	0.112	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-33.3	178.9	-68.9	-176.1	-91.2	0	0	112.1	L210 N269 P275 F278 P365	L210-Q271 HydrophobicContact CD1-CG 4.18Å; L210-Q271 HydrophobicContact CD2-CG 4.32Å; N269-Q271 PolarHBondContact OD1-N 3.27Å; Q271-P275 WeakPolarHBondContact O-CA 3.28Å; Q271-F278 HydrophobicContact CG-CB 3.88Å; Q271-P365 PolarHBondContact NE2-O 3.08Å
272	E	95.1	Very high	94.4	Very high	114 Å²	114	54.4 Å²	54.4	53%	0.533	28%	0.283	S	S	.	.	H	α-helix	trans	-76.4	-42	175.1	178.9	-179.2	-176.3	0	0	112.6	N269 L270 N333	N269-E272 HydrophobicContact CB-CB 3.95Å; N269-E272 VanDerWaalsContact CG-CB 3.41Å; N269-E272 VanDerWaalsContact ND2-CB 3.29Å; N269-E272 WeakPolarHBondContact ND2-CB 3.39Å; N269-E272 PolarHBondContact ND2-OE2 2.83Å; N269-E272 PolarHBondContact O-N 3.2Å; N269-E272 PolarHBondContact OD1-N 3.49Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.95Å; E272-N333 PolarHBondContact OE2-ND2 3.45Å
273	K	95.3	Very high	94.1	Very high	120 Å²	120	56 Å²	56	52%	0.522	29%	0.294	S	S	.	.	H	α-helix	trans	-72.4	-33.5	179.7	-77.4	-175.3	175.1	-83.5	0	113.4	P268 N269 L270 L298	P268-K273 HydrophobicContact CB-CD 3.85Å; P268-K273 HydrophobicContact CG-CD 4.5Å; N269-K273 WeakPolarHBondContact O-CB 3.38Å; N269-K273 PolarHBondContact O-N 2.81Å; L270-K273 PolarHBondContact O-N 3.04Å; K273-L298 HydrophobicContact CD-CD2 3.75Å
274	F	95.5	Very high	93.8	Very high	39 Å²	39	51.1 Å²	51.1	17%	0.171	27%	0.27	C	S	.	.			trans	-133.7	61.6	-174.2	-49.8	-74.9	0	0	0	111.5	L270 E276 V277 F278 L293 P294 L298	L270-F274 HydrophobicContact CD2-CD2 4.08Å; L270-F274 HydrophobicContact CD2-CE2 4.03Å; L270-F274 PolarHBondContact O-N 2.93Å; F274-E276 PolarHBondContact O-N 2.82Å; F274-V277 HydrophobicContact CB-CB 4Å; F274-V277 HydrophobicContact CB-CG2 4.05Å; F274-V277 PolarHBondContact O-N 3.05Å; F274-F278 HydrophobicContact CB-CD2 3.93Å; F274-F278 HydrophobicContact CB-CE2 3.91Å; F274-F278 HydrophobicContact CD2-CE2 4.19Å; F274-F278 HydrophobicContact CG-CE2 4.48Å; F274-F278 WeakPolarHBondContact O-CD2 3.46Å; F274-F278 PolarHBondContact O-N 3.13Å; F274-F278 VanDerWaalsContact O-N 3.11Å; F274-L293 HydrophobicContact CD1-CD2 4.3Å; F274-L293 HydrophobicContact CD2-CD1 4.15Å; F274-L293 HydrophobicContact CD2-CD2 4.09Å; F274-L293 HydrophobicContact CE2-CD1 4.12Å; F274-L293 HydrophobicContact CE2-CD2 4.33Å; F274-L293 HydrophobicContact CG-CD2 4.08Å; F274-P294 HydrophobicContact CE1-CG 3.75Å; F274-P294 HydrophobicContact CZ-CG 3.62Å; F274-L298 HydrophobicContact CE2-CD1 3.9Å; F274-L298 HydrophobicContact CE2-CD2 3.75Å; F274-L298 HydrophobicContact CE2-CG 4.39Å; F274-L298 HydrophobicContact CZ-CD1 4.23Å; F274-L298 HydrophobicContact CZ-CD2 3.91Å; F274-L298 HydrophobicContact CZ-CG 4.45Å
275	P	94.3	Very high	93.4	Very high	69 Å²	69	56.1 Å²	56.1	45%	0.448	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.4	-177.8	23.2	-33.6	0	0	0	111.7	Q271 V277 F278 N279	Q271-P275 WeakPolarHBondContact O-CA 3.28Å; P275-V277 PolarHBondContact O-N 3.26Å; P275-F278 CarbonylContact O-C 3.6Å; P275-F278 PolarHBondContact O-N 3.09Å; P275-N279 VanDerWaalsContact O-CB 3.22Å; P275-N279 WeakPolarHBondContact O-CB 3.22Å; P275-N279 PolarHBondContact O-N 3.46Å; P275-N279 VanDerWaalsContact O-N 3.14Å
276	E	92.4	Very high	93	Very high	151 Å²	151	58.5 Å²	58.5	71%	0.706	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.9	178.7	-56.6	-53.4	149.5	0	0	114.5	F274 I282	F274-E276 PolarHBondContact O-N 2.82Å; E276-I282 WeakPolarHBondContact O-CD1 3.37Å
277	V	93.5	Very high	92.7	Very high	53 Å²	53	59.7 Å²	59.7	32%	0.321	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-33.9	177.8	178.5	0	0	0	0	110.9	F274 P275 I282 L293	F274-V277 HydrophobicContact CB-CB 4Å; F274-V277 HydrophobicContact CB-CG2 4.05Å; F274-V277 PolarHBondContact O-N 3.05Å; P275-V277 PolarHBondContact O-N 3.26Å; V277-I282 WeakPolarHBondContact O-CD1 3.46Å; V277-L293 HydrophobicContact CG1-CD2 4.39Å; V277-L293 HydrophobicContact CG2-CD2 4.46Å
278	F	94	Very high	92.3	Very high	9 Å²	9	63.9 Å²	63.9	4%	0.039	32%	0.318	C	S	.	.	S	Bend	trans	-111.7	40.7	-176.2	-55.2	-70.3	0	0	0	112.2	H209 L210 M213 L270 Q271 F274 P275 L293	H209-F278 AromaticContact CE1-CD1 3.93Å; H209-F278 AromaticContact CE1-CE1 3.65Å; H209-F278 AromaticContact ND1-CD1 3.87Å; H209-F278 AromaticContact ND1-CE1 3.84Å; L210-F278 HydrophobicContact CB-CD1 4.35Å; L210-F278 HydrophobicContact CD1-CB 4.47Å; L210-F278 HydrophobicContact CD1-CD1 3.52Å; L210-F278 HydrophobicContact CD1-CE1 3.79Å; L210-F278 HydrophobicContact CD1-CG 3.91Å; L210-F278 HydrophobicContact CD1-CZ 4.4Å; M213-F278 HydrophobicContact CB-CE1 3.86Å; M213-F278 HydrophobicContact CB-CZ 3.65Å; M213-F278 HydrophobicContact CG-CE1 3.69Å; M213-F278 HydrophobicContact CG-CZ 3.69Å; L270-F278 HydrophobicContact CB-CD2 3.99Å; L270-F278 HydrophobicContact CB-CE2 3.64Å; L270-F278 HydrophobicContact CB-CZ 4.15Å; L270-F278 HydrophobicContact CD1-CE2 4.34Å; L270-F278 HydrophobicContact CD1-CZ 4.06Å; L270-F278 HydrophobicContact CG-CE2 4.4Å; L270-F278 VanDerWaalsContact O-CD2 3.31Å; L270-F278 WeakPolarHBondContact O-CD2 3.38Å; Q271-F278 HydrophobicContact CG-CB 3.88Å; F274-F278 HydrophobicContact CB-CD2 3.93Å; F274-F278 HydrophobicContact CB-CE2 3.91Å; F274-F278 HydrophobicContact CD2-CE2 4.19Å; F274-F278 HydrophobicContact CG-CE2 4.48Å; F274-F278 WeakPolarHBondContact O-CD2 3.46Å; F274-F278 PolarHBondContact O-N 3.13Å; F274-F278 VanDerWaalsContact O-N 3.11Å; P275-F278 CarbonylContact O-C 3.6Å; P275-F278 PolarHBondContact O-N 3.09Å; F278-L293 HydrophobicContact CE2-CD1 4.21Å; F278-L293 HydrophobicContact CZ-CD1 4.05Å
279	N	87.7	Confident	91.9	Very high	54 Å²	54	64.9 Å²	64.9	29%	0.289	32%	0.321	S	S	.	.			trans	-97.8	135.1	175	-176.5	0.3	0	0	0	111	P275 T281 I282	P275-N279 VanDerWaalsContact O-CB 3.22Å; P275-N279 WeakPolarHBondContact O-CB 3.22Å; P275-N279 PolarHBondContact O-N 3.46Å; P275-N279 VanDerWaalsContact O-N 3.14Å; N279-T281 VanDerWaalsContact CG-OG1 3.22Å; N279-T281 PolarHBondContact ND2-OG1 2.7Å; N279-T281 PolarHBondContact O-N 2.93Å; N279-T281 WeakPolarHBondContact OD1-CG2 3.26Å; N279-T281 PolarHBondContact OD1-N 3.5Å; N279-T281 PolarHBondContact OD1-OG1 2.89Å; N279-I282 HydrophobicContact CB-CD1 4.34Å; N279-I282 HydrophobicContact CB-CG1 4.3Å; N279-I282 PolarHBondContact O-N 3.35Å
280	Y	88.6	Confident	91.5	Very high	92 Å²	92	68.8 Å²	68.8	36%	0.361	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-12.4	176.8	-163.8	-102.8	0	0	0	113.5	I203 Y206 F366	I203-Y280 HydrophobicContact CG1-CE2 3.81Å; I203-Y280 WeakPolarHBondContact CG1-OH 3.44Å; Y206-Y280 HydrophobicContact CD1-CD2 4.28Å; Y206-Y280 AromaticContact CD2-CD2 3.48Å; Y206-Y280 HydrophobicContact CD2-CD2 3.48Å; Y206-Y280 VanDerWaalsContact CD2-CD2 3.48Å; Y206-Y280 AromaticContact CD2-CE2 3.29Å; Y206-Y280 HydrophobicContact CD2-CE2 3.29Å; Y206-Y280 HydrophobicContact CE1-CD2 4.42Å; Y206-Y280 AromaticContact CE2-CD2 3.62Å; Y206-Y280 HydrophobicContact CE2-CD2 3.62Å; Y206-Y280 AromaticContact CE2-CE2 3.39Å; Y206-Y280 HydrophobicContact CE2-CE2 3.39Å; Y206-Y280 HydrophobicContact CE2-CG 4.41Å; Y206-Y280 AromaticContact CE2-CZ 4Å; Y206-Y280 AromaticContact CG-CD2 3.83Å; Y206-Y280 HydrophobicContact CG-CD2 3.83Å; Y206-Y280 HydrophobicContact CG-CE2 4.09Å; Y206-Y280 PolarHBondContact OH-O 2.86Å; Y280-F366 HydrophobicContact CD2-CB 3.81Å; Y280-F366 HydrophobicContact CD2-CD1 4Å; Y280-F366 HydrophobicContact CD2-CG 4.08Å; Y280-F366 HydrophobicContact CE2-CB 4.32Å
281	T	87.5	Confident	90.9	Very high	111 Å²	111	69.4 Å²	69.4	68%	0.681	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-13.5	176.9	68.9	0	0	0	0	113.9	N279	N279-T281 VanDerWaalsContact CG-OG1 3.22Å; N279-T281 PolarHBondContact ND2-OG1 2.7Å; N279-T281 PolarHBondContact O-N 2.93Å; N279-T281 WeakPolarHBondContact OD1-CG2 3.26Å; N279-T281 PolarHBondContact OD1-N 3.5Å; N279-T281 PolarHBondContact OD1-OG1 2.89Å
282	I	88.6	Confident	90.6	Very high	32 Å²	32	75.2 Å²	75.2	16%	0.164	38%	0.376	C	S	.	.	S	Bend	trans	-66.3	127.1	177.6	-59.8	169.6	0	0	0	108.3	Y206 E276 V277 N279 E286 L287	Y206-I282 WeakPolarHBondContact CE1-O 3.46Å; Y206-I282 PolarHBondContact OH-O 2.93Å; E276-I282 WeakPolarHBondContact O-CD1 3.37Å; V277-I282 WeakPolarHBondContact O-CD1 3.46Å; N279-I282 HydrophobicContact CB-CD1 4.34Å; N279-I282 HydrophobicContact CB-CG1 4.3Å; N279-I282 PolarHBondContact O-N 3.35Å; I282-E286 HydrophobicContact CG2-CB 3.85Å; I282-L287 HydrophobicContact CG2-CD2 4.32Å
283	P	90.5	Very high	90.6	Very high	38 Å²	38	70.5 Å²	70.5	25%	0.247	35%	0.354	C	S	.	.			trans	-56.8	139.2	177	-25.2	34.4	0	0	0	111.9	Y285 E286	P283-Y285 HydrophobicContact CB-CD1 3.92Å; P283-Y285 HydrophobicContact CB-CE1 3.34Å; P283-Y285 HydrophobicContact CB-CE2 4.02Å; P283-Y285 HydrophobicContact CB-CG 4.46Å; P283-Y285 WeakPolarHBondContact CB-OH 3.48Å; P283-Y285 HydrophobicContact CG-CE1 4.33Å; P283-Y285 PolarHBondContact O-N 3.44Å; P283-E286 HydrophobicContact CB-CG 4.25Å; P283-E286 HydrophobicContact CG-CG 4.48Å; P283-E286 WeakPolarHBondContact O-CB 3.46Å; P283-E286 PolarHBondContact O-N 3.05Å
284	P	89.9	Confident	90.6	Very high	26 Å²	26	67 Å²	67	17%	0.169	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-59.1	-26.9	-172.9	-28.2	36	0	0	0	115.3	L142 V202 L205 E286 L287	L142-P284 HydrophobicContact CD1-CB 3.53Å; L142-P284 HydrophobicContact CD1-CG 3.96Å; V202-P284 HydrophobicContact CG1-CB 3.95Å; V202-P284 HydrophobicContact CG1-CG 3.15Å; L205-P284 HydrophobicContact CD2-CB 4.16Å; P284-E286 VanDerWaalsContact C-N 3.26Å; P284-E286 PolarHBondContact O-N 3.48Å; P284-L287 PolarHBondContact O-N 3.3Å
285	Y	87.4	Confident	90.5	Very high	156 Å²	156	67.8 Å²	67.8	61%	0.612	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-76.8	-11.2	177.5	59.8	-98.9	0	0	0	113.4	Y121 P283	Y121-Y285 WeakPolarHBondContact OH-CB 3.37Å; P283-Y285 HydrophobicContact CB-CD1 3.92Å; P283-Y285 HydrophobicContact CB-CE1 3.34Å; P283-Y285 HydrophobicContact CB-CE2 4.02Å; P283-Y285 HydrophobicContact CB-CG 4.46Å; P283-Y285 WeakPolarHBondContact CB-OH 3.48Å; P283-Y285 HydrophobicContact CG-CE1 4.33Å; P283-Y285 PolarHBondContact O-N 3.44Å
286	E	90.7	Very high	90.4	Very high	110 Å²	110	71.9 Å²	71.9	51%	0.514	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-95.4	-4.2	175.5	-60.2	178.6	-165.8	0	0	112.2	I282 P283 P284 D288	I282-E286 HydrophobicContact CG2-CB 3.85Å; P283-E286 HydrophobicContact CB-CG 4.25Å; P283-E286 HydrophobicContact CG-CG 4.48Å; P283-E286 WeakPolarHBondContact O-CB 3.46Å; P283-E286 PolarHBondContact O-N 3.05Å; P284-E286 VanDerWaalsContact C-N 3.26Å; P284-E286 PolarHBondContact O-N 3.48Å; E286-D288 PolarHBondContact O-N 3.2Å; E286-D288 VanDerWaalsContact O-N 3.09Å
287	L	91.2	Very high	90.5	Very high	27 Å²	27	72.2 Å²	72.2	14%	0.141	37%	0.365	C	S	.	.			trans	-66.2	109.7	176.1	-66.6	176.9	0	0	0	110.5	L205 Y206 I282 P284 M289	L205-L287 HydrophobicContact CB-CD1 3.82Å; Y206-L287 HydrophobicContact CD1-CD1 3.96Å; Y206-L287 HydrophobicContact CD1-CD2 3.9Å; Y206-L287 HydrophobicContact CD1-CG 4.5Å; Y206-L287 HydrophobicContact CE1-CD1 4.09Å; Y206-L287 HydrophobicContact CE1-CD2 3.95Å; Y206-L287 HydrophobicContact CE1-CG 4.39Å; Y206-L287 HydrophobicContact CG-CD1 4.35Å; I282-L287 HydrophobicContact CG2-CD2 4.32Å; P284-L287 PolarHBondContact O-N 3.3Å; L287-M289 PolarHBondContact O-N 3.31Å
288	D	90.3	Very high	90.5	Very high	90 Å²	90	70.2 Å²	70.2	48%	0.481	35%	0.353	S	S	.	.			trans	-88.9	97.6	178.9	-174.9	8.5	0	0	0	111.8	H209 M213 E286 N290 G291	H209-D288 PolarHBondContact NE2-O 3.26Å; M213-D288 WeakPolarHBondContact CE-O 3.47Å; E286-D288 PolarHBondContact O-N 3.2Å; E286-D288 VanDerWaalsContact O-N 3.09Å; D288-N290 PolarHBondContact O-N 2.64Å; D288-N290 VanDerWaalsContact O-N 3.15Å; D288-N290 WeakPolarHBondContact OD1-CA 3.34Å; D288-N290 WeakPolarHBondContact OD1-CB 3.27Å; D288-N290 PolarHBondContact OD1-N 3.14Å; D288-G291 PolarHBondContact O-N 3.4Å; D288-G291 PolarHBondContact OD1-N 2.92Å; D288-G291 VanDerWaalsContact OD2-CA 3.27Å; D288-G291 WeakPolarHBondContact OD2-CA 3.49Å; D288-G291 PolarHBondContact OD2-N 3.39Å
289	M	88.5	Confident	90.5	Very high	42 Å²	42	77.9 Å²	77.9	21%	0.207	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.2	174.1	-65.3	-58.6	-59.3	0	0	113.5	I127 T208 H209 A212 M213 K216 L287	I127-M289 HydrophobicContact CB-CE 4.44Å; I127-M289 HydrophobicContact CD1-CB 4.32Å; I127-M289 HydrophobicContact CD1-CE 4.16Å; I127-M289 HydrophobicContact CD1-CG 4.09Å; I127-M289 HydrophobicContact CG1-CE 3.91Å; I127-M289 HydrophobicContact CG2-CE 3.98Å; T208-M289 HydrophobicContact CG2-CE 4Å; H209-M289 HydrophobicContact CB-SD 3.91Å; A212-M289 HydrophobicContact CB-CE 3.47Å; A212-M289 VanDerWaalsContact CB-CE 3.47Å; M213-M289 WeakPolarHBondContact CE-O 3.32Å; K216-M289 PolarHBondContact NZ-O 2.9Å; L287-M289 PolarHBondContact O-N 3.31Å
290	N	87	Confident	90.8	Very high	87 Å²	87	76.2 Å²	76.2	47%	0.465	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	6.7	175.9	-63.3	-41	0	0	0	112.9	D288 Q292	D288-N290 PolarHBondContact O-N 2.64Å; D288-N290 VanDerWaalsContact O-N 3.15Å; D288-N290 WeakPolarHBondContact OD1-CA 3.34Å; D288-N290 WeakPolarHBondContact OD1-CB 3.27Å; D288-N290 PolarHBondContact OD1-N 3.14Å; N290-Q292 PolarHBondContact O-N 2.98Å; N290-Q292 PolarHBondContact O-NE2 3.28Å
291	G	85.6	Confident	91.3	Very high	14 Å²	14	76.6 Å²	76.6	14%	0.144	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-48.7	137.2	179.6	0	0	0	0	0	111.4	D288	D288-G291 PolarHBondContact O-N 3.4Å; D288-G291 PolarHBondContact OD1-N 2.92Å; D288-G291 VanDerWaalsContact OD2-CA 3.27Å; D288-G291 WeakPolarHBondContact OD2-CA 3.49Å; D288-G291 PolarHBondContact OD2-N 3.39Å
292	Q	89.6	Confident	91.8	Very high	145 Å²	145	71.5 Å²	71.5	68%	0.678	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-99.2	126.6	175.8	-60.1	-59.9	-53.3	0	0	108.4	N290	N290-Q292 PolarHBondContact O-N 2.98Å; N290-Q292 PolarHBondContact O-NE2 3.28Å
293	L	93.8	Very high	92.1	Very high	16 Å²	16	79.2 Å²	79.2	8%	0.084	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-97.4	165.9	164.5	-63	-178.8	0	0	0	108.3	M213 L270 F274 V277 F278 W295 L298	M213-L293 HydrophobicContact CB-CD1 4.32Å; L270-L293 HydrophobicContact CD2-CD1 3.9Å; F274-L293 HydrophobicContact CD1-CD2 4.3Å; F274-L293 HydrophobicContact CD2-CD1 4.15Å; F274-L293 HydrophobicContact CD2-CD2 4.09Å; F274-L293 HydrophobicContact CE2-CD1 4.12Å; F274-L293 HydrophobicContact CE2-CD2 4.33Å; F274-L293 HydrophobicContact CG-CD2 4.08Å; V277-L293 HydrophobicContact CG1-CD2 4.39Å; V277-L293 HydrophobicContact CG2-CD2 4.46Å; F278-L293 HydrophobicContact CE2-CD1 4.21Å; F278-L293 HydrophobicContact CZ-CD1 4.05Å; L293-W295 HydrophobicContact CB-CD2 4.14Å; L293-W295 HydrophobicContact CB-CE3 3.99Å; L293-W295 HydrophobicContact CB-CH2 3.84Å; L293-W295 HydrophobicContact CB-CZ2 4.01Å; L293-W295 HydrophobicContact CB-CZ3 3.85Å; L293-W295 HydrophobicContact CD1-CH2 3.89Å; L293-W295 HydrophobicContact CD1-CZ3 3.87Å; L293-W295 HydrophobicContact CG-CH2 3.84Å; L293-W295 HydrophobicContact CG-CZ2 4.25Å; L293-W295 HydrophobicContact CG-CZ3 4.14Å; L293-W295 PolarHBondContact O-N 3.34Å; L293-W295 PolarHBondContact O-NE1 2.88Å; L293-L298 HydrophobicContact CB-CD1 3.89Å; L293-L298 HydrophobicContact CD1-CD1 4.05Å
294	P	95.1	Very high	92.5	Very high	46 Å²	46	80 Å²	80	30%	0.299	39%	0.394	S	S	.	.			trans	-68.3	72	171	29.8	-36.7	0	0	0	110.6	F274 N296 E297 L298	F274-P294 HydrophobicContact CE1-CG 3.75Å; F274-P294 HydrophobicContact CZ-CG 3.62Å; P294-N296 PolarHBondContact O-N 3.33Å; P294-N296 VanDerWaalsContact O-N 3.09Å; P294-E297 HydrophobicContact CB-CB 4.25Å; P294-E297 HydrophobicContact CB-CG 4.13Å; P294-E297 WeakPolarHBondContact O-CB 3.22Å; P294-E297 PolarHBondContact O-N 2.8Å; P294-L298 PolarHBondContact O-N 3.48Å
295	W	94.2	Very high	92.8	Very high	56 Å²	56	80.5 Å²	80.5	21%	0.212	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-55.3	-35.2	-169.8	-56.4	117.2	0	0	0	113.1	M213 K216 V217 L293 E297 L298 K299	M213-W295 HydrophobicContact SD-CH2 3.8Å; M213-W295 HydrophobicContact SD-CZ2 4.3Å; K216-W295 HydrophobicContact CB-CE3 4.34Å; K216-W295 HydrophobicContact CB-CH2 3.64Å; K216-W295 HydrophobicContact CB-CZ2 4.18Å; K216-W295 HydrophobicContact CB-CZ3 3.72Å; K216-W295 HydrophobicContact CD-CH2 3.81Å; K216-W295 HydrophobicContact CD-CZ2 3.85Å; K216-W295 HydrophobicContact CG-CH2 4.41Å; V217-W295 HydrophobicContact CG2-CZ3 4.21Å; L293-W295 HydrophobicContact CB-CD2 4.14Å; L293-W295 HydrophobicContact CB-CE3 3.99Å; L293-W295 HydrophobicContact CB-CH2 3.84Å; L293-W295 HydrophobicContact CB-CZ2 4.01Å; L293-W295 HydrophobicContact CB-CZ3 3.85Å; L293-W295 HydrophobicContact CD1-CH2 3.89Å; L293-W295 HydrophobicContact CD1-CZ3 3.87Å; L293-W295 HydrophobicContact CG-CH2 3.84Å; L293-W295 HydrophobicContact CG-CZ2 4.25Å; L293-W295 HydrophobicContact CG-CZ3 4.14Å; L293-W295 PolarHBondContact O-N 3.34Å; L293-W295 PolarHBondContact O-NE1 2.88Å; W295-E297 VanDerWaalsContact C-N 3.29Å; W295-E297 PolarHBondContact O-N 3.46Å; W295-L298 HydrophobicContact CE3-CD1 4.17Å; W295-L298 HydrophobicContact CZ3-CD1 4.42Å; W295-L298 PolarHBondContact O-N 3.13Å; W295-K299 PolarHBondContact O-N 3.47Å
296	N	92.6	Very high	93.4	Very high	155 Å²	155	73.3 Å²	73.3	83%	0.829	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-63.2	-34.7	177.7	-67.6	-21.1	0	0	0	112.4	P294 L298 K299	P294-N296 PolarHBondContact O-N 3.33Å; P294-N296 VanDerWaalsContact O-N 3.09Å; N296-L298 VanDerWaalsContact C-N 3.33Å; N296-K299 WeakPolarHBondContact O-CB 3.45Å
297	E	93.8	Very high	93.7	Very high	158 Å²	158	68.1 Å²	68.1	74%	0.738	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-79.3	-17.8	177.9	-61.4	173.4	-153.6	0	0	112.6	P294 W295	P294-E297 HydrophobicContact CB-CB 4.25Å; P294-E297 HydrophobicContact CB-CG 4.13Å; P294-E297 WeakPolarHBondContact O-CB 3.22Å; P294-E297 PolarHBondContact O-N 2.8Å; W295-E297 VanDerWaalsContact C-N 3.29Å; W295-E297 PolarHBondContact O-N 3.46Å
298	L	94.9	Very high	94	Very high	11 Å²	11	70 Å²	70	6%	0.058	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-91.6	-3	177.6	-56.6	177.1	0	0	0	112.7	V217 P268 L270 K273 F274 L293 P294 W295 N296 S300	V217-L298 HydrophobicContact CG1-CB 4.17Å; V217-L298 HydrophobicContact CG2-CD1 4.39Å; P268-L298 HydrophobicContact CB-CD2 4.5Å; P268-L298 HydrophobicContact CG-CB 4.46Å; P268-L298 HydrophobicContact CG-CD2 3.94Å; L270-L298 HydrophobicContact CD2-CD1 4.11Å; K273-L298 HydrophobicContact CD-CD2 3.75Å; F274-L298 HydrophobicContact CE2-CD1 3.9Å; F274-L298 HydrophobicContact CE2-CD2 3.75Å; F274-L298 HydrophobicContact CE2-CG 4.39Å; F274-L298 HydrophobicContact CZ-CD1 4.23Å; F274-L298 HydrophobicContact CZ-CD2 3.91Å; F274-L298 HydrophobicContact CZ-CG 4.45Å; L293-L298 HydrophobicContact CB-CD1 3.89Å; L293-L298 HydrophobicContact CD1-CD1 4.05Å; P294-L298 PolarHBondContact O-N 3.48Å; W295-L298 HydrophobicContact CE3-CD1 4.17Å; W295-L298 HydrophobicContact CZ3-CD1 4.42Å; W295-L298 PolarHBondContact O-N 3.13Å; N296-L298 VanDerWaalsContact C-N 3.33Å; L298-S300 PolarHBondContact O-N 3.36Å
299	K	92.8	Very high	94.4	Very high	169 Å²	169	65.7 Å²	65.7	74%	0.735	33%	0.329	S	S	*	.			trans	-63.8	123.3	-179.7	-172	178.9	179.5	-177.1	0	110.3	W295 N296	W295-K299 PolarHBondContact O-N 3.47Å; N296-K299 WeakPolarHBondContact O-CB 3.45Å
300	S	95.4	Very high	94.8	Very high	20 Å²	20	63.7 Å²	63.7	14%	0.14	32%	0.319	C	S	.	.			trans	-69.9	149	176.6	-179.2	0	0	0	0	112.3	P265 V266 L298 N302	P265-S300 WeakPolarHBondContact O-CB 3.33Å; P265-S300 PolarHBondContact O-OG 2.87Å; V266-S300 WeakPolarHBondContact CA-OG 3.1Å; L298-S300 PolarHBondContact O-N 3.36Å; S300-N302 VanDerWaalsContact C-N 3.3Å; S300-N302 WeakPolarHBondContact OG-CB 3.27Å; S300-N302 PolarHBondContact OG-N 2.99Å
301	T	97.1	Very high	95.4	Very high	99 Å²	99	61.6 Å²	61.6	61%	0.607	31%	0.308	S	S	*	.			trans	-87.1	1.1	167.1	55.6	0	0	0	0	112.8	P264 F303	P264-T301 WeakPolarHBondContact CB-OG1 3.31Å; T301-F303 WeakPolarHBondContact O-CD2 3.36Å; T301-F303 WeakPolarHBondContact O-CE2 3.38Å
302	N	98	Very high	96	Very high	5 Å²	5	61.8 Å²	61.8	3%	0.027	31%	0.31	C	S	.	.			trans	-74.5	126.9	176	-176.9	-71.2	0	0	0	111	R220 C262 P264 V266 S300 N304	R220-N302 PolarHBondContact NH1-O 3Å; R220-N302 PolarHBondContact NH1-OD1 3.44Å; R220-N302 PolarHBondContact NH2-O 3.32Å; C262-N302 PolarHBondContact SG-ND2 2.76Å; P264-N302 HydrophobicContact CB-CB 4.25Å; P264-N302 VanDerWaalsContact O-CB 3.29Å; P264-N302 WeakPolarHBondContact O-CB 3.38Å; P264-N302 PolarHBondContact O-ND2 2.91Å; V266-N302 HydrophobicContact CG2-CB 3.81Å; S300-N302 VanDerWaalsContact C-N 3.3Å; S300-N302 WeakPolarHBondContact OG-CB 3.27Å; S300-N302 PolarHBondContact OG-N 2.99Å; N302-N304 PolarHBondContact ND2-OD1 3.35Å; N302-N304 VanDerWaalsContact ND2-OD1 3.09Å; N302-N304 VanDerWaalsContact OD1-CB 3.3Å; N302-N304 WeakPolarHBondContact OD1-CB 3.44Å; N302-N304 PolarHBondContact OD1-N 3.44Å
303	F	96.8	Very high	96.4	Very high	193 Å²	193	54.9 Å²	54.9	85%	0.846	28%	0.277	S	S	*	.			trans	-103.7	6.4	179.9	-68	-80.7	0	0	0	114.4	T301 N305	T301-F303 WeakPolarHBondContact O-CD2 3.36Å; T301-F303 WeakPolarHBondContact O-CE2 3.38Å; F303-N305 PolarHBondContact O-N 3.48Å
304	N	97.5	Very high	96.6	Very high	54 Å²	54	54.1 Å²	54.1	29%	0.289	27%	0.273	S	S	.	.			trans	-62.4	136.3	-178.7	-68.3	131.6	0	0	0	112	R220 N302 E308 L309	R220-N304 WeakPolarHBondContact CD-O 3.46Å; R220-N304 PolarHBondContact NH1-O 3.18Å; N302-N304 PolarHBondContact ND2-OD1 3.35Å; N302-N304 VanDerWaalsContact ND2-OD1 3.09Å; N302-N304 VanDerWaalsContact OD1-CB 3.3Å; N302-N304 WeakPolarHBondContact OD1-CB 3.44Å; N302-N304 PolarHBondContact OD1-N 3.44Å; N304-E308 WeakPolarHBondContact CA-OE2 3.29Å; N304-E308 HydrophobicContact CB-CB 3.91Å; N304-E308 WeakPolarHBondContact CB-OE2 3.43Å; N304-E308 PolarHBondContact ND2-OE2 3.01Å; N304-L309 HydrophobicContact CB-CD2 3.78Å; N304-L309 HydrophobicContact CB-CG 3.87Å
305	N	97.4	Very high	96.7	Very high	38 Å²	38	55.5 Å²	55.5	20%	0.203	28%	0.276	C	S	.	.			trans	-75.4	174	176	66.2	48.8	0	0	0	111.3	S80 F303 G307 E308 L309	S80-N305 WeakPolarHBondContact OG-CB 3.2Å; S80-N305 VanDerWaalsContact OG-CG 3.27Å; S80-N305 PolarHBondContact OG-OD1 2.85Å; F303-N305 PolarHBondContact O-N 3.48Å; N305-G307 VanDerWaalsContact C-N 3.29Å; N305-G307 PolarHBondContact O-N 2.99Å; N305-G307 PolarHBondContact OD1-N 3.11Å; N305-G307 VanDerWaalsContact OD1-N 3.08Å; N305-E308 PolarHBondContact N-OE2 3.39Å; N305-E308 PolarHBondContact O-N 3.38Å; N305-E308 WeakPolarHBondContact OD1-CG 3.16Å; N305-E308 PolarHBondContact OD1-N 3.22Å; N305-L309 VanDerWaalsContact O-CG 3.31Å; N305-L309 WeakPolarHBondContact O-CG 3.44Å; N305-L309 PolarHBondContact O-N 3.01Å
306	L	98.3	Very high	96.9	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-60.1	-39	-177.6	-72.5	169.7	0	0	0	112.5	S80 I83 W84 W219 R220 P223 L224 L309 F310	S80-L306 PolarHBondContact OG-N 2.94Å; I83-L306 HydrophobicContact CB-CB 4.26Å; I83-L306 HydrophobicContact CB-CD1 4.29Å; I83-L306 HydrophobicContact CD1-CB 3.91Å; I83-L306 WeakPolarHBondContact CD1-O 3.45Å; I83-L306 HydrophobicContact CG2-CB 4.12Å; I83-L306 HydrophobicContact CG2-CD1 3.9Å; I83-L306 HydrophobicContact CG2-CD2 4.29Å; I83-L306 HydrophobicContact CG2-CG 4.35Å; W84-L306 HydrophobicContact CB-CD1 4.29Å; W84-L306 HydrophobicContact CE3-CD1 4.2Å; W219-L306 HydrophobicContact CH2-CD1 4.25Å; W219-L306 HydrophobicContact CH2-CG 4.19Å; W219-L306 HydrophobicContact CZ3-CD1 3.94Å; W219-L306 HydrophobicContact CZ3-CD2 4.43Å; W219-L306 HydrophobicContact CZ3-CG 4.18Å; R220-L306 HydrophobicContact CB-CD2 3.81Å; R220-L306 HydrophobicContact CG-CD2 4.09Å; P223-L306 HydrophobicContact CB-CD1 4.12Å; P223-L306 HydrophobicContact CB-CD2 3.93Å; P223-L306 HydrophobicContact CG-CD2 4.39Å; L224-L306 HydrophobicContact CD1-CD2 4.37Å; L224-L306 HydrophobicContact CD2-CD2 4.28Å; L224-L306 HydrophobicContact CG-CD2 3.81Å; L306-L309 PolarHBondContact O-N 3.13Å; L306-F310 WeakPolarHBondContact O-CB 3.32Å; L306-F310 PolarHBondContact O-N 3.43Å
307	G	97.3	Very high	97.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-45.8	179.1	0	0	0	0	0	112.1	S80 N305 L309 F310 N311	S80-G307 PolarHBondContact OG-N 3.29Å; N305-G307 VanDerWaalsContact C-N 3.29Å; N305-G307 PolarHBondContact O-N 2.99Å; N305-G307 PolarHBondContact OD1-N 3.11Å; N305-G307 VanDerWaalsContact OD1-N 3.08Å; G307-L309 PolarHBondContact O-N 3.42Å; G307-F310 PolarHBondContact O-N 2.94Å; G307-N311 VanDerWaalsContact O-CB 3.27Å; G307-N311 WeakPolarHBondContact O-CB 3.39Å; G307-N311 PolarHBondContact O-N 3.45Å
308	E	97.7	Very high	97.4	Very high	66 Å²	66	40.6 Å²	40.6	31%	0.308	21%	0.205	S	C	.	.	H	α-helix	trans	-61.3	-42.6	174.9	-71.5	172.9	159.9	0	0	112	M76 N304 N305 N311 G312	M76-E308 HydrophobicContact CB-CG 3.94Å; M76-E308 HydrophobicContact CG-CG 3.97Å; N304-E308 WeakPolarHBondContact CA-OE2 3.29Å; N304-E308 HydrophobicContact CB-CB 3.91Å; N304-E308 WeakPolarHBondContact CB-OE2 3.43Å; N304-E308 PolarHBondContact ND2-OE2 3.01Å; N305-E308 PolarHBondContact N-OE2 3.39Å; N305-E308 PolarHBondContact O-N 3.38Å; N305-E308 WeakPolarHBondContact OD1-CG 3.16Å; N305-E308 PolarHBondContact OD1-N 3.22Å; E308-N311 PolarHBondContact O-N 3.16Å; E308-G312 PolarHBondContact O-N 3.33Å
309	L	98.5	Very high	97.5	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.7	-40.5	178.1	-69.9	176.3	0	0	0	112.4	R220 L224 Y257 L258 C262 V266 N304 N305 L306 G307 F313	R220-L309 HydrophobicContact CB-CD1 4.05Å; R220-L309 HydrophobicContact CG-CD1 4.38Å; L224-L309 HydrophobicContact CD1-CB 3.74Å; L224-L309 HydrophobicContact CD1-CD1 3.78Å; L224-L309 HydrophobicContact CD1-CG 4.41Å; L224-L309 HydrophobicContact CD2-CB 4.24Å; Y257-L309 VanDerWaalsContact CE1-O 3.32Å; Y257-L309 WeakPolarHBondContact CE1-O 3.44Å; L258-L309 HydrophobicContact CD2-CD1 4.47Å; L258-L309 HydrophobicContact CD2-CD2 4.08Å; C262-L309 WeakPolarHBondContact SG-CD2 3.03Å; V266-L309 HydrophobicContact CG2-CD1 4.29Å; V266-L309 HydrophobicContact CG2-CD2 3.9Å; N304-L309 HydrophobicContact CB-CD2 3.78Å; N304-L309 HydrophobicContact CB-CG 3.87Å; N305-L309 VanDerWaalsContact O-CG 3.31Å; N305-L309 WeakPolarHBondContact O-CG 3.44Å; N305-L309 PolarHBondContact O-N 3.01Å; L306-L309 PolarHBondContact O-N 3.13Å; G307-L309 PolarHBondContact O-N 3.42Å; L309-F313 WeakPolarHBondContact O-CB 3.27Å; L309-F313 PolarHBondContact O-N 2.96Å
310	F	98.3	Very high	97.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.5	-43.2	173.5	177.5	-106.9	0	0	0	111.1	L79 I83 L224 F227 I228 W231 L306 G307 G312 F313 I314 T391 L395 L401	L79-F310 HydrophobicContact CD2-CD1 4.19Å; I83-F310 HydrophobicContact CD1-CB 4.01Å; L224-F310 HydrophobicContact CD2-CB 4.01Å; F227-F310 AromaticContact CD1-CD2 3.79Å; F227-F310 HydrophobicContact CD1-CD2 3.79Å; F227-F310 AromaticContact CD1-CE2 3.86Å; F227-F310 HydrophobicContact CD1-CE2 3.86Å; F227-F310 HydrophobicContact CD1-CG 4.15Å; F227-F310 HydrophobicContact CD1-CZ 4.29Å; F227-F310 AromaticContact CE1-CD1 3.9Å; F227-F310 HydrophobicContact CE1-CD1 3.9Å; F227-F310 AromaticContact CE1-CD2 3.87Å; F227-F310 HydrophobicContact CE1-CD2 3.87Å; F227-F310 AromaticContact CE1-CE1 3.77Å; F227-F310 HydrophobicContact CE1-CE1 3.77Å; F227-F310 AromaticContact CE1-CE2 3.76Å; F227-F310 HydrophobicContact CE1-CE2 3.76Å; F227-F310 AromaticContact CE1-CG 3.93Å; F227-F310 HydrophobicContact CE1-CG 3.93Å; F227-F310 AromaticContact CE1-CZ 3.71Å; F227-F310 HydrophobicContact CE1-CZ 3.71Å; I228-F310 HydrophobicContact CG1-CD2 3.9Å; I228-F310 HydrophobicContact CG1-CE2 3.99Å; W231-F310 HydrophobicContact CB-CZ 4.49Å; W231-F310 HydrophobicContact CD2-CE2 4.49Å; W231-F310 HydrophobicContact CD2-CZ 4.44Å; W231-F310 HydrophobicContact CG-CE2 4.32Å; W231-F310 HydrophobicContact CG-CZ 4.07Å; L306-F310 WeakPolarHBondContact O-CB 3.32Å; L306-F310 PolarHBondContact O-N 3.43Å; G307-F310 PolarHBondContact O-N 2.94Å; F310-G312 PolarHBondContact O-N 3.04Å; F310-F313 WeakPolarHBondContact O-CB 3.34Å; F310-F313 PolarHBondContact O-N 3.45Å; F310-I314 HydrophobicContact CD1-CG1 4.37Å; F310-I314 HydrophobicContact CD2-CG1 4.38Å; F310-I314 HydrophobicContact CE1-CG1 3.93Å; F310-I314 HydrophobicContact CE2-CD1 3.97Å; F310-I314 HydrophobicContact CE2-CG1 3.92Å; F310-I314 HydrophobicContact CZ-CD1 3.84Å; F310-I314 HydrophobicContact CZ-CG1 3.68Å; F310-I314 WeakPolarHBondContact O-CG1 3.49Å; F310-I314 PolarHBondContact O-N 3.2Å; F310-T391 HydrophobicContact CE1-CG2 4.19Å; F310-T391 HydrophobicContact CZ-CG2 4.12Å; F310-L395 HydrophobicContact CD1-CD1 4.14Å; F310-L395 HydrophobicContact CD1-CD2 4.45Å; F310-L395 HydrophobicContact CE1-CD1 3.91Å; F310-L395 HydrophobicContact CE1-CD2 4.38Å; F310-L401 HydrophobicContact CE1-CD1 3.99Å
311	N	97.8	Very high	97.7	Very high	43 Å²	43	41.4 Å²	41.4	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-46.9	176.1	-177.7	53.5	0	0	0	111.8	M76 G307 E308 F313 I314 H315 L395	M76-N311 HydrophobicContact CE-CB 4Å; M76-N311 HydrophobicContact SD-CB 4.04Å; G307-N311 VanDerWaalsContact O-CB 3.27Å; G307-N311 WeakPolarHBondContact O-CB 3.39Å; G307-N311 PolarHBondContact O-N 3.45Å; E308-N311 PolarHBondContact O-N 3.16Å; N311-F313 VanDerWaalsContact C-N 3.35Å; N311-F313 PolarHBondContact O-N 3.33Å; N311-I314 PolarHBondContact O-N 3.5Å; N311-H315 WeakPolarHBondContact O-CB 3.42Å; N311-H315 PolarHBondContact O-N 3.35Å; N311-L395 HydrophobicContact CB-CD1 4.49Å; N311-L395 WeakPolarHBondContact OD1-CB 3.29Å
312	G	98.2	Very high	97.6	Very high	18 Å²	18	40.2 Å²	40.2	19%	0.186	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-36.4	176	0	0	0	0	0	113.1	Y257 E308 F310 H315 Y316	Y257-G312 WeakPolarHBondContact CE2-O 3.49Å; Y257-G312 VanDerWaalsContact OH-CA 3.3Å; Y257-G312 WeakPolarHBondContact OH-CA 3.48Å; E308-G312 PolarHBondContact O-N 3.33Å; F310-G312 PolarHBondContact O-N 3.04Å; G312-H315 PolarHBondContact O-N 2.95Å; G312-Y316 VanDerWaalsContact O-CB 3.25Å; G312-Y316 WeakPolarHBondContact O-CB 3.48Å; G312-Y316 PolarHBondContact O-N 2.94Å
313	F	98.7	Very high	97.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-47	173.2	169.4	-91	0	0	0	111.6	I228 W231 M253 L254 Y257 L309 F310 N311 Y317 F388	I228-F313 HydrophobicContact CD1-CD1 3.91Å; I228-F313 HydrophobicContact CD1-CD2 4.03Å; I228-F313 HydrophobicContact CD1-CE1 3.94Å; I228-F313 HydrophobicContact CD1-CE2 4.04Å; I228-F313 HydrophobicContact CD1-CG 3.97Å; I228-F313 HydrophobicContact CD1-CZ 4.01Å; I228-F313 HydrophobicContact CG1-CD1 4.29Å; I228-F313 HydrophobicContact CG1-CE1 4.16Å; I228-F313 HydrophobicContact CG2-CE1 4.1Å; I228-F313 HydrophobicContact CG2-CZ 3.99Å; W231-F313 HydrophobicContact CZ3-CE1 4.22Å; M253-F313 HydrophobicContact CB-CE2 4.14Å; M253-F313 HydrophobicContact CB-CZ 4.46Å; L254-F313 HydrophobicContact CB-CE2 4.39Å; L254-F313 HydrophobicContact CD1-CD2 4.37Å; Y257-F313 HydrophobicContact CD1-CB 3.78Å; Y257-F313 HydrophobicContact CD1-CD2 4.13Å; Y257-F313 HydrophobicContact CD1-CG 4.48Å; Y257-F313 HydrophobicContact CE1-CB 3.89Å; Y257-F313 HydrophobicContact CG-CB 4.16Å; Y257-F313 HydrophobicContact CG-CD2 4.13Å; Y257-F313 VanDerWaalsContact CZ-N 3.29Å; L309-F313 WeakPolarHBondContact O-CB 3.27Å; L309-F313 PolarHBondContact O-N 2.96Å; F310-F313 WeakPolarHBondContact O-CB 3.34Å; F310-F313 PolarHBondContact O-N 3.45Å; N311-F313 VanDerWaalsContact C-N 3.35Å; N311-F313 PolarHBondContact O-N 3.33Å; F313-Y317 AromaticContact CD2-CD2 3.92Å; F313-Y317 HydrophobicContact CD2-CD2 3.92Å; F313-Y317 AromaticContact CD2-CE2 3.7Å; F313-Y317 HydrophobicContact CD2-CE2 3.7Å; F313-Y317 HydrophobicContact CE1-CD2 4.36Å; F313-Y317 AromaticContact CE2-CD2 3.67Å; F313-Y317 HydrophobicContact CE2-CD2 3.67Å; F313-Y317 AromaticContact CE2-CE2 3.34Å; F313-Y317 HydrophobicContact CE2-CE2 3.34Å; F313-Y317 HydrophobicContact CG-CD2 4.39Å; F313-Y317 AromaticContact CZ-CD2 3.89Å; F313-Y317 HydrophobicContact CZ-CD2 3.89Å; F313-Y317 AromaticContact CZ-CE2 3.95Å; F313-Y317 HydrophobicContact CZ-CE2 3.95Å; F313-Y317 WeakPolarHBondContact O-CD2 3.31Å; F313-Y317 PolarHBondContact O-N 3.42Å; F313-F388 HydrophobicContact CD1-CE1 4.2Å; F313-F388 AromaticContact CE1-CE1 3.58Å; F313-F388 HydrophobicContact CE1-CE1 3.58Å; F313-F388 AromaticContact CE1-CZ 3.91Å; F313-F388 HydrophobicContact CE1-CZ 3.91Å; F313-F388 HydrophobicContact CZ-CE1 4.12Å; F313-F388 HydrophobicContact CZ-CZ 4.06Å
314	I	98.5	Very high	97.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-45.5	177.7	-65.6	-62.6	0	0	0	110.6	W231 F310 N311 Y316 T318 F388 T391 N392 L395	W231-I314 HydrophobicContact CD2-CD1 4.39Å; W231-I314 HydrophobicContact CH2-CD1 3.92Å; W231-I314 HydrophobicContact CZ2-CD1 3.59Å; W231-I314 HydrophobicContact CZ3-CD1 4.43Å; F310-I314 HydrophobicContact CD1-CG1 4.37Å; F310-I314 HydrophobicContact CD2-CG1 4.38Å; F310-I314 HydrophobicContact CE1-CG1 3.93Å; F310-I314 HydrophobicContact CE2-CD1 3.97Å; F310-I314 HydrophobicContact CE2-CG1 3.92Å; F310-I314 HydrophobicContact CZ-CD1 3.84Å; F310-I314 HydrophobicContact CZ-CG1 3.68Å; F310-I314 WeakPolarHBondContact O-CG1 3.49Å; F310-I314 PolarHBondContact O-N 3.2Å; N311-I314 PolarHBondContact O-N 3.5Å; I314-Y316 PolarHBondContact O-N 3.41Å; I314-T318 VanDerWaalsContact O-CB 3.31Å; I314-T318 WeakPolarHBondContact O-CB 3.47Å; I314-T318 PolarHBondContact O-N 3.38Å; I314-T318 VanDerWaalsContact O-N 3.07Å; I314-T318 PolarHBondContact O-OG1 3.09Å; I314-F388 HydrophobicContact CD1-CD1 3.87Å; I314-F388 HydrophobicContact CD1-CE1 3.92Å; I314-T391 HydrophobicContact CD1-CG2 3.82Å; I314-T391 HydrophobicContact CG1-CG2 3.84Å; I314-T391 HydrophobicContact CG2-CG2 4.01Å; I314-N392 HydrophobicContact CG2-CB 3.74Å; I314-L395 HydrophobicContact CB-CD1 3.91Å; I314-L395 HydrophobicContact CG1-CD1 3.89Å; I314-L395 HydrophobicContact CG2-CD1 3.98Å
315	H	98.1	Very high	96.9	Very high	75 Å²	75	38.9 Å²	38.9	35%	0.347	20%	0.197	S	C	.	.	H	α-helix	trans	-59	-47.4	178.2	-174.2	83.7	0	0	0	111.9	N311 G312 Y317 T318 N319 E320	N311-H315 WeakPolarHBondContact O-CB 3.42Å; N311-H315 PolarHBondContact O-N 3.35Å; G312-H315 PolarHBondContact O-N 2.95Å; H315-Y317 PolarHBondContact O-N 2.88Å; H315-T318 PolarHBondContact O-N 3.31Å; H315-N319 PolarHBondContact CE1-ND2 3.16Å; H315-N319 PolarHBondContact ND1-ND2 2.91Å; H315-N319 PolarHBondContact O-N 3.36Å; H315-N319 PolarHBondContact O-ND2 3.08Å; H315-E320 IonicContact CD2-OE1 2.81Å; H315-E320 PolarHBondContact CD2-OE1 2.94Å; H315-E320 VanDerWaalsContact CD2-OE1 3.3Å; H315-E320 IonicContact NE2-OE1 3.78Å
316	Y	98.2	Very high	96.8	Very high	13 Å²	13	40.3 Å²	40.3	5%	0.051	20%	0.2	C	C	.	.	I	π-helix	trans	-57.7	-51.5	-179.2	176.3	-109.4	0	0	0	112.3	H256 Y257 A261 G312 I314 T318 E320 F321	H256-Y316 AromaticContact CD2-CE1 3.91Å; H256-Y316 AromaticContact NE2-CZ 4Å; H256-Y316 PolarHBondContact NE2-OH 3.31Å; H256-Y316 VanDerWaalsContact NE2-OH 3.07Å; Y257-Y316 HydrophobicContact CD2-CD1 4.12Å; Y257-Y316 AromaticContact CD2-CG 3.99Å; Y257-Y316 HydrophobicContact CD2-CG 3.99Å; A261-Y316 HydrophobicContact CB-CD1 4.33Å; A261-Y316 HydrophobicContact CB-CD2 3.37Å; A261-Y316 HydrophobicContact CB-CE1 4.28Å; A261-Y316 HydrophobicContact CB-CE2 3.31Å; A261-Y316 HydrophobicContact CB-CG 3.88Å; G312-Y316 VanDerWaalsContact O-CB 3.25Å; G312-Y316 WeakPolarHBondContact O-CB 3.48Å; G312-Y316 PolarHBondContact O-N 2.94Å; I314-Y316 PolarHBondContact O-N 3.41Å; Y316-T318 VanDerWaalsContact C-N 3.26Å; Y316-T318 PolarHBondContact O-N 3.12Å; Y316-E320 HydrophobicContact CD2-CB 3.81Å; Y316-E320 HydrophobicContact CD2-CG 4.48Å; Y316-E320 HydrophobicContact CE2-CB 4.21Å; Y316-E320 PolarHBondContact O-N 2.77Å; Y316-F321 HydrophobicContact CD1-CB 4.21Å; Y316-F321 HydrophobicContact CE1-CB 3.84Å; Y316-F321 AromaticContact CE1-CD2 3.79Å; Y316-F321 HydrophobicContact CE1-CD2 3.79Å; Y316-F321 HydrophobicContact CE1-CG 4.09Å; Y316-F321 HydrophobicContact CE2-CB 4.42Å; Y316-F321 AromaticContact CZ-CD2 3.66Å; Y316-F321 PolarHBondContact O-N 3.11Å; Y316-F321 VanDerWaalsContact OH-CD2 3.29Å; Y316-F321 WeakPolarHBondContact OH-CD2 3.49Å
317	Y	98.1	Very high	96.7	Very high	7 Å²	7	40.1 Å²	40.1	3%	0.027	20%	0.199	C	C	.	.	I	π-helix	trans	-76.1	-12.2	-179.1	-74.7	-63.1	0	0	0	114.2	M253 H256 F313 H315 F321 F323 I328 F388	M253-Y317 WeakPolarHBondContact CA-OH 3.36Å; M253-Y317 HydrophobicContact CB-CE2 3.97Å; M253-Y317 WeakPolarHBondContact CB-OH 3.38Å; M253-Y317 HydrophobicContact CE-CD1 3.97Å; M253-Y317 HydrophobicContact CE-CD2 3.99Å; M253-Y317 HydrophobicContact CE-CE1 3.93Å; M253-Y317 HydrophobicContact CE-CE2 3.96Å; M253-Y317 HydrophobicContact CE-CG 4Å; M253-Y317 PolarHBondContact O-OH 3.37Å; H256-Y317 PolarHBondContact CD2-OH 3.18Å; F313-Y317 AromaticContact CD2-CD2 3.92Å; F313-Y317 HydrophobicContact CD2-CD2 3.92Å; F313-Y317 AromaticContact CD2-CE2 3.7Å; F313-Y317 HydrophobicContact CD2-CE2 3.7Å; F313-Y317 HydrophobicContact CE1-CD2 4.36Å; F313-Y317 AromaticContact CE2-CD2 3.67Å; F313-Y317 HydrophobicContact CE2-CD2 3.67Å; F313-Y317 AromaticContact CE2-CE2 3.34Å; F313-Y317 HydrophobicContact CE2-CE2 3.34Å; F313-Y317 HydrophobicContact CG-CD2 4.39Å; F313-Y317 AromaticContact CZ-CD2 3.89Å; F313-Y317 HydrophobicContact CZ-CD2 3.89Å; F313-Y317 AromaticContact CZ-CE2 3.95Å; F313-Y317 HydrophobicContact CZ-CE2 3.95Å; F313-Y317 WeakPolarHBondContact O-CD2 3.31Å; F313-Y317 PolarHBondContact O-N 3.42Å; H315-Y317 PolarHBondContact O-N 2.88Å; Y317-F321 HydrophobicContact CD1-CB 3.88Å; Y317-F321 AromaticContact CD1-CD1 4Å; Y317-F321 HydrophobicContact CD1-CD1 4Å; Y317-F321 AromaticContact CD1-CG 3.99Å; Y317-F321 HydrophobicContact CD1-CG 3.99Å; Y317-F321 HydrophobicContact CE1-CB 4.29Å; Y317-F321 HydrophobicContact CE1-CD1 4.05Å; Y317-F321 HydrophobicContact CE1-CD2 4.44Å; Y317-F321 AromaticContact CE1-CG 3.99Å; Y317-F321 HydrophobicContact CE1-CG 3.99Å; Y317-F323 HydrophobicContact CD1-CE1 4.23Å; Y317-F323 HydrophobicContact CD1-CE2 4.36Å; Y317-F323 AromaticContact CD1-CZ 3.64Å; Y317-F323 HydrophobicContact CD1-CZ 3.64Å; Y317-F323 HydrophobicContact CE1-CZ 4.36Å; Y317-F323 HydrophobicContact CG-CZ 4.39Å; Y317-I328 HydrophobicContact CE1-CD1 3.85Å; Y317-I328 HydrophobicContact CE1-CG1 4.27Å; Y317-F388 VanDerWaalsContact CB-CE1 3.45Å; Y317-F388 HydrophobicContact CD2-CE1 4.01Å; Y317-F388 HydrophobicContact CD2-CZ 4.17Å; Y317-F388 HydrophobicContact CG-CE1 4.06Å; Y317-F388 HydrophobicContact CG-CZ 4.15Å
318	T	97.9	Very high	96.7	Very high	35 Å²	35	40.1 Å²	40.1	22%	0.215	20%	0.199	C	C	.	.	I	π-helix	trans	-88.3	-49.3	174.1	-54.9	0	0	0	0	111.7	I314 H315 Y316 F388 I389 N392	I314-T318 VanDerWaalsContact O-CB 3.31Å; I314-T318 WeakPolarHBondContact O-CB 3.47Å; I314-T318 PolarHBondContact O-N 3.38Å; I314-T318 VanDerWaalsContact O-N 3.07Å; I314-T318 PolarHBondContact O-OG1 3.09Å; H315-T318 PolarHBondContact O-N 3.31Å; Y316-T318 VanDerWaalsContact C-N 3.26Å; Y316-T318 PolarHBondContact O-N 3.12Å; T318-F388 PolarHBondContact OG1-O 3.34Å; T318-I389 HydrophobicContact CG2-CB 4.42Å; T318-I389 HydrophobicContact CG2-CG1 3.84Å; T318-N392 HydrophobicContact CG2-CB 3.92Å
319	N	97.2	Very high	96.6	Very high	89 Å²	89	37.1 Å²	37.1	48%	0.476	19%	0.185	S	C	.	.	I	π-helix	trans	-111.8	-25.2	-162.9	-57.6	-55.6	0	0	0	114	H315 N392	H315-N319 PolarHBondContact CE1-ND2 3.16Å; H315-N319 PolarHBondContact ND1-ND2 2.91Å; H315-N319 PolarHBondContact O-N 3.36Å; H315-N319 PolarHBondContact O-ND2 3.08Å; N319-N392 PolarHBondContact ND2-OD1 2.91Å
320	E	96.6	Very high	96.5	Very high	115 Å²	115	37.1 Å²	37.1	54%	0.537	19%	0.185	S	C	.	.	I	π-helix	trans	-111.1	-44.3	-171.3	-61.5	178.8	-136.5	0	0	112.7	H315 Y316 N322	H315-E320 IonicContact CD2-OE1 2.81Å; H315-E320 PolarHBondContact CD2-OE1 2.94Å; H315-E320 VanDerWaalsContact CD2-OE1 3.3Å; H315-E320 IonicContact NE2-OE1 3.78Å; Y316-E320 HydrophobicContact CD2-CB 3.81Å; Y316-E320 HydrophobicContact CD2-CG 4.48Å; Y316-E320 HydrophobicContact CE2-CB 4.21Å; Y316-E320 PolarHBondContact O-N 2.77Å; E320-N322 PolarHBondContact O-N 2.94Å
321	F	96.6	Very high	96.3	Very high	13 Å²	13	40.1 Å²	40.1	6%	0.057	20%	0.197	C	C	.	.			trans	-81.8	110.5	-173.4	-168.1	-93.7	0	0	0	112.7	H256 Y316 Y317 F323 W326 I328 P335	H256-F321 AromaticContact NE2-CE2 3.87Å; Y316-F321 HydrophobicContact CD1-CB 4.21Å; Y316-F321 HydrophobicContact CE1-CB 3.84Å; Y316-F321 AromaticContact CE1-CD2 3.79Å; Y316-F321 HydrophobicContact CE1-CD2 3.79Å; Y316-F321 HydrophobicContact CE1-CG 4.09Å; Y316-F321 HydrophobicContact CE2-CB 4.42Å; Y316-F321 AromaticContact CZ-CD2 3.66Å; Y316-F321 PolarHBondContact O-N 3.11Å; Y316-F321 VanDerWaalsContact OH-CD2 3.29Å; Y316-F321 WeakPolarHBondContact OH-CD2 3.49Å; Y317-F321 HydrophobicContact CD1-CB 3.88Å; Y317-F321 AromaticContact CD1-CD1 4Å; Y317-F321 HydrophobicContact CD1-CD1 4Å; Y317-F321 AromaticContact CD1-CG 3.99Å; Y317-F321 HydrophobicContact CD1-CG 3.99Å; Y317-F321 HydrophobicContact CE1-CB 4.29Å; Y317-F321 HydrophobicContact CE1-CD1 4.05Å; Y317-F321 HydrophobicContact CE1-CD2 4.44Å; Y317-F321 AromaticContact CE1-CG 3.99Å; Y317-F321 HydrophobicContact CE1-CG 3.99Å; F321-F323 AromaticContact CD1-CD1 3.82Å; F321-F323 HydrophobicContact CD1-CD1 3.82Å; F321-F323 HydrophobicContact CD1-CD2 4.14Å; F321-F323 AromaticContact CD1-CE1 3.88Å; F321-F323 HydrophobicContact CD1-CE1 3.88Å; F321-F323 HydrophobicContact CD1-CE2 4.19Å; F321-F323 AromaticContact CD1-CG 3.96Å; F321-F323 HydrophobicContact CD1-CG 3.96Å; F321-F323 HydrophobicContact CD1-CZ 4.07Å; F321-F323 AromaticContact CE1-CD1 3.62Å; F321-F323 HydrophobicContact CE1-CD1 3.62Å; F321-F323 AromaticContact CE1-CE1 3.92Å; F321-F323 HydrophobicContact CE1-CE1 3.92Å; F321-F323 HydrophobicContact CE1-CG 4.05Å; F321-F323 PolarHBondContact O-N 2.94Å; F321-W326 HydrophobicContact CD2-CB 4.39Å; F321-W326 HydrophobicContact CE1-CB 4.37Å; F321-W326 HydrophobicContact CE2-CB 3.64Å; F321-W326 HydrophobicContact CZ-CB 3.61Å; F321-I328 HydrophobicContact CE1-CD1 4.22Å; F321-I328 HydrophobicContact CE1-CG1 3.8Å; F321-I328 HydrophobicContact CE2-CG1 4.05Å; F321-I328 HydrophobicContact CZ-CD1 4.32Å; F321-I328 HydrophobicContact CZ-CG1 3.41Å; F321-I328 VanDerWaalsContact CZ-CG1 3.41Å; F321-P335 HydrophobicContact CE2-CB 4.15Å; F321-P335 HydrophobicContact CE2-CG 4.35Å
322	N	94.6	Very high	95.8	Very high	75 Å²	75	40.2 Å²	40.2	40%	0.401	20%	0.196	S	C	.	.			trans	-88	99.1	174.2	-172.1	-26.8	0	0	0	112.2	E320 N324 K325 W326	E320-N322 PolarHBondContact O-N 2.94Å; N322-N324 PolarHBondContact O-N 2.66Å; N322-N324 VanDerWaalsContact O-N 3.08Å; N322-N324 WeakPolarHBondContact OD1-CA 3.36Å; N322-N324 VanDerWaalsContact OD1-CB 3.31Å; N322-N324 WeakPolarHBondContact OD1-CB 3.44Å; N322-N324 PolarHBondContact OD1-N 3.34Å; N322-K325 HydrophobicContact CB-CB 4.1Å; N322-K325 PolarHBondContact O-N 3.31Å; N322-K325 PolarHBondContact OD1-N 3.36Å; N322-W326 PolarHBondContact O-N 3.12Å
323	F	93	Very high	95.3	Very high	9 Å²	9	43.4 Å²	43.4	4%	0.039	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.4	176.6	-68.2	-80.4	0	0	0	115.4	M253 Y317 F321 I328 K338 I360	M253-F323 HydrophobicContact CE-CZ 4.38Å; Y317-F323 HydrophobicContact CD1-CE1 4.23Å; Y317-F323 HydrophobicContact CD1-CE2 4.36Å; Y317-F323 AromaticContact CD1-CZ 3.64Å; Y317-F323 HydrophobicContact CD1-CZ 3.64Å; Y317-F323 HydrophobicContact CE1-CZ 4.36Å; Y317-F323 HydrophobicContact CG-CZ 4.39Å; F321-F323 AromaticContact CD1-CD1 3.82Å; F321-F323 HydrophobicContact CD1-CD1 3.82Å; F321-F323 HydrophobicContact CD1-CD2 4.14Å; F321-F323 AromaticContact CD1-CE1 3.88Å; F321-F323 HydrophobicContact CD1-CE1 3.88Å; F321-F323 HydrophobicContact CD1-CE2 4.19Å; F321-F323 AromaticContact CD1-CG 3.96Å; F321-F323 HydrophobicContact CD1-CG 3.96Å; F321-F323 HydrophobicContact CD1-CZ 4.07Å; F321-F323 AromaticContact CE1-CD1 3.62Å; F321-F323 HydrophobicContact CE1-CD1 3.62Å; F321-F323 AromaticContact CE1-CE1 3.92Å; F321-F323 HydrophobicContact CE1-CE1 3.92Å; F321-F323 HydrophobicContact CE1-CG 4.05Å; F321-F323 PolarHBondContact O-N 2.94Å; F323-I328 HydrophobicContact CE1-CD1 4.12Å; F323-K338 PolarHBondContact O-NZ 2.72Å; F323-I360 HydrophobicContact CD1-CB 4.44Å; F323-I360 HydrophobicContact CD1-CD1 4.24Å; F323-I360 HydrophobicContact CD1-CG1 3.92Å; F323-I360 HydrophobicContact CD1-CG2 3.95Å; F323-I360 HydrophobicContact CE1-CD1 4.35Å; F323-I360 HydrophobicContact CE1-CG1 4.48Å; F323-I360 HydrophobicContact CE1-CG2 4.19Å; F323-I360 HydrophobicContact CG-CG1 4.41Å
324	N	91.4	Very high	94.8	Very high	107 Å²	107	51.6 Å²	51.6	57%	0.572	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-27.8	176.3	-64.1	-25.3	0	0	0	111.9	N322	N322-N324 PolarHBondContact O-N 2.66Å; N322-N324 VanDerWaalsContact O-N 3.08Å; N322-N324 WeakPolarHBondContact OD1-CA 3.36Å; N322-N324 VanDerWaalsContact OD1-CB 3.31Å; N322-N324 WeakPolarHBondContact OD1-CB 3.44Å; N322-N324 PolarHBondContact OD1-N 3.34Å
325	K	93.5	Very high	94.1	Very high	107 Å²	107	53 Å²	53	47%	0.465	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-38.4	-175.1	-173.6	175.8	178.1	-179.5	0	112.7	N322 K338	N322-K325 HydrophobicContact CB-CB 4.1Å; N322-K325 PolarHBondContact O-N 3.31Å; N322-K325 PolarHBondContact OD1-N 3.36Å; K325-K338 WeakPolarHBondContact O-CB 3.41Å; K325-K338 PolarHBondContact O-N 3.5Å
326	W	95.3	Very high	93.6	Very high	69 Å²	69	51.4 Å²	51.4	26%	0.261	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	144.8	-167.6	-57.6	119.4	0	0	0	112.6	F321 N322 P335 F336 M337	F321-W326 HydrophobicContact CD2-CB 4.39Å; F321-W326 HydrophobicContact CE1-CB 4.37Å; F321-W326 HydrophobicContact CE2-CB 3.64Å; F321-W326 HydrophobicContact CZ-CB 3.61Å; N322-W326 PolarHBondContact O-N 3.12Å; W326-P335 HydrophobicContact CB-CB 3.99Å; W326-P335 HydrophobicContact CD2-CB 4.1Å; W326-P335 HydrophobicContact CE3-CB 4.09Å; W326-P335 HydrophobicContact CG-CB 4.08Å; W326-F336 CarbonylContact C-O 3.22Å; W326-F336 WeakPolarHBondContact CA-O 3.42Å; W326-M337 HydrophobicContact CE3-CG 4.05Å; W326-M337 HydrophobicContact CH2-CE 4.34Å; W326-M337 HydrophobicContact CH2-CG 4.14Å; W326-M337 HydrophobicContact CZ3-CB 4.35Å; W326-M337 HydrophobicContact CZ3-CG 3.46Å; W326-M337 VanDerWaalsContact CZ3-CG 3.46Å
327	A	95.2	Very high	93.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	137.6	166.9	0	0	0	0	0	109.4	F336 T341 F361	A327-F336 PolarHBondContact N-O 3.19Å; A327-F336 PolarHBondContact O-N 3.07Å; A327-T341 HydrophobicContact CB-CG2 4.43Å; A327-T341 WeakPolarHBondContact CB-OG1 3.49Å; A327-F361 WeakPolarHBondContact CA-O 3.31Å; A327-F361 HydrophobicContact CB-CB 4.11Å; A327-F361 HydrophobicContact CB-CD1 3.58Å; A327-F361 HydrophobicContact CB-CE1 4.37Å; A327-F361 HydrophobicContact CB-CG 4.09Å
328	I	97.1	Very high	92.9	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-76.8	126.4	171.4	-61.8	165.2	0	0	0	107.1	M253 H256 Y317 F321 F323 F361 I362 E363	M253-I328 HydrophobicContact CG-CD1 3.58Å; M253-I328 HydrophobicContact SD-CD1 4.37Å; H256-I328 HydrophobicContact CB-CG2 3.58Å; Y317-I328 HydrophobicContact CE1-CD1 3.85Å; Y317-I328 HydrophobicContact CE1-CG1 4.27Å; F321-I328 HydrophobicContact CE1-CD1 4.22Å; F321-I328 HydrophobicContact CE1-CG1 3.8Å; F321-I328 HydrophobicContact CE2-CG1 4.05Å; F321-I328 HydrophobicContact CZ-CD1 4.32Å; F321-I328 HydrophobicContact CZ-CG1 3.41Å; F321-I328 VanDerWaalsContact CZ-CG1 3.41Å; F323-I328 HydrophobicContact CE1-CD1 4.12Å; I328-F361 PolarHBondContact N-O 3.23Å; I328-I362 HydrophobicContact CB-CB 4.4Å; I328-I362 HydrophobicContact CB-CG1 4.18Å; I328-I362 HydrophobicContact CB-CG2 4.19Å; I328-I362 HydrophobicContact CD1-CD1 4.04Å; I328-I362 HydrophobicContact CD1-CG1 3.79Å; I328-I362 HydrophobicContact CG1-CG1 4.47Å; I328-I362 HydrophobicContact CG2-CG2 4.11Å; I328-E363 PolarHBondContact O-N 3.2Å
329	T	95.7	Very high	92.4	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.012	28%	0.278	C	S	.	.			trans	-141.6	141.4	177.8	173.2	0	0	0	0	109.4	H256 R331 H332 R334 F336 E363	H256-T329 PolarHBondContact ND1-O 3.07Å; T329-R331 PolarHBondContact OG1-N 3.34Å; T329-H332 HydrophobicContact CG2-CB 3.87Å; T329-H332 PolarHBondContact OG1-CD2 3.18Å; T329-R334 WeakPolarHBondContact CG2-O 3.41Å; T329-F336 HydrophobicContact CG2-CB 4.2Å; T329-E363 VanDerWaalsContact CB-OE2 3.23Å; T329-E363 WeakPolarHBondContact CB-OE2 3.29Å; T329-E363 PolarHBondContact OG1-OE2 3.41Å
330	I	96.8	Very high	92	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	27%	0.274	C	S	.	.	S	Bend	trans	-106.1	-4.9	174	66.1	162.1	0	0	0	112.6	L210 Y214 L252 I255 H256 Q259 P365	L210-I330 HydrophobicContact CD2-CD1 3.91Å; Y214-I330 HydrophobicContact CE2-CD1 3.93Å; L252-I330 HydrophobicContact CD2-CD1 3.6Å; L252-I330 HydrophobicContact CD2-CG1 4.15Å; L252-I330 HydrophobicContact CD2-CG2 4.24Å; I255-I330 HydrophobicContact CB-CG2 3.9Å; I255-I330 HydrophobicContact CG2-CB 3.95Å; I255-I330 HydrophobicContact CG2-CD1 4.48Å; I255-I330 HydrophobicContact CG2-CG2 3.59Å; H256-I330 HydrophobicContact CB-CG2 4.27Å; Q259-I330 PolarHBondContact NE2-O 2.54Å; Q259-I330 VanDerWaalsContact OE1-CA 3.3Å; Q259-I330 PolarHBondContact OE1-O 2.81Å; I330-P365 HydrophobicContact CD1-CB 4.11Å; I330-P365 HydrophobicContact CD1-CG 4.15Å; I330-P365 HydrophobicContact CG1-CB 4.08Å
331	R	93.3	Very high	91.5	Very high	62 Å²	62	53 Å²	53	23%	0.234	25%	0.25	C	C	.	.	S	Bend	trans	-87.2	-17.6	179.4	-172.6	176.8	62.9	97.6	-8.4	111.9	N269 T329 E363	N269-R331 VanDerWaalsContact ND2-C 3.34Å; N269-R331 PolarHBondContact ND2-O 3.47Å; T329-R331 PolarHBondContact OG1-N 3.34Å; R331-E363 IonicContact CZ-OE1 2.92Å; R331-E363 IonicContact NE-OE1 3.3Å; R331-E363 PolarHBondContact NE-OE1 3.41Å; R331-E363 IonicContact NE-OE2 3.78Å; R331-E363 IonicContact NH2-OE1 3.76Å; R331-E363 PolarHBondContact NH2-OE1 2.92Å; R331-E363 IonicContact NH2-OE2 3.47Å
332	H	89	Confident	91	Very high	46 Å²	46	53.6 Å²	53.6	21%	0.213	25%	0.253	C	S	.	.	S	Bend	trans	-121.3	143.9	176.6	-57.1	-75.7	0	0	0	110.1	T329 R334 E363	T329-H332 HydrophobicContact CG2-CB 3.87Å; T329-H332 PolarHBondContact OG1-CD2 3.18Å; H332-R334 PolarHBondContact O-N 2.81Å; H332-E363 IonicContact CD2-OE2 3.77Å
333	N	86.6	Confident	90.6	Very high	84 Å²	84	57.5 Å²	57.5	45%	0.449	27%	0.267	S	S	.	.	S	Bend	trans	-73.7	15.3	177.2	-61.6	-47.1	0	0	0	114.4	T260 N269 E272	T260-N333 VanDerWaalsContact CG2-C 3.42Å; T260-N333 WeakPolarHBondContact CG2-O 2.96Å; N269-N333 WeakPolarHBondContact CB-OD1 3.23Å; E272-N333 PolarHBondContact OE2-ND2 3.45Å
334	R	89.1	Confident	90.2	Very high	172 Å²	172	61.9 Å²	61.9	65%	0.649	29%	0.287	S	S	*	.	S	Bend	trans	-154.6	153.4	179.5	62.1	-177.4	178.4	-168.6	-1.2	110.7	T329 H332 F336	T329-R334 WeakPolarHBondContact CG2-O 3.41Å; H332-R334 PolarHBondContact O-N 2.81Å; R334-F336 PolarHBondContact O-N 3.1Å
335	P	83.5	Confident	89.9	Confident	31 Å²	31	57.1 Å²	57.1	20%	0.201	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-53.1	138.2	167.5	-22.7	32	0	0	0	111.1	F321 W326	F321-P335 HydrophobicContact CE2-CB 4.15Å; F321-P335 HydrophobicContact CE2-CG 4.35Å; W326-P335 HydrophobicContact CB-CB 3.99Å; W326-P335 HydrophobicContact CD2-CB 4.1Å; W326-P335 HydrophobicContact CE3-CB 4.09Å; W326-P335 HydrophobicContact CG-CB 4.08Å
336	F	87.2	Confident	89.4	Confident	41 Å²	41	54.5 Å²	54.5	18%	0.18	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	145.2	178.1	-147.6	-112.1	0	0	0	110	W326 A327 T329 R334 K338 I340 T341	W326-F336 CarbonylContact C-O 3.22Å; W326-F336 WeakPolarHBondContact CA-O 3.42Å; A327-F336 PolarHBondContact N-O 3.19Å; A327-F336 PolarHBondContact O-N 3.07Å; T329-F336 HydrophobicContact CG2-CB 4.2Å; R334-F336 PolarHBondContact O-N 3.1Å; F336-K338 PolarHBondContact O-N 3.29Å; F336-K338 VanDerWaalsContact O-N 3.16Å; F336-I340 HydrophobicContact CD1-CB 4.48Å; F336-I340 HydrophobicContact CD1-CG2 4.46Å; F336-I340 HydrophobicContact CE1-CB 4.1Å; F336-I340 HydrophobicContact CE1-CG2 3.63Å; F336-I340 HydrophobicContact CZ-CG2 4.23Å; F336-T341 WeakPolarHBondContact CD1-OG1 3.4Å
337	M	91.5	Very high	88.8	Confident	84 Å²	84	57.2 Å²	57.2	41%	0.414	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	121.8	179.2	-81.4	-166.6	161	0	0	110.1	W326 N339 I340 T341	W326-M337 HydrophobicContact CE3-CG 4.05Å; W326-M337 HydrophobicContact CH2-CE 4.34Å; W326-M337 HydrophobicContact CH2-CG 4.14Å; W326-M337 HydrophobicContact CZ3-CB 4.35Å; W326-M337 HydrophobicContact CZ3-CG 3.46Å; W326-M337 VanDerWaalsContact CZ3-CG 3.46Å; M337-N339 VanDerWaalsContact C-N 3.26Å; M337-N339 PolarHBondContact O-N 3.49Å; M337-I340 HydrophobicContact CB-CB 4.13Å; M337-I340 HydrophobicContact CB-CD1 3.85Å; M337-I340 HydrophobicContact CB-CG1 3.78Å; M337-I340 HydrophobicContact CG-CD1 4.33Å; M337-I340 WeakPolarHBondContact O-CA 3.22Å; M337-I340 WeakPolarHBondContact O-CB 3.27Å; M337-I340 PolarHBondContact O-N 2.86Å; M337-I340 HydrophobicContact SD-CD1 3.94Å; M337-I340 HydrophobicContact SD-CG1 4.46Å; M337-T341 PolarHBondContact O-N 3.47Å; M337-T341 PolarHBondContact O-OG1 3.29Å; M337-T341 VanDerWaalsContact O-OG1 3.11Å
338	K	90.1	Very high	88.2	Confident	13 Å²	13	64.2 Å²	64.2	6%	0.057	30%	0.302	C	S	.	.	H	α-helix	trans	-53.1	-43.4	-175	-178.7	177.2	172.3	-172.4	0	112.5	F323 K325 F336 I340 T341 M342 C358 K359 F361	F323-K338 PolarHBondContact O-NZ 2.72Å; K325-K338 WeakPolarHBondContact O-CB 3.41Å; K325-K338 PolarHBondContact O-N 3.5Å; F336-K338 PolarHBondContact O-N 3.29Å; F336-K338 VanDerWaalsContact O-N 3.16Å; K338-I340 VanDerWaalsContact C-N 3.32Å; K338-I340 PolarHBondContact O-N 3.41Å; K338-T341 PolarHBondContact O-N 3.45Å; K338-M342 HydrophobicContact CG-SD 4.03Å; K338-M342 WeakPolarHBondContact O-CB 3.47Å; K338-M342 VanDerWaalsContact O-CG 3.24Å; K338-M342 WeakPolarHBondContact O-CG 3.35Å; K338-M342 PolarHBondContact O-N 3.47Å; K338-C358 WeakPolarHBondContact CE-O 3.25Å; K338-C358 PolarHBondContact NZ-O 3.38Å; K338-K359 PolarHBondContact NZ-O 2.89Å; K338-F361 HydrophobicContact CD-CB 4.27Å; K338-F361 HydrophobicContact CG-CB 4.02Å
339	N	87.6	Confident	87.5	Confident	113 Å²	113	64.3 Å²	64.3	60%	0.604	30%	0.302	S	S	*	.	H	α-helix	trans	-66.2	-32.2	178.4	-70.1	-8.8	0	0	0	113	M337 K343	M337-N339 VanDerWaalsContact C-N 3.26Å; M337-N339 PolarHBondContact O-N 3.49Å; N339-K343 WeakPolarHBondContact O-CG 3.4Å; N339-K343 PolarHBondContact O-N 2.97Å
340	I	87.9	Confident	87	Confident	77 Å²	77	66.3 Å²	66.3	40%	0.395	31%	0.311	S	S	.	.	H	α-helix	trans	-74.9	-46.1	176.4	-56.8	-177	0	0	0	109.4	F336 M337 K338 M342 K343 Q344	F336-I340 HydrophobicContact CD1-CB 4.48Å; F336-I340 HydrophobicContact CD1-CG2 4.46Å; F336-I340 HydrophobicContact CE1-CB 4.1Å; F336-I340 HydrophobicContact CE1-CG2 3.63Å; F336-I340 HydrophobicContact CZ-CG2 4.23Å; M337-I340 HydrophobicContact CB-CB 4.13Å; M337-I340 HydrophobicContact CB-CD1 3.85Å; M337-I340 HydrophobicContact CB-CG1 3.78Å; M337-I340 HydrophobicContact CG-CD1 4.33Å; M337-I340 WeakPolarHBondContact O-CA 3.22Å; M337-I340 WeakPolarHBondContact O-CB 3.27Å; M337-I340 PolarHBondContact O-N 2.86Å; M337-I340 HydrophobicContact SD-CD1 3.94Å; M337-I340 HydrophobicContact SD-CG1 4.46Å; K338-I340 VanDerWaalsContact C-N 3.32Å; K338-I340 PolarHBondContact O-N 3.41Å; I340-M342 VanDerWaalsContact C-N 3.26Å; I340-M342 PolarHBondContact O-N 2.73Å; I340-K343 PolarHBondContact O-N 3.07Å; I340-K343 VanDerWaalsContact O-N 3.09Å; I340-Q344 PolarHBondContact O-N 3.19Å
341	T	86.2	Confident	86.4	Confident	4 Å²	4	70.3 Å²	70.3	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-55.2	-44.8	175.8	-40.1	0	0	0	0	111.1	A327 F336 M337 K338 K343 Q344 F361	A327-T341 HydrophobicContact CB-CG2 4.43Å; A327-T341 WeakPolarHBondContact CB-OG1 3.49Å; F336-T341 WeakPolarHBondContact CD1-OG1 3.4Å; M337-T341 PolarHBondContact O-N 3.47Å; M337-T341 PolarHBondContact O-OG1 3.29Å; M337-T341 VanDerWaalsContact O-OG1 3.11Å; K338-T341 PolarHBondContact O-N 3.45Å; T341-K343 VanDerWaalsContact C-N 3.3Å; T341-K343 PolarHBondContact O-N 2.81Å; T341-Q344 PolarHBondContact O-N 2.89Å; T341-Q344 VanDerWaalsContact O-N 3.12Å; T341-F361 HydrophobicContact CG2-CD1 4.19Å; T341-F361 HydrophobicContact CG2-CE1 3.42Å; T341-F361 VanDerWaalsContact CG2-CE1 3.42Å; T341-F361 HydrophobicContact CG2-CZ 3.66Å
342	M	85.7	Confident	85.8	Confident	26 Å²	26	70.9 Å²	70.9	13%	0.128	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-36	179.6	-75.3	175.3	48.8	0	0	112.8	K338 I340 Q344 L345 Q350 I353 M354 F361	K338-M342 HydrophobicContact CG-SD 4.03Å; K338-M342 WeakPolarHBondContact O-CB 3.47Å; K338-M342 VanDerWaalsContact O-CG 3.24Å; K338-M342 WeakPolarHBondContact O-CG 3.35Å; K338-M342 PolarHBondContact O-N 3.47Å; I340-M342 VanDerWaalsContact C-N 3.26Å; I340-M342 PolarHBondContact O-N 2.73Å; M342-Q344 VanDerWaalsContact C-N 3.27Å; M342-Q344 PolarHBondContact O-N 3.48Å; M342-L345 WeakPolarHBondContact O-CB 3.27Å; M342-L345 PolarHBondContact O-N 3.2Å; M342-Q350 WeakPolarHBondContact O-CG 3.36Å; M342-I353 HydrophobicContact CE-CG2 3.38Å; M342-I353 HydrophobicContact CG-CG2 3.97Å; M342-I353 HydrophobicContact SD-CG2 3.72Å; M342-M354 HydrophobicContact CE-CG 4.44Å; M342-F361 HydrophobicContact CG-CD2 3.92Å; M342-F361 HydrophobicContact CG-CE2 3.78Å
343	K	86.2	Confident	85.5	Confident	157 Å²	157	68.9 Å²	68.9	68%	0.683	33%	0.326	S	S	*	.	H	α-helix	trans	-71.4	-20.2	177.4	-72.8	175.3	-179.1	-173.9	0	113.4	N339 I340 T341 Q350	N339-K343 WeakPolarHBondContact O-CG 3.4Å; N339-K343 PolarHBondContact O-N 2.97Å; I340-K343 PolarHBondContact O-N 3.07Å; I340-K343 VanDerWaalsContact O-N 3.09Å; T341-K343 VanDerWaalsContact C-N 3.3Å; T341-K343 PolarHBondContact O-N 2.81Å; K343-Q350 PolarHBondContact O-NE2 2.93Å
344	Q	85.7	Confident	85.2	Confident	101 Å²	101	69.9 Å²	69.9	47%	0.472	33%	0.329	S	S	.	.	H	α-helix	trans	-86.1	-10	178.9	-68.2	176.2	-15.9	0	0	113	I340 T341 M342	I340-Q344 PolarHBondContact O-N 3.19Å; T341-Q344 PolarHBondContact O-N 2.89Å; T341-Q344 VanDerWaalsContact O-N 3.12Å; M342-Q344 VanDerWaalsContact C-N 3.27Å; M342-Q344 PolarHBondContact O-N 3.48Å
345	L	84.6	Confident	84.7	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.037	34%	0.335	C	S	.	.	S	Bend	trans	-68.3	155.9	179.1	-70.5	171.5	0	0	0	112.5	M342 E349 Q350 I353 F361 Q368	M342-L345 WeakPolarHBondContact O-CB 3.27Å; M342-L345 PolarHBondContact O-N 3.2Å; L345-E349 HydrophobicContact CB-CB 4.12Å; L345-E349 HydrophobicContact CD1-CB 4.25Å; L345-E349 HydrophobicContact CD2-CB 4.42Å; L345-Q350 HydrophobicContact CB-CG 3.81Å; L345-Q350 WeakPolarHBondContact O-CG 3.34Å; L345-Q350 PolarHBondContact O-NE2 3.47Å; L345-I353 HydrophobicContact CD1-CD1 3.33Å; L345-I353 HydrophobicContact CD1-CG1 4.48Å; L345-F361 HydrophobicContact CD1-CE2 3.96Å; L345-F361 HydrophobicContact CD1-CZ 4.16Å; L345-F361 HydrophobicContact CD2-CZ 4.39Å; L345-Q368 WeakPolarHBondContact CD2-O 3.48Å
346	P	82.5	Confident	84.5	Confident	53 Å²	53	72.6 Å²	72.6	34%	0.344	35%	0.346	S	S	.	.			trans	-53.7	142.4	163.6	-24.4	34.5	0	0	0	111.7	Y348 E349 Q350	P346-Y348 HydrophobicContact CB-CD1 3.63Å; P346-Y348 HydrophobicContact CB-CE1 3.22Å; P346-Y348 HydrophobicContact CG-CE1 3.98Å; P346-Y348 PolarHBondContact O-N 3.28Å; P346-E349 WeakPolarHBondContact O-CA 3.38Å; P346-E349 PolarHBondContact O-N 3.46Å; P346-Q350 PolarHBondContact O-N 3.39Å
347	I	83.9	Confident	84.4	Confident	125 Å²	125	75.7 Å²	75.7	64%	0.641	36%	0.364	S	S	*	.	H	α-helix	trans	-49.9	-40.5	-174.7	-64.5	168.8	0	0	0	112.5	E349 Q350 N351	I347-E349 VanDerWaalsContact C-N 3.32Å; I347-E349 PolarHBondContact O-N 3.07Å; I347-Q350 WeakPolarHBondContact O-CB 3.43Å; I347-Q350 PolarHBondContact O-N 3.4Å; I347-N351 PolarHBondContact O-N 2.96Å; I347-N351 PolarHBondContact O-ND2 3.41Å
348	Y	82	Confident	84.1	Confident	148 Å²	148	72.3 Å²	72.3	58%	0.58	35%	0.349	S	S	*	.	H	α-helix	trans	-66.1	-31.7	179.5	70.3	-91.6	0	0	0	113.3	P346 Y352	P346-Y348 HydrophobicContact CB-CD1 3.63Å; P346-Y348 HydrophobicContact CB-CE1 3.22Å; P346-Y348 HydrophobicContact CG-CE1 3.98Å; P346-Y348 PolarHBondContact O-N 3.28Å; Y348-Y352 WeakPolarHBondContact O-CB 3.21Å; Y348-Y352 PolarHBondContact O-N 3.42Å
349	E	83.1	Confident	84.1	Confident	3 Å²	3	72.9 Å²	72.9	1%	0.014	35%	0.352	C	S	.	.	H	α-helix	trans	-78.9	-35.2	173.6	-71.6	-76	156.2	0	0	111.1	K180 L345 P346 I347 N351 Y352 I353 T369 R373	K180-E349 IonicContact NZ-OE1 3.62Å; K180-E349 PolarHBondContact NZ-OE1 2.85Å; L345-E349 HydrophobicContact CB-CB 4.12Å; L345-E349 HydrophobicContact CD1-CB 4.25Å; L345-E349 HydrophobicContact CD2-CB 4.42Å; P346-E349 WeakPolarHBondContact O-CA 3.38Å; P346-E349 PolarHBondContact O-N 3.46Å; I347-E349 VanDerWaalsContact C-N 3.32Å; I347-E349 PolarHBondContact O-N 3.07Å; E349-N351 PolarHBondContact O-N 3.26Å; E349-Y352 PolarHBondContact O-N 2.91Å; E349-I353 WeakPolarHBondContact O-CB 3.4Å; E349-I353 VanDerWaalsContact O-CG1 3.31Å; E349-I353 WeakPolarHBondContact O-CG1 3.11Å; E349-I353 PolarHBondContact O-N 3.47Å; E349-T369 HydrophobicContact CG-CG2 3.8Å; E349-R373 IonicContact OE1-CZ 3.28Å; E349-R373 IonicContact OE1-NH2 3.25Å; E349-R373 PolarHBondContact OE1-NH2 2.84Å; E349-R373 IonicContact OE2-CZ 3.89Å; E349-R373 IonicContact OE2-NH2 3.49Å; E349-R373 PolarHBondContact OE2-NH2 2.84Å
350	Q	85.4	Confident	84.4	Confident	44 Å²	44	67.7 Å²	67.7	21%	0.206	32%	0.324	C	S	.	.	H	α-helix	trans	-55.9	-52.2	172.4	-61.3	-168.4	23.4	0	0	110.7	M342 K343 L345 P346 I347 Y352 I353 M354	M342-Q350 WeakPolarHBondContact O-CG 3.36Å; K343-Q350 PolarHBondContact O-NE2 2.93Å; L345-Q350 HydrophobicContact CB-CG 3.81Å; L345-Q350 WeakPolarHBondContact O-CG 3.34Å; L345-Q350 PolarHBondContact O-NE2 3.47Å; P346-Q350 PolarHBondContact O-N 3.39Å; I347-Q350 WeakPolarHBondContact O-CB 3.43Å; I347-Q350 PolarHBondContact O-N 3.4Å; Q350-Y352 VanDerWaalsContact C-N 3.32Å; Q350-Y352 PolarHBondContact O-N 2.99Å; Q350-I353 PolarHBondContact O-N 3.22Å; Q350-M354 WeakPolarHBondContact O-CB 3.44Å; Q350-M354 VanDerWaalsContact O-CG 3.3Å; Q350-M354 WeakPolarHBondContact O-CG 3.32Å; Q350-M354 PolarHBondContact O-N 3.31Å
351	N	82.6	Confident	84.7	Confident	85 Å²	85	64.1 Å²	64.1	46%	0.455	31%	0.305	S	S	.	.	H	α-helix	trans	-59.4	-42.7	178.2	-69.7	-19.3	0	0	0	111.6	I347 E349 I353 N355	I347-N351 PolarHBondContact O-N 2.96Å; I347-N351 PolarHBondContact O-ND2 3.41Å; E349-N351 PolarHBondContact O-N 3.26Å; N351-I353 PolarHBondContact O-N 3.22Å; N351-N355 VanDerWaalsContact O-CB 3.23Å; N351-N355 WeakPolarHBondContact O-CB 3.44Å; N351-N355 PolarHBondContact O-N 2.83Å; N351-N355 PolarHBondContact O-ND2 2.86Å
352	Y	81.4	Confident	85.1	Confident	75 Å²	75	64 Å²	64	29%	0.294	30%	0.304	S	S	.	.	H	α-helix	trans	-60.9	-45.4	178	179.1	-91.9	0	0	0	112.4	Y348 E349 Q350 R356 R373	Y348-Y352 WeakPolarHBondContact O-CB 3.21Å; Y348-Y352 PolarHBondContact O-N 3.42Å; E349-Y352 PolarHBondContact O-N 2.91Å; Q350-Y352 VanDerWaalsContact C-N 3.32Å; Q350-Y352 PolarHBondContact O-N 2.99Å; Y352-R356 WeakPolarHBondContact O-CB 3.47Å; Y352-R356 PolarHBondContact O-N 3.31Å; Y352-R356 PolarHBondContact OH-NH1 3.4Å; Y352-R373 HydrophobicContact CE1-CB 4.07Å
353	I	82.9	Confident	85.6	Confident	3 Å²	3	63 Å²	63	2%	0.015	30%	0.299	C	S	.	.	H	α-helix	trans	-73.3	-39.1	-176.7	-71.5	-175.2	0	0	0	111.5	M342 L345 E349 Q350 N351 N357 C358 F361 N370	M342-I353 HydrophobicContact CE-CG2 3.38Å; M342-I353 HydrophobicContact CG-CG2 3.97Å; M342-I353 HydrophobicContact SD-CG2 3.72Å; L345-I353 HydrophobicContact CD1-CD1 3.33Å; L345-I353 HydrophobicContact CD1-CG1 4.48Å; E349-I353 WeakPolarHBondContact O-CB 3.4Å; E349-I353 VanDerWaalsContact O-CG1 3.31Å; E349-I353 WeakPolarHBondContact O-CG1 3.11Å; E349-I353 PolarHBondContact O-N 3.47Å; Q350-I353 PolarHBondContact O-N 3.22Å; N351-I353 PolarHBondContact O-N 3.22Å; I353-N357 PolarHBondContact O-N 3.22Å; I353-C358 HydrophobicContact CB-CB 4.26Å; I353-C358 HydrophobicContact CG2-CB 3.23Å; I353-C358 PolarHBondContact O-N 3.48Å; I353-C358 VanDerWaalsContact O-N 3.1Å; I353-F361 HydrophobicContact CD1-CD2 4.28Å; I353-F361 HydrophobicContact CD1-CE2 3.65Å; I353-N370 HydrophobicContact CD1-CB 3.86Å
354	M	80.8	Confident	86	Confident	105 Å²	105	55.9 Å²	55.9	52%	0.517	27%	0.269	S	S	.	.	H	α-helix	trans	-65.1	-48.5	175.2	-71.3	-178.4	-174.9	0	0	111.1	M342 Q350 R356 N357	M342-M354 HydrophobicContact CE-CG 4.44Å; Q350-M354 WeakPolarHBondContact O-CB 3.44Å; Q350-M354 VanDerWaalsContact O-CG 3.3Å; Q350-M354 WeakPolarHBondContact O-CG 3.32Å; Q350-M354 PolarHBondContact O-N 3.31Å; M354-R356 PolarHBondContact O-N 3.25Å; M354-N357 PolarHBondContact O-N 3.3Å; M354-N357 VanDerWaalsContact O-N 3.13Å
355	N	78.3	Confident	86.4	Confident	143 Å²	143	51.2 Å²	51.2	77%	0.765	25%	0.247	S	C	*	.	H	α-helix	trans	-63.4	-27.2	-179.3	-71.2	-15.3	0	0	0	113.4	N351	N351-N355 VanDerWaalsContact O-CB 3.23Å; N351-N355 WeakPolarHBondContact O-CB 3.44Å; N351-N355 PolarHBondContact O-N 2.83Å; N351-N355 PolarHBondContact O-ND2 2.86Å
356	R	79.3	Confident	86.8	Confident	118 Å²	118	52.1 Å²	52.1	45%	0.445	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	5.3	179	-70.3	-164.7	172.2	-146.8	-3.2	114.4	Y352 M354	Y352-R356 WeakPolarHBondContact O-CB 3.47Å; Y352-R356 PolarHBondContact O-N 3.31Å; Y352-R356 PolarHBondContact OH-NH1 3.4Å; M354-R356 PolarHBondContact O-N 3.25Å
357	N	83.9	Confident	87.2	Confident	105 Å²	105	51.4 Å²	51.4	56%	0.561	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.1	66.4	-175.9	-171.4	12.1	0	0	0	111.7	I353 M354 K359	I353-N357 PolarHBondContact O-N 3.22Å; M354-N357 PolarHBondContact O-N 3.3Å; M354-N357 VanDerWaalsContact O-N 3.13Å; N357-K359 PolarHBondContact ND2-NZ 3.11Å; N357-K359 WeakPolarHBondContact O-CD 3.33Å; N357-K359 WeakPolarHBondContact O-CE 3.37Å; N357-K359 WeakPolarHBondContact O-CG 3.45Å; N357-K359 PolarHBondContact O-N 2.88Å; N357-K359 VanDerWaalsContact O-N 3.13Å
358	C	86	Confident	87.4	Confident	14 Å²	14	48.6 Å²	48.6	10%	0.095	23%	0.231	C	C	.	.			trans	-47	121.6	-175.5	169.6	0	0	0	0	112.6	K338 I353 I360 N370	K338-C358 WeakPolarHBondContact CE-O 3.25Å; K338-C358 PolarHBondContact NZ-O 3.38Å; I353-C358 HydrophobicContact CB-CB 4.26Å; I353-C358 HydrophobicContact CG2-CB 3.23Å; I353-C358 PolarHBondContact O-N 3.48Å; I353-C358 VanDerWaalsContact O-N 3.1Å; C358-I360 PolarHBondContact SG-O 2.95Å; C358-I360 VanDerWaalsContact SG-O 3.36Å; C358-N370 PolarHBondContact SG-ND2 3.48Å; C358-N370 VanDerWaalsContact SG-ND2 3.37Å
359	K	89.3	Confident	87.8	Confident	25 Å²	25	42.3 Å²	42.3	11%	0.109	21%	0.208	C	C	.	.			trans	-91.5	-53.5	-174.8	-51.5	-64.3	-179.7	165.6	0	111.7	K338 N357 D378 V381	K338-K359 PolarHBondContact NZ-O 2.89Å; N357-K359 PolarHBondContact ND2-NZ 3.11Å; N357-K359 WeakPolarHBondContact O-CD 3.33Å; N357-K359 WeakPolarHBondContact O-CE 3.37Å; N357-K359 WeakPolarHBondContact O-CG 3.45Å; N357-K359 PolarHBondContact O-N 2.88Å; N357-K359 VanDerWaalsContact O-N 3.13Å; K359-D378 WeakPolarHBondContact CD-OD1 3.45Å; K359-D378 WeakPolarHBondContact CE-OD1 3.33Å; K359-D378 IonicContact NZ-OD1 2.66Å; K359-D378 PolarHBondContact NZ-OD1 3Å; K359-D378 IonicContact NZ-OD2 3.93Å; K359-D378 PolarHBondContact NZ-OD2 2.99Å; K359-V381 HydrophobicContact CB-CG2 3.42Å; K359-V381 VanDerWaalsContact CB-CG2 3.42Å; K359-V381 HydrophobicContact CG-CG2 3.86Å
360	I	93.9	Very high	88.3	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.015	21%	0.209	C	C	.	.			trans	-114.8	132.3	175.6	-62.4	178.2	0	0	0	108.4	F323 C358 I362 N370 A372 I375 I384	F323-I360 HydrophobicContact CD1-CB 4.44Å; F323-I360 HydrophobicContact CD1-CD1 4.24Å; F323-I360 HydrophobicContact CD1-CG1 3.92Å; F323-I360 HydrophobicContact CD1-CG2 3.95Å; F323-I360 HydrophobicContact CE1-CD1 4.35Å; F323-I360 HydrophobicContact CE1-CG1 4.48Å; F323-I360 HydrophobicContact CE1-CG2 4.19Å; F323-I360 HydrophobicContact CG-CG1 4.41Å; C358-I360 PolarHBondContact SG-O 2.95Å; C358-I360 VanDerWaalsContact SG-O 3.36Å; I360-I362 HydrophobicContact CG2-CD1 4.25Å; I360-I362 HydrophobicContact CG2-CG1 3.93Å; I360-N370 PolarHBondContact O-ND2 2.88Å; I360-A372 HydrophobicContact CB-CB 4.43Å; I360-A372 HydrophobicContact CG2-CB 4.12Å; I360-I375 HydrophobicContact CD1-CD1 4.25Å; I360-I375 HydrophobicContact CD1-CG2 4.36Å; I360-I384 HydrophobicContact CD1-CD1 4.09Å; I360-I384 HydrophobicContact CD1-CG2 4.49Å
361	F	94.7	Very high	88.7	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.009	21%	0.207	C	C	.	.			trans	-115.7	116.4	176.3	-162.8	-71.1	0	0	0	110.1	A327 I328 K338 T341 M342 L345 I353 E363 N370	A327-F361 WeakPolarHBondContact CA-O 3.31Å; A327-F361 HydrophobicContact CB-CB 4.11Å; A327-F361 HydrophobicContact CB-CD1 3.58Å; A327-F361 HydrophobicContact CB-CE1 4.37Å; A327-F361 HydrophobicContact CB-CG 4.09Å; I328-F361 PolarHBondContact N-O 3.23Å; K338-F361 HydrophobicContact CD-CB 4.27Å; K338-F361 HydrophobicContact CG-CB 4.02Å; T341-F361 HydrophobicContact CG2-CD1 4.19Å; T341-F361 HydrophobicContact CG2-CE1 3.42Å; T341-F361 VanDerWaalsContact CG2-CE1 3.42Å; T341-F361 HydrophobicContact CG2-CZ 3.66Å; M342-F361 HydrophobicContact CG-CD2 3.92Å; M342-F361 HydrophobicContact CG-CE2 3.78Å; L345-F361 HydrophobicContact CD1-CE2 3.96Å; L345-F361 HydrophobicContact CD1-CZ 4.16Å; L345-F361 HydrophobicContact CD2-CZ 4.39Å; I353-F361 HydrophobicContact CD1-CD2 4.28Å; I353-F361 HydrophobicContact CD1-CE2 3.65Å; F361-E363 HydrophobicContact CE1-CB 4.06Å; F361-N370 HydrophobicContact CD2-CB 4.15Å; F361-N370 HydrophobicContact CE2-CB 3.99Å; F361-N370 HydrophobicContact CZ-CB 4.25Å
362	I	96	Very high	89.2	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-120.9	110.1	172.8	-52.3	-175.7	0	0	0	106.6	L245 C249 L252 M253 I328 I360 E364 N370 A371 A372	L245-I362 HydrophobicContact CD2-CD1 4.49Å; C249-I362 HydrophobicContact CB-CD1 3.75Å; L252-I362 HydrophobicContact CB-CG2 3.71Å; L252-I362 HydrophobicContact CD1-CG2 3.54Å; L252-I362 HydrophobicContact CG-CG2 4.3Å; M253-I362 HydrophobicContact CG-CD1 3.88Å; M253-I362 HydrophobicContact SD-CD1 4.06Å; I328-I362 HydrophobicContact CB-CB 4.4Å; I328-I362 HydrophobicContact CB-CG1 4.18Å; I328-I362 HydrophobicContact CB-CG2 4.19Å; I328-I362 HydrophobicContact CD1-CD1 4.04Å; I328-I362 HydrophobicContact CD1-CG1 3.79Å; I328-I362 HydrophobicContact CG1-CG1 4.47Å; I328-I362 HydrophobicContact CG2-CG2 4.11Å; I360-I362 HydrophobicContact CG2-CD1 4.25Å; I360-I362 HydrophobicContact CG2-CG1 3.93Å; I362-E364 PolarHBondContact O-N 3.35Å; I362-N370 PolarHBondContact N-OD1 3.2Å; I362-N370 WeakPolarHBondContact O-CA 3.47Å; I362-N370 PolarHBondContact O-OD1 2.92Å; I362-A371 HydrophobicContact CB-CB 4.32Å; I362-A371 HydrophobicContact CG2-CB 4.39Å; I362-A371 PolarHBondContact O-N 3.38Å; I362-A372 HydrophobicContact CB-CB 4.28Å; I362-A372 HydrophobicContact CD1-CB 4.02Å; I362-A372 HydrophobicContact CG1-CB 3.89Å
363	E	95.1	Very high	89.6	Confident	5 Å²	5	37 Å²	37	2%	0.023	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-65.8	127.3	-178.8	-170.8	-171.8	-142.3	0	0	110	I328 T329 R331 H332 F361 Q368	I328-E363 PolarHBondContact O-N 3.2Å; T329-E363 VanDerWaalsContact CB-OE2 3.23Å; T329-E363 WeakPolarHBondContact CB-OE2 3.29Å; T329-E363 PolarHBondContact OG1-OE2 3.41Å; R331-E363 IonicContact CZ-OE1 2.92Å; R331-E363 IonicContact NE-OE1 3.3Å; R331-E363 PolarHBondContact NE-OE1 3.41Å; R331-E363 IonicContact NE-OE2 3.78Å; R331-E363 IonicContact NH2-OE1 3.76Å; R331-E363 PolarHBondContact NH2-OE1 2.92Å; R331-E363 IonicContact NH2-OE2 3.47Å; H332-E363 IonicContact CD2-OE2 3.77Å; F361-E363 HydrophobicContact CE1-CB 4.06Å; E363-Q368 HydrophobicContact CG-CB 4.39Å
364	E	94.1	Very high	89.9	Confident	9 Å²	9	38.3 Å²	38.3	4%	0.042	19%	0.193	C	C	.	.			trans	-78.1	121.1	170.8	-158.7	-70.7	131.7	0	0	108.8	N207 Y248 I362 F366 S367 Q368 T369	N207-E364 PolarHBondContact ND2-OE1 3.07Å; N207-E364 PolarHBondContact OD1-OE1 3.48Å; Y248-E364 HydrophobicContact CE1-CG 4.35Å; Y248-E364 PolarHBondContact OH-OE1 2.93Å; I362-E364 PolarHBondContact O-N 3.35Å; E364-F366 PolarHBondContact O-N 2.98Å; E364-F366 PolarHBondContact OE2-N 2.86Å; E364-S367 WeakPolarHBondContact OE2-CA 3.43Å; E364-S367 VanDerWaalsContact OE2-CB 3.22Å; E364-S367 WeakPolarHBondContact OE2-CB 3.27Å; E364-S367 PolarHBondContact OE2-N 3.35Å; E364-S367 PolarHBondContact OE2-OG 2.82Å; E364-Q368 WeakPolarHBondContact O-CA 3.48Å; E364-Q368 PolarHBondContact O-N 2.94Å; E364-T369 VanDerWaalsContact CB-O 3.31Å; E364-T369 WeakPolarHBondContact CB-O 3.31Å; E364-T369 PolarHBondContact N-O 2.92Å
365	P	95.1	Very high	90.4	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.019	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20	-165.2	22.3	-34.8	0	0	0	115.9	N207 L210 Y248 Q271 I330	N207-P365 WeakPolarHBondContact OD1-CG 3.38Å; L210-P365 HydrophobicContact CD2-CB 3.78Å; L210-P365 HydrophobicContact CD2-CG 3.76Å; Y248-P365 WeakPolarHBondContact OH-CD 3.3Å; Q271-P365 PolarHBondContact NE2-O 3.08Å; I330-P365 HydrophobicContact CD1-CB 4.11Å; I330-P365 HydrophobicContact CD1-CG 4.15Å; I330-P365 HydrophobicContact CG1-CB 4.08Å
366	F	93.4	Very high	90.8	Very high	26 Å²	26	31.4 Å²	31.4	11%	0.114	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-52.6	-178.2	-64.4	-76.4	0	0	0	112.7	Y206 L210 Y280 E364	Y206-F366 VanDerWaalsContact C-CE2 3.4Å; Y206-F366 WeakPolarHBondContact O-CE2 3.3Å; L210-F366 HydrophobicContact CB-CE2 4.07Å; L210-F366 HydrophobicContact CB-CZ 4.05Å; L210-F366 HydrophobicContact CD2-CE2 3.85Å; L210-F366 HydrophobicContact CD2-CZ 3.98Å; Y280-F366 HydrophobicContact CD2-CB 3.81Å; Y280-F366 HydrophobicContact CD2-CD1 4Å; Y280-F366 HydrophobicContact CD2-CG 4.08Å; Y280-F366 HydrophobicContact CE2-CB 4.32Å; E364-F366 PolarHBondContact O-N 2.98Å; E364-F366 PolarHBondContact OE2-N 2.86Å
367	S	89.3	Confident	91.4	Very high	37 Å²	37	27.7 Å²	27.7	26%	0.259	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-13	-179	68.8	0	0	0	0	114.1	E364 T369	E364-S367 WeakPolarHBondContact OE2-CA 3.43Å; E364-S367 VanDerWaalsContact OE2-CB 3.22Å; E364-S367 WeakPolarHBondContact OE2-CB 3.27Å; E364-S367 PolarHBondContact OE2-N 3.35Å; E364-S367 PolarHBondContact OE2-OG 2.82Å; S367-T369 PolarHBondContact O-N 3.28Å; S367-T369 PolarHBondContact OG-OG1 3.2Å
368	Q	88.7	Confident	91.7	Very high	67 Å²	67	27.3 Å²	27.3	31%	0.313	15%	0.145	S	C	.	.			trans	60.8	10	-177.2	-57.4	173.8	25.4	0	0	114.2	L345 E363 E364	L345-Q368 WeakPolarHBondContact CD2-O 3.48Å; E363-Q368 HydrophobicContact CG-CB 4.39Å; E364-Q368 WeakPolarHBondContact O-CA 3.48Å; E364-Q368 PolarHBondContact O-N 2.94Å
369	T	90.6	Very high	92.1	Very high	15 Å²	15	32 Å²	32	9%	0.092	17%	0.169	C	C	.	.			trans	-75.5	172.3	176.7	66.3	0	0	0	0	112.1	E349 E364 S367 A371	E349-T369 HydrophobicContact CG-CG2 3.8Å; E364-T369 VanDerWaalsContact CB-O 3.31Å; E364-T369 WeakPolarHBondContact CB-O 3.31Å; E364-T369 PolarHBondContact N-O 2.92Å; S367-T369 PolarHBondContact O-N 3.28Å; S367-T369 PolarHBondContact OG-OG1 3.2Å; T369-A371 PolarHBondContact O-N 2.71Å
370	N	93	Very high	92.3	Very high	5 Å²	5	32 Å²	32	3%	0.027	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-84.1	112.4	175.8	-173.9	9.7	0	0	0	111.7	I353 C358 I360 F361 I362 A372 R373	I353-N370 HydrophobicContact CD1-CB 3.86Å; C358-N370 PolarHBondContact SG-ND2 3.48Å; C358-N370 VanDerWaalsContact SG-ND2 3.37Å; I360-N370 PolarHBondContact O-ND2 2.88Å; F361-N370 HydrophobicContact CD2-CB 4.15Å; F361-N370 HydrophobicContact CE2-CB 3.99Å; F361-N370 HydrophobicContact CZ-CB 4.25Å; I362-N370 PolarHBondContact N-OD1 3.2Å; I362-N370 WeakPolarHBondContact O-CA 3.47Å; I362-N370 PolarHBondContact O-OD1 2.92Å; N370-A372 VanDerWaalsContact C-N 3.28Å; N370-A372 PolarHBondContact O-N 3.22Å; N370-A372 WeakPolarHBondContact OD1-CB 3.41Å; N370-A372 PolarHBondContact OD1-N 3.21Å; N370-R373 WeakPolarHBondContact O-CB 3.27Å; N370-R373 PolarHBondContact O-N 3.03Å; N370-R373 PolarHBondContact O-NE 3.37Å
371	A	94.1	Very high	92.3	Very high	21 Å²	21	32.4 Å²	32.4	17%	0.174	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-28.7	173.8	0	0	0	0	0	112.8	Y248 C249 L252 I362 T369 R373	Y248-A371 HydrophobicContact CD1-CB 4.05Å; Y248-A371 HydrophobicContact CE1-CB 3.78Å; C249-A371 PolarHBondContact SG-O 3.31Å; L252-A371 HydrophobicContact CD1-CB 4.14Å; I362-A371 HydrophobicContact CB-CB 4.32Å; I362-A371 HydrophobicContact CG2-CB 4.39Å; I362-A371 PolarHBondContact O-N 3.38Å; T369-A371 PolarHBondContact O-N 2.71Å; A371-R373 VanDerWaalsContact C-N 3.26Å; A371-R373 PolarHBondContact O-N 3.42Å
372	A	94.1	Very high	92.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	20.7	179.3	0	0	0	0	0	113.8	I360 I362 N370 S374 I375	I360-A372 HydrophobicContact CB-CB 4.43Å; I360-A372 HydrophobicContact CG2-CB 4.12Å; I362-A372 HydrophobicContact CB-CB 4.28Å; I362-A372 HydrophobicContact CD1-CB 4.02Å; I362-A372 HydrophobicContact CG1-CB 3.89Å; N370-A372 VanDerWaalsContact C-N 3.28Å; N370-A372 PolarHBondContact O-N 3.22Å; N370-A372 WeakPolarHBondContact OD1-CB 3.41Å; N370-A372 PolarHBondContact OD1-N 3.21Å; A372-S374 PolarHBondContact O-N 3.05Å; A372-I375 HydrophobicContact CB-CD1 4.13Å; A372-I375 WeakPolarHBondContact O-CB 3.36Å; A372-I375 PolarHBondContact O-N 3.07Å
373	R	89.7	Confident	92.3	Very high	71 Å²	71	41.1 Å²	41.1	27%	0.268	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-19.9	-177.3	60.1	176	51.6	170.5	-14.7	115.9	E349 Y352 N370 A371 I375	E349-R373 IonicContact OE1-CZ 3.28Å; E349-R373 IonicContact OE1-NH2 3.25Å; E349-R373 PolarHBondContact OE1-NH2 2.84Å; E349-R373 IonicContact OE2-CZ 3.89Å; E349-R373 IonicContact OE2-NH2 3.49Å; E349-R373 PolarHBondContact OE2-NH2 2.84Å; Y352-R373 HydrophobicContact CE1-CB 4.07Å; N370-R373 WeakPolarHBondContact O-CB 3.27Å; N370-R373 PolarHBondContact O-N 3.03Å; N370-R373 PolarHBondContact O-NE 3.37Å; A371-R373 VanDerWaalsContact C-N 3.26Å; A371-R373 PolarHBondContact O-N 3.42Å; R373-I375 VanDerWaalsContact C-N 3.26Å
374	S	88.5	Confident	92.3	Very high	29 Å²	29	41 Å²	41	20%	0.203	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-21.9	175	51.8	0	0	0	0	111.9	G243 R244 A372 H376	G243-S374 VanDerWaalsContact CA-O 3.26Å; G243-S374 WeakPolarHBondContact CA-O 3.48Å; R244-S374 PolarHBondContact O-OG 3.34Å; A372-S374 PolarHBondContact O-N 3.05Å; S374-H376 PolarHBondContact O-CE1 2.87Å; S374-H376 PolarHBondContact O-N 3.45Å; S374-H376 PolarHBondContact O-ND1 3.3Å
375	I	92.3	Very high	92.4	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.026	23%	0.229	C	C	.	.			trans	-88.3	92.8	-177.7	-49.6	178.7	0	0	0	109.7	G243 L245 I360 A372 R373 I380 V381 I384	G243-I375 WeakPolarHBondContact O-CA 3.45Å; G243-I375 WeakPolarHBondContact O-CG1 3.24Å; L245-I375 HydrophobicContact CD2-CD1 3.6Å; L245-I375 HydrophobicContact CG-CD1 3.96Å; I360-I375 HydrophobicContact CD1-CD1 4.25Å; I360-I375 HydrophobicContact CD1-CG2 4.36Å; A372-I375 HydrophobicContact CB-CD1 4.13Å; A372-I375 WeakPolarHBondContact O-CB 3.36Å; A372-I375 PolarHBondContact O-N 3.07Å; R373-I375 VanDerWaalsContact C-N 3.26Å; I375-I380 HydrophobicContact CG2-CG2 4.21Å; I375-V381 HydrophobicContact CG2-CG2 3.71Å; I375-I384 HydrophobicContact CD1-CD1 3.92Å; I375-I384 HydrophobicContact CG2-CD1 4.22Å
376	H	86.3	Confident	92.5	Very high	99 Å²	99	49.3 Å²	49.3	46%	0.458	25%	0.251	S	S	.	.			trans	-122.5	-12.1	-176.4	59.3	-77.9	0	0	0	113.9	S374	S374-H376 PolarHBondContact O-CE1 2.87Å; S374-H376 PolarHBondContact O-N 3.45Å; S374-H376 PolarHBondContact O-ND1 3.3Å
377	S	90.4	Very high	92.7	Very high	40 Å²	40	48.2 Å²	48.2	28%	0.28	25%	0.247	S	C	.	.			trans	-93.1	131.8	179.9	173	0	0	0	0	111.4	N379 I380 V381	S377-N379 PolarHBondContact O-N 2.79Å; S377-N379 PolarHBondContact OG-N 2.83Å; S377-I380 PolarHBondContact O-N 3.04Å; S377-V381 WeakPolarHBondContact O-CG2 3.25Å; S377-V381 PolarHBondContact O-N 3.43Å; S377-V381 VanDerWaalsContact O-N 3.12Å
378	D	92.1	Very high	93.1	Very high	97 Å²	97	46.5 Å²	46.5	52%	0.519	24%	0.235	S	C	.	.	H	α-helix	trans	-60.5	-34.9	173.5	-74.7	-53.5	0	0	0	112.2	K359 I380 V381 S382	K359-D378 WeakPolarHBondContact CD-OD1 3.45Å; K359-D378 WeakPolarHBondContact CE-OD1 3.33Å; K359-D378 IonicContact NZ-OD1 2.66Å; K359-D378 PolarHBondContact NZ-OD1 3Å; K359-D378 IonicContact NZ-OD2 3.93Å; K359-D378 PolarHBondContact NZ-OD2 2.99Å; D378-I380 PolarHBondContact O-N 2.74Å; D378-V381 PolarHBondContact O-N 2.95Å; D378-S382 WeakPolarHBondContact O-CB 3.47Å; D378-S382 PolarHBondContact O-N 3.32Å
379	N	93.7	Very high	93.5	Very high	112 Å²	112	47 Å²	47	60%	0.599	24%	0.239	S	C	*	.	H	α-helix	trans	-62.3	-44.2	175.7	-65.8	-10.5	0	0	0	111	S377 V381 S382 Y383	S377-N379 PolarHBondContact O-N 2.79Å; S377-N379 PolarHBondContact OG-N 2.83Å; N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 PolarHBondContact O-N 2.94Å; N379-S382 WeakPolarHBondContact O-CB 3.47Å; N379-S382 PolarHBondContact O-N 3.41Å; N379-Y383 HydrophobicContact CB-CE2 4.35Å; N379-Y383 WeakPolarHBondContact O-CD2 3.29Å; N379-Y383 PolarHBondContact O-N 3.17Å
380	I	93.1	Very high	93.8	Very high	25 Å²	25	51.2 Å²	51.2	13%	0.128	26%	0.256	C	S	.	.	H	α-helix	trans	-64.2	-40.8	177.6	-62.3	-62.1	0	0	0	111.4	G243 R244 I375 S377 D378 S382 Y383 I384	G243-I380 WeakPolarHBondContact O-CG2 3.41Å; R244-I380 HydrophobicContact CB-CG2 4.38Å; R244-I380 HydrophobicContact CG-CD1 4.1Å; R244-I380 HydrophobicContact CG-CG2 3.87Å; I375-I380 HydrophobicContact CG2-CG2 4.21Å; S377-I380 PolarHBondContact O-N 3.04Å; D378-I380 PolarHBondContact O-N 2.74Å; I380-S382 VanDerWaalsContact C-N 3.31Å; I380-S382 PolarHBondContact O-N 3.03Å; I380-Y383 HydrophobicContact CD1-CD2 4.43Å; I380-Y383 PolarHBondContact O-N 3.49Å; I380-I384 HydrophobicContact CG2-CD1 4Å; I380-I384 WeakPolarHBondContact O-CG1 3.3Å; I380-I384 PolarHBondContact O-N 3.29Å
381	V	94	Very high	94.1	Very high	12 Å²	12	51 Å²	51	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-39.1	176.6	177.5	0	0	0	0	110.9	K359 I375 S377 D378 N379 I384 K385	K359-V381 HydrophobicContact CB-CG2 3.42Å; K359-V381 VanDerWaalsContact CB-CG2 3.42Å; K359-V381 HydrophobicContact CG-CG2 3.86Å; I375-V381 HydrophobicContact CG2-CG2 3.71Å; S377-V381 WeakPolarHBondContact O-CG2 3.25Å; S377-V381 PolarHBondContact O-N 3.43Å; S377-V381 VanDerWaalsContact O-N 3.12Å; D378-V381 PolarHBondContact O-N 2.95Å; N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 PolarHBondContact O-N 2.94Å; V381-I384 PolarHBondContact O-N 3.1Å; V381-K385 HydrophobicContact CG1-CD 4.49Å; V381-K385 WeakPolarHBondContact O-CG 3.18Å; V381-K385 PolarHBondContact O-N 2.89Å
382	S	95.3	Very high	94.2	Very high	53 Å²	53	50.9 Å²	50.9	37%	0.371	25%	0.251	S	S	.	.	H	α-helix	trans	-61.1	-48	173.9	-170.1	0	0	0	0	111.4	D378 N379 I380 I384 K385 Q386	D378-S382 WeakPolarHBondContact O-CB 3.47Å; D378-S382 PolarHBondContact O-N 3.32Å; N379-S382 WeakPolarHBondContact O-CB 3.47Å; N379-S382 PolarHBondContact O-N 3.41Å; I380-S382 VanDerWaalsContact C-N 3.31Å; I380-S382 PolarHBondContact O-N 3.03Å; S382-I384 VanDerWaalsContact C-N 3.34Å; S382-I384 PolarHBondContact O-N 3.45Å; S382-K385 PolarHBondContact O-N 2.95Å; S382-Q386 WeakPolarHBondContact O-CB 3.44Å; S382-Q386 VanDerWaalsContact O-CG 3.31Å; S382-Q386 WeakPolarHBondContact O-CG 3.42Å; S382-Q386 PolarHBondContact O-N 2.69Å
383	Y	95.1	Very high	94.3	Very high	133 Å²	133	56 Å²	56	52%	0.522	28%	0.275	S	S	.	.	H	α-helix	trans	-59.6	-41.6	175.7	-69.6	-53.9	0	0	0	112.7	N379 I380 Q386 A387	N379-Y383 HydrophobicContact CB-CE2 4.35Å; N379-Y383 WeakPolarHBondContact O-CD2 3.29Å; N379-Y383 PolarHBondContact O-N 3.17Å; I380-Y383 HydrophobicContact CD1-CD2 4.43Å; I380-Y383 PolarHBondContact O-N 3.49Å; Y383-Q386 PolarHBondContact O-N 3.45Å; Y383-A387 WeakPolarHBondContact O-CB 3.41Å; Y383-A387 PolarHBondContact O-N 3.3Å
384	I	96.1	Very high	94.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-59.4	-49.9	175	-68.3	163.7	0	0	0	110.5	I237 L245 I360 I375 I380 V381 S382 Q386 A387 F388	I237-I384 HydrophobicContact CB-CG1 4.1Å; I237-I384 HydrophobicContact CG2-CG1 4.12Å; L245-I384 HydrophobicContact CD1-CD1 4.22Å; L245-I384 HydrophobicContact CD1-CG1 4.25Å; L245-I384 HydrophobicContact CD1-CG2 4.07Å; L245-I384 HydrophobicContact CG-CD1 4.03Å; I360-I384 HydrophobicContact CD1-CD1 4.09Å; I360-I384 HydrophobicContact CD1-CG2 4.49Å; I375-I384 HydrophobicContact CD1-CD1 3.92Å; I375-I384 HydrophobicContact CG2-CD1 4.22Å; I380-I384 HydrophobicContact CG2-CD1 4Å; I380-I384 WeakPolarHBondContact O-CG1 3.3Å; I380-I384 PolarHBondContact O-N 3.29Å; V381-I384 PolarHBondContact O-N 3.1Å; S382-I384 VanDerWaalsContact C-N 3.34Å; S382-I384 PolarHBondContact O-N 3.45Å; I384-Q386 PolarHBondContact O-N 3.01Å; I384-A387 WeakPolarHBondContact O-CB 3.31Å; I384-A387 PolarHBondContact O-N 3.12Å; I384-F388 HydrophobicContact CG2-CD2 4.08Å; I384-F388 HydrophobicContact CG2-CE2 4.04Å; I384-F388 WeakPolarHBondContact O-CD2 3.49Å; I384-F388 PolarHBondContact O-N 2.87Å
385	K	96.5	Very high	94.9	Very high	81 Å²	81	52 Å²	52	35%	0.352	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-44	178.9	-72.2	179.4	178.4	-177.3	0	112.1	V381 S382 A387 F388 I389	V381-K385 HydrophobicContact CG1-CD 4.49Å; V381-K385 WeakPolarHBondContact O-CG 3.18Å; V381-K385 PolarHBondContact O-N 2.89Å; S382-K385 PolarHBondContact O-N 2.95Å; K385-A387 VanDerWaalsContact C-N 3.29Å; K385-A387 PolarHBondContact O-N 3.38Å; K385-F388 PolarHBondContact O-N 3.37Å; K385-I389 VanDerWaalsContact O-CG1 3.31Å; K385-I389 WeakPolarHBondContact O-CG1 3.41Å; K385-I389 PolarHBondContact O-N 3.04Å
386	Q	96.7	Very high	94.9	Very high	106 Å²	106	55.3 Å²	55.3	50%	0.495	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-37.9	177.4	-74.4	177.6	-2.8	0	0	112	S382 Y383 I384 I389 K390	S382-Q386 WeakPolarHBondContact O-CB 3.44Å; S382-Q386 VanDerWaalsContact O-CG 3.31Å; S382-Q386 WeakPolarHBondContact O-CG 3.42Å; S382-Q386 PolarHBondContact O-N 2.69Å; Y383-Q386 PolarHBondContact O-N 3.45Å; I384-Q386 PolarHBondContact O-N 3.01Å; Q386-I389 PolarHBondContact O-N 3.05Å; Q386-K390 VanDerWaalsContact O-CB 3.29Å; Q386-K390 WeakPolarHBondContact O-CB 3.46Å; Q386-K390 PolarHBondContact O-N 3.02Å
387	A	97.4	Very high	95.2	Very high	4 Å²	4	54.9 Å²	54.9	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-43.3	176.2	0	0	0	0	0	112.6	M235 I237 Y383 I384 K385 T391	M235-A387 HydrophobicContact CB-CB 4.01Å; M235-A387 HydrophobicContact CE-CB 3.54Å; M235-A387 HydrophobicContact CG-CB 4.39Å; I237-A387 HydrophobicContact CD1-CB 3.91Å; I237-A387 HydrophobicContact CG2-CB 3.84Å; Y383-A387 WeakPolarHBondContact O-CB 3.41Å; Y383-A387 PolarHBondContact O-N 3.3Å; I384-A387 WeakPolarHBondContact O-CB 3.31Å; I384-A387 PolarHBondContact O-N 3.12Å; K385-A387 VanDerWaalsContact C-N 3.29Å; K385-A387 PolarHBondContact O-N 3.38Å; A387-T391 WeakPolarHBondContact O-CB 3.43Å; A387-T391 PolarHBondContact O-N 3.43Å; A387-T391 VanDerWaalsContact O-N 3.09Å; A387-T391 PolarHBondContact O-OG1 2.76Å
388	F	97.9	Very high	95.3	Very high	1 Å²	1	55.9 Å²	55.9	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-49.5	172.4	-85.1	-77	0	0	0	111.9	W231 M253 F313 I314 Y317 T318 I384 K385 K390 T391 N392	W231-F388 AromaticContact CH2-CD1 3.87Å; W231-F388 HydrophobicContact CH2-CD1 3.87Å; W231-F388 HydrophobicContact CH2-CD2 4Å; W231-F388 AromaticContact CH2-CE1 3.58Å; W231-F388 HydrophobicContact CH2-CE1 3.58Å; W231-F388 AromaticContact CH2-CE2 3.72Å; W231-F388 HydrophobicContact CH2-CE2 3.72Å; W231-F388 HydrophobicContact CH2-CG 4.06Å; W231-F388 AromaticContact CH2-CZ 3.5Å; W231-F388 HydrophobicContact CH2-CZ 3.5Å; W231-F388 VanDerWaalsContact CH2-CZ 3.5Å; W231-F388 HydrophobicContact CZ2-CD1 4.3Å; W231-F388 HydrophobicContact CZ2-CE1 4.39Å; W231-F388 HydrophobicContact CZ2-CG 4.46Å; W231-F388 HydrophobicContact CZ3-CE1 4.18Å; W231-F388 HydrophobicContact CZ3-CE2 4.36Å; W231-F388 AromaticContact CZ3-CZ 3.9Å; W231-F388 HydrophobicContact CZ3-CZ 3.9Å; M253-F388 HydrophobicContact CE-CE2 4.01Å; M253-F388 HydrophobicContact CE-CZ 3.69Å; F313-F388 HydrophobicContact CD1-CE1 4.2Å; F313-F388 AromaticContact CE1-CE1 3.58Å; F313-F388 HydrophobicContact CE1-CE1 3.58Å; F313-F388 AromaticContact CE1-CZ 3.91Å; F313-F388 HydrophobicContact CE1-CZ 3.91Å; F313-F388 HydrophobicContact CZ-CE1 4.12Å; F313-F388 HydrophobicContact CZ-CZ 4.06Å; I314-F388 HydrophobicContact CD1-CD1 3.87Å; I314-F388 HydrophobicContact CD1-CE1 3.92Å; Y317-F388 VanDerWaalsContact CB-CE1 3.45Å; Y317-F388 HydrophobicContact CD2-CE1 4.01Å; Y317-F388 HydrophobicContact CD2-CZ 4.17Å; Y317-F388 HydrophobicContact CG-CE1 4.06Å; Y317-F388 HydrophobicContact CG-CZ 4.15Å; T318-F388 PolarHBondContact OG1-O 3.34Å; I384-F388 HydrophobicContact CG2-CD2 4.08Å; I384-F388 HydrophobicContact CG2-CE2 4.04Å; I384-F388 WeakPolarHBondContact O-CD2 3.49Å; I384-F388 PolarHBondContact O-N 2.87Å; K385-F388 PolarHBondContact O-N 3.37Å; F388-K390 PolarHBondContact O-N 3.42Å; F388-T391 PolarHBondContact O-N 3.14Å; F388-N392 WeakPolarHBondContact O-CB 3.36Å; F388-N392 PolarHBondContact O-N 3Å
389	I	97.6	Very high	95.2	Very high	76 Å²	76	57.5 Å²	57.5	39%	0.39	28%	0.282	S	S	.	.	H	α-helix	trans	-57	-51.8	178.4	-68	163.6	0	0	0	111.2	T318 K385 Q386 T391 N392 E393	T318-I389 HydrophobicContact CG2-CB 4.42Å; T318-I389 HydrophobicContact CG2-CG1 3.84Å; K385-I389 VanDerWaalsContact O-CG1 3.31Å; K385-I389 WeakPolarHBondContact O-CG1 3.41Å; K385-I389 PolarHBondContact O-N 3.04Å; Q386-I389 PolarHBondContact O-N 3.05Å; I389-T391 VanDerWaalsContact C-N 3.3Å; I389-T391 PolarHBondContact O-N 2.81Å; I389-N392 WeakPolarHBondContact O-CB 3.3Å; I389-N392 PolarHBondContact O-N 3.29Å; I389-N392 VanDerWaalsContact O-N 3.12Å; I389-E393 WeakPolarHBondContact O-CG 3.18Å; I389-E393 PolarHBondContact O-N 3.47Å
390	K	96.9	Very high	94.9	Very high	105 Å²	105	56 Å²	56	46%	0.457	28%	0.277	S	S	.	.	H	α-helix	trans	-60.4	-40.9	-179.3	-177.6	177.7	178.6	-170.6	0	111.8	M235 Q386 F388 E393 I394 I404	M235-K390 HydrophobicContact CE-CB 4.42Å; M235-K390 HydrophobicContact CE-CD 4.26Å; Q386-K390 VanDerWaalsContact O-CB 3.29Å; Q386-K390 WeakPolarHBondContact O-CB 3.46Å; Q386-K390 PolarHBondContact O-N 3.02Å; F388-K390 PolarHBondContact O-N 3.42Å; K390-E393 PolarHBondContact O-N 2.96Å; K390-I394 HydrophobicContact CG-CD1 4.21Å; K390-I394 WeakPolarHBondContact O-CG1 3.48Å; K390-I394 PolarHBondContact O-N 3.27Å; K390-I394 VanDerWaalsContact O-N 3.13Å; K390-I404 HydrophobicContact CD-CG2 4.16Å; K390-I404 VanDerWaalsContact CE-CG2 3.48Å
391	T	97.6	Very high	94.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-40.3	177.3	-51.5	0	0	0	0	110.8	W231 F310 I314 A387 F388 I389 E393 I394 L395 L401 I404	W231-T391 PolarHBondContact NE1-OG1 3.42Å; F310-T391 HydrophobicContact CE1-CG2 4.19Å; F310-T391 HydrophobicContact CZ-CG2 4.12Å; I314-T391 HydrophobicContact CD1-CG2 3.82Å; I314-T391 HydrophobicContact CG1-CG2 3.84Å; I314-T391 HydrophobicContact CG2-CG2 4.01Å; A387-T391 WeakPolarHBondContact O-CB 3.43Å; A387-T391 PolarHBondContact O-N 3.43Å; A387-T391 VanDerWaalsContact O-N 3.09Å; A387-T391 PolarHBondContact O-OG1 2.76Å; F388-T391 PolarHBondContact O-N 3.14Å; I389-T391 VanDerWaalsContact C-N 3.3Å; I389-T391 PolarHBondContact O-N 2.81Å; T391-E393 VanDerWaalsContact C-N 3.33Å; T391-E393 PolarHBondContact O-N 3.42Å; T391-I394 PolarHBondContact O-N 3.17Å; T391-L395 HydrophobicContact CG2-CD1 3.89Å; T391-L395 HydrophobicContact CG2-CG 4.37Å; T391-L395 WeakPolarHBondContact O-CB 3.37Å; T391-L395 VanDerWaalsContact O-CG 3.27Å; T391-L395 WeakPolarHBondContact O-CG 3.06Å; T391-L395 PolarHBondContact O-N 2.95Å; T391-L401 HydrophobicContact CG2-CD2 4.32Å; T391-I404 HydrophobicContact CG2-CD1 3.95Å
392	N	97.2	Very high	94.3	Very high	18 Å²	18	58.4 Å²	58.4	10%	0.096	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-40.5	176.7	-174.9	80.8	0	0	0	111.7	I314 T318 N319 F388 I389 L395 S396	I314-N392 HydrophobicContact CG2-CB 3.74Å; T318-N392 HydrophobicContact CG2-CB 3.92Å; N319-N392 PolarHBondContact ND2-OD1 2.91Å; F388-N392 WeakPolarHBondContact O-CB 3.36Å; F388-N392 PolarHBondContact O-N 3Å; I389-N392 WeakPolarHBondContact O-CB 3.3Å; I389-N392 PolarHBondContact O-N 3.29Å; I389-N392 VanDerWaalsContact O-N 3.12Å; N392-L395 PolarHBondContact O-N 2.96Å; N392-S396 WeakPolarHBondContact O-CB 3.44Å; N392-S396 PolarHBondContact O-N 2.75Å; N392-S396 PolarHBondContact O-OG 2.93Å
393	E	96.3	Very high	93.7	Very high	108 Å²	108	59.8 Å²	59.8	51%	0.505	30%	0.297	S	S	.	.	H	α-helix	trans	-63	-45.1	175.2	-72.1	171.4	178.7	0	0	111.7	I389 K390 T391 L395 N397	I389-E393 WeakPolarHBondContact O-CG 3.18Å; I389-E393 PolarHBondContact O-N 3.47Å; K390-E393 PolarHBondContact O-N 2.96Å; T391-E393 VanDerWaalsContact C-N 3.33Å; T391-E393 PolarHBondContact O-N 3.42Å; E393-L395 PolarHBondContact O-N 3.3Å; E393-N397 WeakPolarHBondContact O-CB 3.48Å; E393-N397 PolarHBondContact O-N 3.33Å; E393-N397 VanDerWaalsContact O-N 3.1Å; E393-N397 PolarHBondContact O-ND2 3.09Å
394	I	95.2	Very high	93.3	Very high	15 Å²	15	54.3 Å²	54.3	8%	0.077	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-46.3	177.7	-72.5	164	0	0	0	110.9	K390 T391 Q398 Y399 L401 I404	K390-I394 HydrophobicContact CG-CD1 4.21Å; K390-I394 WeakPolarHBondContact O-CG1 3.48Å; K390-I394 PolarHBondContact O-N 3.27Å; K390-I394 VanDerWaalsContact O-N 3.13Å; T391-I394 PolarHBondContact O-N 3.17Å; I394-Q398 PolarHBondContact O-N 3.4Å; I394-Y399 WeakPolarHBondContact CG2-O 3.13Å; I394-Y399 PolarHBondContact O-N 3.05Å; I394-L401 HydrophobicContact CG2-CD2 3.8Å; I394-I404 HydrophobicContact CD1-CB 4.31Å; I394-I404 HydrophobicContact CD1-CD1 3.89Å; I394-I404 HydrophobicContact CD1-CG1 3.96Å; I394-I404 HydrophobicContact CD1-CG2 3.41Å; I394-I404 VanDerWaalsContact CD1-CG2 3.41Å
395	L	94.9	Very high	92.9	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-69.3	-41.6	-178.5	-68.2	168.6	0	0	0	112.3	Y75 L79 F310 N311 I314 T391 N392 E393 N397 Q398 L401	Y75-L395 HydrophobicContact CE1-CD2 4.15Å; L79-L395 HydrophobicContact CD2-CD2 3.84Å; F310-L395 HydrophobicContact CD1-CD1 4.14Å; F310-L395 HydrophobicContact CD1-CD2 4.45Å; F310-L395 HydrophobicContact CE1-CD1 3.91Å; F310-L395 HydrophobicContact CE1-CD2 4.38Å; N311-L395 HydrophobicContact CB-CD1 4.49Å; N311-L395 WeakPolarHBondContact OD1-CB 3.29Å; I314-L395 HydrophobicContact CB-CD1 3.91Å; I314-L395 HydrophobicContact CG1-CD1 3.89Å; I314-L395 HydrophobicContact CG2-CD1 3.98Å; T391-L395 HydrophobicContact CG2-CD1 3.89Å; T391-L395 HydrophobicContact CG2-CG 4.37Å; T391-L395 WeakPolarHBondContact O-CB 3.37Å; T391-L395 VanDerWaalsContact O-CG 3.27Å; T391-L395 WeakPolarHBondContact O-CG 3.06Å; T391-L395 PolarHBondContact O-N 2.95Å; N392-L395 PolarHBondContact O-N 2.96Å; E393-L395 PolarHBondContact O-N 3.3Å; L395-N397 VanDerWaalsContact C-N 3.28Å; L395-N397 PolarHBondContact O-N 3.35Å; L395-Q398 PolarHBondContact O-N 2.9Å; L395-L401 HydrophobicContact CD2-CD1 4.3Å; L395-L401 HydrophobicContact CD2-CD2 3.94Å; L395-L401 HydrophobicContact CD2-CG 4.27Å; L395-L401 HydrophobicContact CG-CD2 4.27Å
396	S	92.5	Very high	92.1	Very high	73 Å²	73	57 Å²	57	51%	0.51	29%	0.291	S	S	.	.	H	α-helix	trans	-64.4	-35	179.3	-60.3	0	0	0	0	111.9	N392 Q398	N392-S396 WeakPolarHBondContact O-CB 3.44Å; N392-S396 PolarHBondContact O-N 2.75Å; N392-S396 PolarHBondContact O-OG 2.93Å; S396-Q398 VanDerWaalsContact C-N 3.3Å
397	N	93	Very high	90.8	Very high	91 Å²	91	52.9 Å²	52.9	49%	0.487	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4.8	175.7	-66.4	-56.5	0	0	0	113.6	E393 L395 Y399	E393-N397 WeakPolarHBondContact O-CB 3.48Å; E393-N397 PolarHBondContact O-N 3.33Å; E393-N397 VanDerWaalsContact O-N 3.1Å; E393-N397 PolarHBondContact O-ND2 3.09Å; L395-N397 VanDerWaalsContact C-N 3.28Å; L395-N397 PolarHBondContact O-N 3.35Å; N397-Y399 HydrophobicContact CB-CD1 4.18Å; N397-Y399 HydrophobicContact CB-CD2 3.69Å; N397-Y399 HydrophobicContact CB-CE1 3.99Å; N397-Y399 HydrophobicContact CB-CE2 3.48Å; N397-Y399 VanDerWaalsContact CB-CE2 3.48Å; N397-Y399 HydrophobicContact CB-CG 4.04Å; N397-Y399 WeakPolarHBondContact O-CD1 3.21Å; N397-Y399 PolarHBondContact O-N 2.94Å
398	Q	92.3	Very high	88.8	Confident	61 Å²	61	55.3 Å²	55.3	29%	0.285	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	33	-177.9	-59.4	178	20.9	0	0	113.3	S71 Y75 I394 L395 S396	S71-Q398 PolarHBondContact OG-OE1 3.43Å; Y75-Q398 HydrophobicContact CD1-CB 4.37Å; Y75-Q398 HydrophobicContact CD1-CG 4.19Å; Y75-Q398 HydrophobicContact CD2-CB 3.65Å; Y75-Q398 HydrophobicContact CD2-CG 4.27Å; Y75-Q398 WeakPolarHBondContact CD2-O 3.16Å; Y75-Q398 VanDerWaalsContact CE2-CA 3.5Å; Y75-Q398 HydrophobicContact CE2-CB 3.96Å; Y75-Q398 WeakPolarHBondContact CE2-O 3.44Å; Y75-Q398 HydrophobicContact CG-CB 3.88Å; Y75-Q398 HydrophobicContact CG-CG 3.96Å; I394-Q398 PolarHBondContact O-N 3.4Å; L395-Q398 PolarHBondContact O-N 2.9Å; S396-Q398 VanDerWaalsContact C-N 3.3Å
399	Y	90.7	Very high	86.2	Confident	131 Å²	131	62 Å²	62	51%	0.514	33%	0.333	S	S	.	.			trans	-79	150.9	176.3	-64.9	-28.7	0	0	0	111.3	Y75 I394 N397 L401	Y75-Y399 WeakPolarHBondContact CE2-O 3.39Å; Y75-Y399 PolarHBondContact OH-O 3.09Å; I394-Y399 WeakPolarHBondContact CG2-O 3.13Å; I394-Y399 PolarHBondContact O-N 3.05Å; N397-Y399 HydrophobicContact CB-CD1 4.18Å; N397-Y399 HydrophobicContact CB-CD2 3.69Å; N397-Y399 HydrophobicContact CB-CE1 3.99Å; N397-Y399 HydrophobicContact CB-CE2 3.48Å; N397-Y399 VanDerWaalsContact CB-CE2 3.48Å; N397-Y399 HydrophobicContact CB-CG 4.04Å; N397-Y399 WeakPolarHBondContact O-CD1 3.21Å; N397-Y399 PolarHBondContact O-N 2.94Å; Y399-L401 PolarHBondContact O-N 2.91Å
400	P	87.7	Confident	83.4	Confident	79 Å²	79	68.2 Å²	68.2	51%	0.513	37%	0.367	S	S	.	.			trans	-60.6	131.8	174.8	-19.8	31.3	0	0	0	111.7	E402 S403	P400-E402 WeakPolarHBondContact CA-OE2 3.29Å; P400-E402 WeakPolarHBondContact CB-OE2 3.31Å; P400-E402 PolarHBondContact O-N 2.9Å; P400-S403 PolarHBondContact O-OG 3.4Å
401	L	88.1	Confident	82.8	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.01	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-67.3	-12.8	176.7	-74.7	179.5	0	0	0	112.9	L79 F227 F310 T391 I394 L395 Y399 S403 I404 M405 L407	L79-L401 HydrophobicContact CD1-CD1 3.37Å; L79-L401 HydrophobicContact CD1-CG 4.43Å; L79-L401 HydrophobicContact CD2-CD1 4.44Å; F227-L401 HydrophobicContact CE1-CD1 4.39Å; F227-L401 HydrophobicContact CZ-CD1 3.96Å; F310-L401 HydrophobicContact CE1-CD1 3.99Å; T391-L401 HydrophobicContact CG2-CD2 4.32Å; I394-L401 HydrophobicContact CG2-CD2 3.8Å; L395-L401 HydrophobicContact CD2-CD1 4.3Å; L395-L401 HydrophobicContact CD2-CD2 3.94Å; L395-L401 HydrophobicContact CD2-CG 4.27Å; L395-L401 HydrophobicContact CG-CD2 4.27Å; Y399-L401 PolarHBondContact O-N 2.91Å; L401-S403 PolarHBondContact O-N 3.1Å; L401-I404 HydrophobicContact CD2-CD1 3.98Å; L401-I404 HydrophobicContact CD2-CG1 4.27Å; L401-I404 VanDerWaalsContact O-CG1 3.3Å; L401-I404 WeakPolarHBondContact O-CG1 3.36Å; L401-I404 PolarHBondContact O-N 2.93Å; L401-M405 HydrophobicContact CD1-SD 4.39Å; L401-M405 PolarHBondContact O-N 2.93Å; L401-L407 HydrophobicContact CB-CD1 3.92Å
402	E	86.5	Confident	82	Confident	87 Å²	87	69.8 Å²	69.8	41%	0.407	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-53.6	-23.7	175.7	-74.5	73.5	-169.7	0	0	113.4	K82 P400 I404 M405	K82-E402 VanDerWaalsContact CE-OE1 3.3Å; K82-E402 WeakPolarHBondContact CE-OE1 3.49Å; K82-E402 VanDerWaalsContact NZ-CD 3.28Å; K82-E402 IonicContact NZ-OE1 2.81Å; K82-E402 PolarHBondContact NZ-OE1 3.02Å; K82-E402 IonicContact NZ-OE2 3.59Å; K82-E402 PolarHBondContact NZ-OE2 2.98Å; K82-E402 VanDerWaalsContact NZ-OE2 3.14Å; P400-E402 WeakPolarHBondContact CA-OE2 3.29Å; P400-E402 WeakPolarHBondContact CB-OE2 3.31Å; P400-E402 PolarHBondContact O-N 2.9Å; E402-I404 PolarHBondContact O-N 2.6Å; E402-M405 WeakPolarHBondContact CA-O 3.43Å
403	S	82.3	Confident	81.1	Confident	82 Å²	82	72.7 Å²	72.7	57%	0.573	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-67.6	-19.5	174.6	60.5	0	0	0	0	114.4	P400 L401	P400-S403 PolarHBondContact O-OG 3.4Å; L401-S403 PolarHBondContact O-N 3.1Å
404	I	85.4	Confident	80.3	Confident	17 Å²	17	70.6 Å²	70.6	9%	0.087	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	-11.5	-178.5	59.6	162	0	0	0	113.9	C234 M235 K390 T391 I394 L401 E402	C234-I404 VanDerWaalsContact CB-O 3.24Å; C234-I404 WeakPolarHBondContact CB-O 3.32Å; M235-I404 HydrophobicContact SD-CB 3.72Å; M235-I404 HydrophobicContact SD-CD1 3.98Å; M235-I404 HydrophobicContact SD-CG1 4.39Å; M235-I404 HydrophobicContact SD-CG2 4.13Å; K390-I404 HydrophobicContact CD-CG2 4.16Å; K390-I404 VanDerWaalsContact CE-CG2 3.48Å; T391-I404 HydrophobicContact CG2-CD1 3.95Å; I394-I404 HydrophobicContact CD1-CB 4.31Å; I394-I404 HydrophobicContact CD1-CD1 3.89Å; I394-I404 HydrophobicContact CD1-CG1 3.96Å; I394-I404 HydrophobicContact CD1-CG2 3.41Å; I394-I404 VanDerWaalsContact CD1-CG2 3.41Å; L401-I404 HydrophobicContact CD2-CD1 3.98Å; L401-I404 HydrophobicContact CD2-CG1 4.27Å; L401-I404 VanDerWaalsContact O-CG1 3.3Å; L401-I404 WeakPolarHBondContact O-CG1 3.36Å; L401-I404 PolarHBondContact O-N 2.93Å; E402-I404 PolarHBondContact O-N 2.6Å
405	M	87.5	Confident	79.3	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.02	41%	0.411	C	S	.	.	S	Bend	trans	-138.6	132.2	-176.2	-71.8	177.7	69.8	0	0	110.9	F227 W231 C234 L401 E402 L407	F227-M405 HydrophobicContact CD1-CE 4.44Å; F227-M405 HydrophobicContact CD2-CE 4.27Å; F227-M405 HydrophobicContact CE1-CE 3.92Å; F227-M405 HydrophobicContact CE1-SD 4.24Å; F227-M405 HydrophobicContact CE2-CE 3.73Å; F227-M405 HydrophobicContact CZ-CE 3.52Å; F227-M405 HydrophobicContact CZ-SD 3.98Å; W231-M405 VanDerWaalsContact CA-CE 3.49Å; W231-M405 HydrophobicContact CB-CE 3.57Å; W231-M405 HydrophobicContact CB-CG 4.49Å; W231-M405 HydrophobicContact CB-SD 3.6Å; W231-M405 VanDerWaalsContact CD1-SD 3.54Å; W231-M405 HydrophobicContact CG-SD 3.96Å; C234-M405 HydrophobicContact CB-CG 4.12Å; L401-M405 HydrophobicContact CD1-SD 4.39Å; L401-M405 PolarHBondContact O-N 2.93Å; E402-M405 WeakPolarHBondContact CA-O 3.43Å; M405-L407 HydrophobicContact CB-CD2 4.25Å; M405-L407 HydrophobicContact CB-CG 4.15Å; M405-L407 HydrophobicContact CE-CD2 3.97Å; M405-L407 PolarHBondContact O-N 2.92Å; M405-L407 VanDerWaalsContact O-N 3.14Å
406	E	79.9	Confident	78.3	Confident	135 Å²	135	78.9 Å²	78.9	63%	0.631	44%	0.438	S	S	*	.			trans	-74.3	104.6	168	-67.8	179.5	-173.4	0	0	109.3	H230	H230-E406 PolarHBondContact NE2-O 2.87Å
407	L	70.7	Confident	77.3	Confident	19 Å²	19	79.4 Å²	79.4	10%	0.099	43%	0.433	C	S	.	.			trans	-103.3	-16.7	177.4	-62.5	177.6	0	0	0	112.6	K82 R89 F227 L401 M405	K82-L407 HydrophobicContact CB-CD1 4.48Å; K82-L407 HydrophobicContact CD-CD1 3.91Å; R89-L407 PolarHBondContact NH2-O 3.04Å; F227-L407 HydrophobicContact CE2-CD2 3.69Å; F227-L407 HydrophobicContact CZ-CD2 4.3Å; L401-L407 HydrophobicContact CB-CD1 3.92Å; M405-L407 HydrophobicContact CB-CD2 4.25Å; M405-L407 HydrophobicContact CB-CG 4.15Å; M405-L407 HydrophobicContact CE-CD2 3.97Å; M405-L407 PolarHBondContact O-N 2.92Å; M405-L407 VanDerWaalsContact O-N 3.14Å
408	G	55.6	Low	76.1	Confident	56 Å²	56	78.5 Å²	78.5	58%	0.577	43%	0.429	S	S	*	.	S	Bend	trans	-70.7	168.8	-178.1	0	0	0	0	0	115.4	R89 N410	R89-G408 PolarHBondContact NH1-O 3.27Å; R89-G408 PolarHBondContact NH2-O 3.09Å; G408-N410 PolarHBondContact O-N 3.06Å
409	N	42.5	Very low	74.7	Confident	141 Å²	141	79.9 Å²	79.9	75%	0.754	44%	0.441	S	S	*	.			trans	-76.1	104.6	174.7	-73	-36.5	0	0	0	109.9	R89	R89-N409 PolarHBondContact NH1-OD1 3.14Å
410	N	39.7	Very low	73.2	Confident	206 Å²	206	75.3 Å²	75.3	100%	1.102	43%	0.434	S	S	*	.			trans	-91.5	0	150.2	-82	-20.8	0	0	0	108.9	G408	G408-N410 PolarHBondContact O-N 3.06Å

Retrieved 410 of 410 residues in 477.8 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).