A0A077ZJ32_TRITR Loading...

YkuD and PG binding 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJ32, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 464 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.7	Very low	42.7	Very low	166 Å²	166	114.5 Å²	114.5	82%	0.818	58%	0.575	S	S	*	*				0	120.7	0	-81.5	175.4	167.7	0	0	108.5	V454 M455 I464	M1-V454 HydrophobicContact CB-CG1 4.15Å; M1-V454 HydrophobicContact CE-CG1 4.45Å; M1-V454 HydrophobicContact CG-CG1 3.87Å; M1-V454 HydrophobicContact SD-CG1 4.27Å; M1-M455 WeakPolarHBondContact CA-O 3.38Å; M1-I464 HydrophobicContact CE-CD1 3.76Å; M1-I464 HydrophobicContact CG-CD1 4.26Å
2	L	49.6	Very low	41.8	Very low	21 Å²	21	114.1 Å²	114.1	11%	0.11	59%	0.591	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.4	146.4	174.4	-68.7	158.3	0	0	0	108.3	V454 M455 W458	L2-V454 WeakPolarHBondContact O-CA 3.29Å; L2-M455 PolarHBondContact N-O 3.15Å; L2-M455 PolarHBondContact O-N 3.25Å; L2-W458 HydrophobicContact CD1-CB 4Å; L2-W458 HydrophobicContact CD1-CD2 3.36Å; L2-W458 HydrophobicContact CD1-CE3 4Å; L2-W458 HydrophobicContact CD1-CG 3.34Å; L2-W458 HydrophobicContact CD1-CZ2 4.29Å; L2-W458 HydrophobicContact CD2-CD2 4.18Å; L2-W458 VanDerWaalsContact CD2-CE2 3.47Å; L2-W458 HydrophobicContact CD2-CH2 4.23Å; L2-W458 HydrophobicContact CD2-CZ2 3.5Å; L2-W458 VanDerWaalsContact CD2-CZ2 3.5Å; L2-W458 HydrophobicContact CG-CD2 4.4Å
3	L	50	Low	41.2	Very low	20 Å²	20	111.1 Å²	111.1	11%	0.105	59%	0.593	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-110	124.4	179	-81.1	146.2	0	0	0	108.1	V427 A432 I436 L447 Y452 T453 V454	L3-V427 HydrophobicContact CB-CB 4.07Å; L3-V427 HydrophobicContact CB-CG2 3.86Å; L3-V427 WeakPolarHBondContact O-CG2 3.39Å; L3-V427 PolarHBondContact O-N 2.78Å; L3-A432 HydrophobicContact CD1-CB 4.09Å; L3-I436 HydrophobicContact CD1-CB 4.37Å; L3-I436 HydrophobicContact CD1-CD1 4.28Å; L3-I436 HydrophobicContact CD1-CG2 3.89Å; L3-L447 HydrophobicContact CD2-CD1 3.82Å; L3-L447 HydrophobicContact CD2-CD2 3.31Å; L3-L447 HydrophobicContact CD2-CG 4.15Å; L3-Y452 HydrophobicContact CB-CD1 4.14Å; L3-Y452 HydrophobicContact CD2-CD1 4.25Å; L3-Y452 HydrophobicContact CD2-CG 3.99Å; L3-T453 WeakPolarHBondContact CA-O 3.1Å; L3-V454 HydrophobicContact CD2-CG2 4.07Å
4	N	44.2	Very low	40.8	Very low	31 Å²	31	114.3 Å²	114.3	17%	0.166	61%	0.608	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.7	121	177.8	-173	6.9	0	0	0	109.6	P424 W425 Y452 T453 M455	N4-P424 VanDerWaalsContact OD1-CB 3.25Å; N4-P424 WeakPolarHBondContact OD1-CB 3.49Å; N4-W425 WeakPolarHBondContact CA-O 3.26Å; N4-Y452 CarbonylContact O-C 3.55Å; N4-Y452 WeakPolarHBondContact O-CA 3.2Å; N4-T453 PolarHBondContact N-O 3.32Å; N4-T453 PolarHBondContact O-N 2.77Å; N4-M455 HydrophobicContact CB-SD 4.33Å
5	M	43.9	Very low	40.1	Very low	49 Å²	49	113.2 Å²	113.2	24%	0.241	61%	0.613	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-91	121.7	179.4	-161.3	-172.3	173.2	0	0	111.2	W425 H450 G451 Y452	M5-W425 HydrophobicContact CB-CB 4.09Å; M5-W425 HydrophobicContact CB-CE3 4.35Å; M5-W425 PolarHBondContact N-O 2.92Å; M5-W425 PolarHBondContact O-N 3.04Å; M5-W425 HydrophobicContact SD-CE3 4.16Å; M5-H450 WeakPolarHBondContact CE-O 3.33Å; M5-H450 WeakPolarHBondContact CG-O 3.49Å; M5-G451 CarbonylContact C-O 3.42Å; M5-G451 VanDerWaalsContact CA-O 3.26Å; M5-G451 WeakPolarHBondContact CA-O 3.25Å; M5-Y452 HydrophobicContact CB-CD1 3.86Å; M5-Y452 HydrophobicContact CB-CE1 3.96Å; M5-Y452 HydrophobicContact CG-CD1 4.24Å; M5-Y452 HydrophobicContact CG-CE1 4.22Å; M5-Y452 HydrophobicContact SD-CE1 4.42Å
6	M	48	Very low	39.5	Very low	136 Å²	136	115.6 Å²	115.6	67%	0.67	62%	0.624	S	S	*	*			trans	-95.1	115.2	171.6	-68	178.8	68.8	0	0	109.4	G8 G451	M6-G8 PolarHBondContact O-N 3.08Å; M6-G451 PolarHBondContact N-O 3.28Å
7	C	42.5	Very low	39.1	Very low	111 Å²	111	115.2 Å²	115.2	75%	0.75	63%	0.631	S	S	*	*			trans	-78.1	116.2	-178.5	-87.9	0	0	0	0	112.7
8	G	37.4	Very low	38.4	Very low	71 Å²	71	117.3 Å²	117.3	73%	0.732	64%	0.641	S	S	*	*			trans	-145.8	99.8	166.9	0	0	0	0	0	112.4	M6	M6-G8 PolarHBondContact O-N 3.08Å
9	R	40.7	Very low	38.2	Very low	241 Å²	241	116.6 Å²	116.6	91%	0.909	65%	0.652	S	S	*	*			trans	44.1	120.5	158.7	-72.6	-178	173.8	-174.5	-1.3	123
10	R	31.2	Very low	37.8	Very low	233 Å²	233	116.2 Å²	116.2	88%	0.879	65%	0.652	S	S	*	*			trans	43.7	116.1	134.5	-57.7	-166.1	178.9	-158.1	-0.4	120.2
11	L	35.4	Very low	37.7	Very low	180 Å²	180	117.6 Å²	117.6	94%	0.942	66%	0.663	S	S	*	*				-179.3	166.7	109.6	-94.8	157.6	0	0	0	113.3
12	S	31.8	Very low	37	Very low	110 Å²	110	118.8 Å²	118.8	77%	0.769	66%	0.664	S	S	*	*			trans	-79.5	160.1	-156.8	-166	0	0	0	0	117
13	A	34.4	Very low	36.3	Very low	75 Å²	75	122 Å²	122	62%	0.62	69%	0.694	S	S	*	*			trans	93.3	116.5	132.8	0	0	0	0	0	123.1
14	I	35.4	Very low	35.5	Very low	156 Å²	156	126.9 Å²	126.9	80%	0.8	73%	0.727	S	S	*	*				100.2	110.5	122.9	-66.1	167.9	0	0	0	120.2
15	S	30.6	Very low	34.8	Very low	98 Å²	98	133.3 Å²	133.3	69%	0.685	76%	0.761	S	S	*	*			trans	71.6	133.8	134.9	-80.6	0	0	0	0	125.8
16	L	30.4	Very low	34.3	Very low	151 Å²	151	140.9 Å²	140.9	79%	0.791	79%	0.792	S	S	*	*			trans	59.5	139.3	140.6	-95	66.8	0	0	0	117.5
17	C	32.5	Very low	33.3	Very low	110 Å²	110	142.6 Å²	142.6	74%	0.743	81%	0.805	S	S	*	*			cis	-167	167.8	31.4	-131.4	0	0	0	0	111.1
18	L	27	Very low	32.8	Very low	153 Å²	153	141.7 Å²	141.7	80%	0.801	81%	0.805	S	S	*	*			trans	-51.6	146.8	178.7	-86.3	101.7	0	0	0	116.8
19	A	34.9	Very low	32.4	Very low	103 Å²	103	147.8 Å²	147.8	85%	0.851	81%	0.814	S	S	*	*			trans	-158.8	130.6	130.4	0	0	0	0	0	111.5
20	V	29.2	Very low	32	Very low	108 Å²	108	140.7 Å²	140.7	66%	0.655	81%	0.807	S	S	*	*			trans	-94.3	132.2	-179.9	170.8	0	0	0	0	109.2	F22	V20-F22 HydrophobicContact CG1-CD2 4.4Å
21	T	36.6	Very low	31.9	Very low	146 Å²	146	137.3 Å²	137.3	90%	0.896	81%	0.807	S	S	*	*			trans	-144.6	142	154	48	0	0	0	0	111.7
22	F	31.8	Very low	31.9	Very low	191 Å²	191	137.2 Å²	137.2	84%	0.838	80%	0.801	S	S	*	*			trans	-88.2	158.8	-167.6	-105.5	-102.2	0	0	0	113.9	V20	V20-F22 HydrophobicContact CG1-CD2 4.4Å
23	A	34.5	Very low	32.3	Very low	88 Å²	88	137.7 Å²	137.7	73%	0.727	80%	0.802	S	S	*	*			trans	93.1	157.9	148.8	0	0	0	0	0	119.6
24	P	33.9	Very low	32.2	Very low	123 Å²	123	142.9 Å²	142.9	80%	0.799	81%	0.813	S	S	*	*			cis	-126.6	178.6	-43.8	33.1	-16	0	0	0	113.1
25	L	28.7	Very low	32.1	Very low	167 Å²	167	141.6 Å²	141.6	87%	0.874	81%	0.813	S	S	*	*			trans	-50.4	132.6	-172.5	-63.2	148.5	0	0	0	116.1
26	F	32.4	Very low	32.2	Very low	207 Å²	207	143.7 Å²	143.7	91%	0.908	81%	0.814	S	S	*	*			trans	-134.1	126.5	150.1	-93.2	-82.8	0	0	0	109.8	A28	F26-A28 PolarHBondContact O-N 3.21Å
27	N	28.6	Very low	32.3	Very low	173 Å²	173	141.4 Å²	141.4	93%	0.925	81%	0.809	S	S	*	*			trans	-55.8	125.8	173.1	-81.7	-44.3	0	0	0	110.5
28	A	31.6	Very low	32.2	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	81%	0.807	S	S	*	*			trans	-126.9	106.3	160.9	0	0	0	0	0	106.9	F26 A30	F26-A28 PolarHBondContact O-N 3.21Å; A28-A30 PolarHBondContact O-N 3.3Å
29	Q	28.9	Very low	32.3	Very low	199 Å²	199	139.9 Å²	139.9	93%	0.93	81%	0.81	S	S	*	*			trans	-58.5	118.9	162.1	-75.5	-174.8	-89.6	0	0	107.2
30	A	31.4	Very low	32	Very low	93 Å²	93	139.4 Å²	139.4	77%	0.769	80%	0.801	S	S	*	*			trans	-88.2	114.9	161.6	0	0	0	0	0	106.1	A28 E32	A28-A30 PolarHBondContact O-N 3.3Å; A30-E32 PolarHBondContact O-N 2.95Å
31	D	29.8	Very low	32	Very low	162 Å²	162	140.4 Å²	140.4	87%	0.866	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-52.8	127.4	162.7	-94.6	-34.4	0	0	0	108.6
32	E	35.7	Very low	31.6	Very low	177 Å²	177	138.7 Å²	138.7	83%	0.827	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-63.8	138.5	169.2	-76.1	-178	151.7	0	0	108.8	A30 E34	A30-E32 PolarHBondContact O-N 2.95Å; E32-E34 PolarHBondContact O-N 2.97Å
33	P	39.3	Very low	31.3	Very low	121 Å²	121	133.8 Å²	133.8	79%	0.786	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-65.7	133.1	171.5	28.2	-31.4	0	0	0	109.4	V35	P33-V35 PolarHBondContact O-N 3.34Å
34	E	33.3	Very low	31.1	Very low	183 Å²	183	135.1 Å²	135.1	86%	0.855	79%	0.792	S	S	*	*			trans	-43.8	127.8	173	-166.8	171	-173.7	0	0	111.4	E32 I36	E32-E34 PolarHBondContact O-N 2.97Å; E34-I36 PolarHBondContact O-N 2.74Å
35	V	33.8	Very low	30.8	Very low	130 Å²	130	133.8 Å²	133.8	79%	0.788	79%	0.786	S	S	*	*			trans	-61.6	107.6	175.3	175.8	0	0	0	0	108	P33 P37	P33-V35 PolarHBondContact O-N 3.34Å; V35-P37 WeakPolarHBondContact O-CD 3.36Å
36	I	31.8	Very low	30.8	Very low	141 Å²	141	135 Å²	135	72%	0.723	79%	0.787	S	S	*	*			trans	-69	120.8	166.5	-55.3	177	0	0	0	106.3	E34 G38	E34-I36 PolarHBondContact O-N 2.74Å; I36-G38 PolarHBondContact O-N 3.25Å; I36-G38 VanDerWaalsContact O-N 3.09Å
37	P	32	Very low	30.6	Very low	103 Å²	103	133.2 Å²	133.2	67%	0.669	78%	0.781	S	S	*	*			trans	-59.4	118.3	171	-14.2	27.7	0	0	0	107.4	V35 D39	V35-P37 WeakPolarHBondContact O-CD 3.36Å; P37-D39 PolarHBondContact O-N 3.25Å; P37-D39 VanDerWaalsContact O-N 3.12Å
38	G	30.3	Very low	30.7	Very low	68 Å²	68	129 Å²	129	70%	0.701	78%	0.779	S	S	*	*			trans	-64.4	113.3	167.1	0	0	0	0	0	107.7	I36 S40	I36-G38 PolarHBondContact O-N 3.25Å; I36-G38 VanDerWaalsContact O-N 3.09Å; G38-S40 PolarHBondContact O-N 2.95Å
39	D	29.1	Very low	31	Very low	163 Å²	163	133 Å²	133	87%	0.872	78%	0.782	S	S	*	*			trans	-60.2	84.8	166	-79.9	-30.6	0	0	0	108.4	P37	P37-D39 PolarHBondContact O-N 3.25Å; P37-D39 VanDerWaalsContact O-N 3.12Å
40	S	29.8	Very low	32.5	Very low	94 Å²	94	128.1 Å²	128.1	66%	0.657	78%	0.776	S	S	*	*			trans	-75.8	127.6	150.3	-64.6	0	0	0	0	105.8	G38 V42	G38-S40 PolarHBondContact O-N 2.95Å; S40-V42 PolarHBondContact O-N 3.45Å
41	P	29.4	Very low	34.3	Very low	128 Å²	128	129.9 Å²	129.9	83%	0.831	77%	0.772	S	S	*	*			trans	-70.4	87.1	165	31.5	-28.8	0	0	0	105.6	A43	P41-A43 PolarHBondContact O-N 2.92Å
42	V	28	Very low	37	Very low	111 Å²	111	125.6 Å²	125.6	67%	0.673	75%	0.753	S	S	*	*			trans	-66.8	98	146.5	-178.2	0	0	0	0	102.8	S40 V44	S40-V42 PolarHBondContact O-N 3.45Å; V42-V44 HydrophobicContact CB-CG2 4.32Å; V42-V44 HydrophobicContact CG1-CG2 3.69Å; V42-V44 PolarHBondContact O-N 3.35Å
43	A	25.7	Very low	39.5	Very low	87 Å²	87	121.6 Å²	121.6	72%	0.719	73%	0.734	S	S	*	*			trans	-52.8	90.9	151.3	0	0	0	0	0	105.7	P41 S45	P41-A43 PolarHBondContact O-N 2.92Å; A43-S45 PolarHBondContact O-N 3.03Å
44	V	29.8	Very low	41.9	Very low	117 Å²	117	115.9 Å²	115.9	71%	0.709	70%	0.697	S	S	*	*			trans	-72.6	86.5	162	-179.4	0	0	0	0	103.1	V42 E46	V42-V44 HydrophobicContact CB-CG2 4.32Å; V42-V44 HydrophobicContact CG1-CG2 3.69Å; V42-V44 PolarHBondContact O-N 3.35Å; V44-E46 PolarHBondContact O-N 3Å
45	S	27.3	Very low	44.6	Very low	95 Å²	95	112.9 Å²	112.9	66%	0.664	68%	0.683	S	S	*	*			trans	-42	112.8	155.9	33.7	0	0	0	0	107.8	A43 Q47	A43-S45 PolarHBondContact O-N 3.03Å; S45-Q47 PolarHBondContact O-N 3.28Å
46	E	28.1	Very low	47.2	Very low	193 Å²	193	106.8 Å²	106.8	90%	0.902	65%	0.646	S	S	*	*	S	Bend	trans	-64	70.8	166.4	-73.6	-170.4	137.2	0	0	109.5	V44	V44-E46 PolarHBondContact O-N 3Å
47	Q	28.6	Very low	50	Low	168 Å²	168	100.1 Å²	100.1	79%	0.785	61%	0.612	S	S	*	*			trans	-148.3	82.3	159	-71.7	-168.2	-21.4	0	0	106.7	S45 E49	S45-Q47 PolarHBondContact O-N 3.28Å; Q47-E49 PolarHBondContact O-N 3.02Å
48	G	31	Very low	52.7	Low	85 Å²	85	95.3 Å²	95.3	88%	0.876	58%	0.581	S	S	*	*			trans	-71.7	70.4	171.1	0	0	0	0	0	110.8	A50	G48-A50 PolarHBondContact O-N 3.34Å
49	E	38.2	Very low	55.5	Low	175 Å²	175	92.7 Å²	92.7	82%	0.818	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-67.9	117.3	158.4	-78.3	-172.7	154.7	0	0	107.4	Q47 L51	Q47-E49 PolarHBondContact O-N 3.02Å; E49-L51 PolarHBondContact O-N 3.42Å; E49-L51 VanDerWaalsContact O-N 3.14Å
50	A	59.6	Low	58.4	Low	97 Å²	97	86.8 Å²	86.8	80%	0.802	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-55.1	122	173.8	0	0	0	0	0	108.4	G48	G48-A50 PolarHBondContact O-N 3.34Å
51	L	70.5	Confident	61.3	Low	130 Å²	130	84.5 Å²	84.5	68%	0.681	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-51.3	133.1	174.9	-73.8	168.6	0	0	0	108.4	E49 Q53	E49-L51 PolarHBondContact O-N 3.42Å; E49-L51 VanDerWaalsContact O-N 3.14Å; L51-Q53 PolarHBondContact O-N 3.23Å
52	P	86.5	Confident	64.1	Low	72 Å²	72	81.5 Å²	81.5	47%	0.468	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-53.2	142.1	178.2	18.9	-29.5	0	0	0	109.6	N192 L196	P52-N192 PolarHBondContact O-ND2 2.88Å; P52-L196 HydrophobicContact CB-CD1 4.47Å; P52-L196 HydrophobicContact CB-CD2 4.35Å; P52-L196 HydrophobicContact CG-CD1 4.02Å; P52-L196 WeakPolarHBondContact O-CD1 3.5Å
53	Q	86.7	Confident	66.9	Low	92 Å²	92	81.5 Å²	81.5	43%	0.43	49%	0.493	S	S	.	.			trans	-108.2	126.4	-177.9	-168.4	170.6	11.5	0	0	109.6	L51 T57 A58 N192	L51-Q53 PolarHBondContact O-N 3.23Å; Q53-T57 WeakPolarHBondContact CG-OG1 3.48Å; Q53-A58 HydrophobicContact CG-CB 4.16Å; Q53-A58 VanDerWaalsContact NE2-CA 3.31Å; Q53-N192 WeakPolarHBondContact CA-OD1 3.43Å
54	A	91.2	Very high	69.8	Low	2 Å²	2	81.3 Å²	81.3	2%	0.017	48%	0.477	C	S	.	.			trans	-68.1	147	172.2	0	0	0	0	0	110.1	A56 T57 A58 N192 Q195 L196	A54-A56 VanDerWaalsContact C-N 3.26Å; A54-A56 PolarHBondContact O-N 3.19Å; A54-T57 PolarHBondContact N-OG1 2.85Å; A54-T57 PolarHBondContact O-N 2.94Å; A54-T57 VanDerWaalsContact O-N 3.12Å; A54-T57 PolarHBondContact O-OG1 2.85Å; A54-A58 PolarHBondContact O-N 2.9Å; A54-N192 PolarHBondContact N-OD1 2.97Å; A54-Q195 HydrophobicContact CB-CB 3.52Å; A54-L196 HydrophobicContact CB-CD2 4.07Å; A54-L196 HydrophobicContact CB-CG 4.22Å
55	Q	88.5	Confident	72.6	Confident	119 Å²	119	81.4 Å²	81.4	56%	0.556	48%	0.48	S	S	*	.	H	α-helix	trans	-56.4	-43.4	179.2	-173.1	177.6	9.8	0	0	111.6	T57 A58 I59	Q55-T57 VanDerWaalsContact C-N 3.3Å; Q55-T57 PolarHBondContact O-N 3.41Å; Q55-A58 PolarHBondContact O-N 2.87Å; Q55-I59 HydrophobicContact CG-CD1 4.23Å; Q55-I59 WeakPolarHBondContact O-CB 3.3Å; Q55-I59 PolarHBondContact O-N 3.18Å
56	A	88.5	Confident	75.4	Confident	3 Å²	3	79 Å²	79	3%	0.025	46%	0.459	C	S	.	.	H	α-helix	trans	-61	-35.3	179.6	0	0	0	0	0	113.2	A54 I59 M60 L97 A100 Q195	A54-A56 VanDerWaalsContact C-N 3.26Å; A54-A56 PolarHBondContact O-N 3.19Å; A56-I59 WeakPolarHBondContact O-CB 3.42Å; A56-M60 WeakPolarHBondContact O-CG 3.27Å; A56-M60 PolarHBondContact O-N 3.43Å; A56-L97 HydrophobicContact CB-CD2 3.84Å; A56-A100 HydrophobicContact CB-CB 3.8Å; A56-Q195 HydrophobicContact CB-CG 4.23Å
57	T	90.4	Very high	78	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-82.3	-29.7	177.3	58.7	0	0	0	0	112.9	Q53 A54 Q55 I59 M60 A61 L188 I191 N192 Q195	Q53-T57 WeakPolarHBondContact CG-OG1 3.48Å; A54-T57 PolarHBondContact N-OG1 2.85Å; A54-T57 PolarHBondContact O-N 2.94Å; A54-T57 VanDerWaalsContact O-N 3.12Å; A54-T57 PolarHBondContact O-OG1 2.85Å; Q55-T57 VanDerWaalsContact C-N 3.3Å; Q55-T57 PolarHBondContact O-N 3.41Å; T57-I59 VanDerWaalsContact C-N 3.28Å; T57-M60 PolarHBondContact O-N 2.94Å; T57-A61 WeakPolarHBondContact O-CB 3.35Å; T57-A61 PolarHBondContact O-N 3.31Å; T57-L188 HydrophobicContact CG2-CD1 4.42Å; T57-I191 HydrophobicContact CG2-CB 4.41Å; T57-I191 HydrophobicContact CG2-CG2 3.95Å; T57-N192 VanDerWaalsContact CG2-CA 3.46Å; T57-N192 HydrophobicContact CG2-CB 3.87Å; T57-N192 PolarHBondContact OG1-OD1 3.35Å; T57-Q195 HydrophobicContact CG2-CB 4.15Å; T57-Q195 HydrophobicContact CG2-CG 3.9Å
58	A	89.4	Confident	80.6	Confident	3 Å²	3	76 Å²	76	3%	0.025	45%	0.454	C	S	.	.	H	α-helix	trans	-61.3	-40.8	168.9	0	0	0	0	0	111.3	Q53 A54 Q55 A61 G62 I63 Q64	Q53-A58 HydrophobicContact CG-CB 4.16Å; Q53-A58 VanDerWaalsContact NE2-CA 3.31Å; A54-A58 PolarHBondContact O-N 2.9Å; Q55-A58 PolarHBondContact O-N 2.87Å; A58-A61 PolarHBondContact O-N 3.11Å; A58-G62 PolarHBondContact O-N 3Å; A58-I63 HydrophobicContact CB-CB 4.47Å; A58-I63 WeakPolarHBondContact O-CB 3.4Å; A58-I63 PolarHBondContact O-N 3.04Å; A58-Q64 HydrophobicContact CB-CB 4.28Å; A58-Q64 HydrophobicContact CB-CG 3.94Å; A58-Q64 PolarHBondContact O-N 3.02Å
59	I	90	Very high	83.3	Confident	13 Å²	13	73.7 Å²	73.7	7%	0.067	43%	0.43	C	S	.	.	H	α-helix	trans	-61	-50.6	170.7	-83.8	164.8	0	0	0	111.5	Q55 A56 T57 A61 G62 Q64 L66 A100	Q55-I59 HydrophobicContact CG-CD1 4.23Å; Q55-I59 WeakPolarHBondContact O-CB 3.3Å; Q55-I59 PolarHBondContact O-N 3.18Å; A56-I59 WeakPolarHBondContact O-CB 3.42Å; T57-I59 VanDerWaalsContact C-N 3.28Å; I59-A61 PolarHBondContact O-N 3.5Å; I59-G62 PolarHBondContact O-N 3.17Å; I59-Q64 HydrophobicContact CG1-CB 4.06Å; I59-L66 HydrophobicContact CB-CD1 4.21Å; I59-L66 HydrophobicContact CD1-CG 4.16Å; I59-L66 HydrophobicContact CG1-CD1 4.23Å; I59-L66 HydrophobicContact CG1-CG 4.24Å; I59-L66 HydrophobicContact CG2-CD1 3.16Å; I59-L66 HydrophobicContact CG2-CD2 4.14Å; I59-L66 HydrophobicContact CG2-CG 3.69Å; I59-A100 HydrophobicContact CB-CB 4.44Å; I59-A100 HydrophobicContact CD1-CB 3.47Å; I59-A100 VanDerWaalsContact CD1-CB 3.47Å; I59-A100 HydrophobicContact CG2-CB 4.27Å
60	M	89.3	Confident	85.9	Confident	39 Å²	39	66.4 Å²	66.4	19%	0.192	40%	0.399	C	S	.	.	H	α-helix	trans	-61.5	-29.9	178.3	-75.6	-175.5	63.3	0	0	113.4	A56 T57 G62 Q93 L96 L97 L188 I191	A56-M60 WeakPolarHBondContact O-CG 3.27Å; A56-M60 PolarHBondContact O-N 3.43Å; T57-M60 PolarHBondContact O-N 2.94Å; M60-G62 VanDerWaalsContact C-N 3.25Å; M60-G62 PolarHBondContact O-N 3.15Å; M60-Q93 HydrophobicContact CE-CB 3.95Å; M60-Q93 HydrophobicContact CE-CG 3.9Å; M60-L96 HydrophobicContact CG-CB 4.04Å; M60-L96 HydrophobicContact CG-CD1 4.25Å; M60-L97 HydrophobicContact CG-CD2 4.35Å; M60-L97 HydrophobicContact SD-CD1 4.35Å; M60-L97 HydrophobicContact SD-CD2 3.48Å; M60-L97 WeakPolarHBondContact SD-CD2 3.48Å; M60-L97 HydrophobicContact SD-CG 3.74Å; M60-L188 HydrophobicContact CB-CD1 4.06Å; M60-L188 HydrophobicContact CE-CD1 4.41Å; M60-I191 HydrophobicContact CE-CD1 3.76Å; M60-I191 HydrophobicContact SD-CG2 4.09Å
61	A	90.4	Very high	87.3	Confident	45 Å²	45	62.5 Å²	62.5	37%	0.372	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.5	175.3	0	0	0	0	0	113.7	T57 A58 I59 I63 L188	T57-A61 WeakPolarHBondContact O-CB 3.35Å; T57-A61 PolarHBondContact O-N 3.31Å; A58-A61 PolarHBondContact O-N 3.11Å; I59-A61 PolarHBondContact O-N 3.5Å; A61-I63 VanDerWaalsContact C-N 3.26Å; A61-I63 HydrophobicContact CB-CD1 3.66Å; A61-I63 HydrophobicContact CB-CG1 3.77Å; A61-I63 PolarHBondContact O-N 3.28Å; A61-L188 HydrophobicContact CB-CD2 3.79Å
62	G	87.7	Confident	88.4	Confident	65 Å²	65	62.1 Å²	62.1	67%	0.67	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	15.5	-172	0	0	0	0	0	114.2	A58 I59 M60	A58-G62 PolarHBondContact O-N 3Å; I59-G62 PolarHBondContact O-N 3.17Å; M60-G62 VanDerWaalsContact C-N 3.25Å; M60-G62 PolarHBondContact O-N 3.15Å
63	I	88.2	Confident	88.7	Confident	112 Å²	112	65.7 Å²	65.7	57%	0.574	37%	0.37	S	S	*	.	S	Bend	trans	-81.2	-34.5	179.9	-62.5	168.9	0	0	0	110.6	A58 A61	A58-I63 HydrophobicContact CB-CB 4.47Å; A58-I63 WeakPolarHBondContact O-CB 3.4Å; A58-I63 PolarHBondContact O-N 3.04Å; A61-I63 VanDerWaalsContact C-N 3.26Å; A61-I63 HydrophobicContact CB-CD1 3.66Å; A61-I63 HydrophobicContact CB-CG1 3.77Å; A61-I63 PolarHBondContact O-N 3.28Å
64	Q	86.5	Confident	89	Confident	83 Å²	83	61.4 Å²	61.4	39%	0.388	35%	0.35	S	S	.	.	S	Bend	trans	-117.8	139.5	175.5	-71.6	-176.4	6.6	0	0	110.7	A58 I59	A58-Q64 HydrophobicContact CB-CB 4.28Å; A58-Q64 HydrophobicContact CB-CG 3.94Å; A58-Q64 PolarHBondContact O-N 3.02Å; I59-Q64 HydrophobicContact CG1-CB 4.06Å
65	P	87.5	Confident	89.2	Confident	119 Å²	119	65.8 Å²	65.8	77%	0.773	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-75	145.2	177.6	31.4	-33.8	0	0	0	111
66	L	86.8	Confident	89.5	Confident	44 Å²	44	64.5 Å²	64.5	23%	0.23	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-84.6	155.5	158	-67.9	92.8	0	0	0	109.8	I59 E68 A70 L96 A99	I59-L66 HydrophobicContact CB-CD1 4.21Å; I59-L66 HydrophobicContact CD1-CG 4.16Å; I59-L66 HydrophobicContact CG1-CD1 4.23Å; I59-L66 HydrophobicContact CG1-CG 4.24Å; I59-L66 HydrophobicContact CG2-CD1 3.16Å; I59-L66 HydrophobicContact CG2-CD2 4.14Å; I59-L66 HydrophobicContact CG2-CG 3.69Å; L66-E68 PolarHBondContact O-N 3.25Å; L66-A70 HydrophobicContact CB-CB 4.44Å; L66-A70 HydrophobicContact CD2-CB 4.41Å; L66-L96 HydrophobicContact CD1-CD2 4.11Å; L66-A99 HydrophobicContact CD2-CB 3.36Å
67	P	82.3	Confident	89.7	Confident	93 Å²	93	67.5 Å²	67.5	60%	0.604	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-52.9	139.3	163.7	-22.1	32.9	0	0	0	111.1	G69 A70	P67-G69 PolarHBondContact O-N 3.49Å; P67-A70 HydrophobicContact CB-CB 4.2Å; P67-A70 WeakPolarHBondContact O-CB 3.15Å; P67-A70 PolarHBondContact O-N 3.45Å
68	E	83.6	Confident	89.9	Confident	206 Å²	206	67.6 Å²	67.6	96%	0.963	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	130.2	-179.2	-167.4	176.5	179.8	0	0	110.7	L66 A70	L66-E68 PolarHBondContact O-N 3.25Å; E68-A70 VanDerWaalsContact C-N 3.28Å; E68-A70 PolarHBondContact O-N 2.92Å
69	G	88.1	Confident	90.1	Very high	36 Å²	36	71.5 Å²	71.5	37%	0.371	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-4	-177.8	0	0	0	0	0	115.8	P67 E72 K73	P67-G69 PolarHBondContact O-N 3.49Å; G69-E72 VanDerWaalsContact CA-OE2 3.29Å; G69-E72 WeakPolarHBondContact CA-OE2 3.42Å; G69-K73 VanDerWaalsContact O-CB 3.27Å; G69-K73 WeakPolarHBondContact O-CB 3.42Å; G69-K73 PolarHBondContact O-N 3.36Å
70	A	91.5	Very high	90.3	Very high	22 Å²	22	75.1 Å²	75.1	18%	0.182	43%	0.425	C	S	.	.	H	α-helix	trans	-65.6	-39.8	-178.2	0	0	0	0	0	112.6	L66 P67 E68 A74 A99	L66-A70 HydrophobicContact CB-CB 4.44Å; L66-A70 HydrophobicContact CD2-CB 4.41Å; P67-A70 HydrophobicContact CB-CB 4.2Å; P67-A70 WeakPolarHBondContact O-CB 3.15Å; P67-A70 PolarHBondContact O-N 3.45Å; E68-A70 VanDerWaalsContact C-N 3.28Å; E68-A70 PolarHBondContact O-N 2.92Å; A70-A74 VanDerWaalsContact O-CB 3.3Å; A70-A74 WeakPolarHBondContact O-CB 3.35Å; A70-A74 PolarHBondContact O-N 3.4Å; A70-A99 HydrophobicContact CB-CB 4.3Å
71	A	90.2	Very high	90.3	Very high	14 Å²	14	76.8 Å²	76.8	12%	0.116	43%	0.432	C	S	.	.	H	α-helix	trans	-68.1	-43	179.4	0	0	0	0	0	111.9	A74 R75 L96	A71-A74 PolarHBondContact O-N 2.89Å; A71-R75 WeakPolarHBondContact O-CB 3.27Å; A71-R75 PolarHBondContact O-N 3.43Å; A71-L96 HydrophobicContact CB-CD2 4.09Å
72	E	92.5	Very high	90.5	Very high	122 Å²	122	75.7 Å²	75.7	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-63.6	-44.9	175.4	-67.8	75.2	-165.4	0	0	111.1	G69 A74 R75 T76	G69-E72 VanDerWaalsContact CA-OE2 3.29Å; G69-E72 WeakPolarHBondContact CA-OE2 3.42Å; E72-A74 PolarHBondContact O-N 3.31Å; E72-R75 WeakPolarHBondContact O-CB 3.38Å; E72-R75 PolarHBondContact O-N 3.12Å; E72-T76 PolarHBondContact O-N 3.01Å; E72-T76 PolarHBondContact O-OG1 3.04Å
73	K	93.2	Very high	90.6	Very high	148 Å²	148	74.5 Å²	74.5	64%	0.643	40%	0.4	S	S	*	.	H	α-helix	trans	-60.1	-46.9	176.1	-175.7	-178	177.3	-173.6	0	111.4	G69 R75 T76 Q77	G69-K73 VanDerWaalsContact O-CB 3.27Å; G69-K73 WeakPolarHBondContact O-CB 3.42Å; G69-K73 PolarHBondContact O-N 3.36Å; K73-R75 VanDerWaalsContact C-N 3.32Å; K73-R75 PolarHBondContact O-N 3.32Å; K73-T76 PolarHBondContact O-N 3.03Å; K73-Q77 WeakPolarHBondContact O-CB 3.38Å; K73-Q77 PolarHBondContact O-N 3.28Å
74	A	93.9	Very high	90.6	Very high	2 Å²	2	74.4 Å²	74.4	2%	0.017	42%	0.416	C	S	.	.	H	α-helix	trans	-60.2	-43.3	176.9	0	0	0	0	0	111.4	A70 A71 E72 Q77 I78 A99 M103	A70-A74 VanDerWaalsContact O-CB 3.3Å; A70-A74 WeakPolarHBondContact O-CB 3.35Å; A70-A74 PolarHBondContact O-N 3.4Å; A71-A74 PolarHBondContact O-N 2.89Å; E72-A74 PolarHBondContact O-N 3.31Å; A74-Q77 PolarHBondContact O-N 2.96Å; A74-I78 WeakPolarHBondContact O-CB 3.15Å; A74-I78 VanDerWaalsContact O-CG1 3.23Å; A74-I78 WeakPolarHBondContact O-CG1 3.44Å; A74-I78 PolarHBondContact O-N 2.68Å; A74-A99 HydrophobicContact CB-CB 3.78Å; A74-M103 HydrophobicContact CB-SD 3.51Å; A74-M103 VanDerWaalsContact CB-SD 3.51Å
75	R	94.9	Very high	90.8	Very high	93 Å²	93	74.8 Å²	74.8	35%	0.351	44%	0.442	S	S	.	.	H	α-helix	trans	-58.6	-51.7	175.9	-177.1	-176.1	173.9	167.3	-7.4	112.1	A71 E72 K73 Q77 I78 E79 Q95	A71-R75 WeakPolarHBondContact O-CB 3.27Å; A71-R75 PolarHBondContact O-N 3.43Å; E72-R75 WeakPolarHBondContact O-CB 3.38Å; E72-R75 PolarHBondContact O-N 3.12Å; K73-R75 VanDerWaalsContact C-N 3.32Å; K73-R75 PolarHBondContact O-N 3.32Å; R75-Q77 VanDerWaalsContact C-N 3.3Å; R75-Q77 PolarHBondContact O-N 3.35Å; R75-I78 PolarHBondContact O-N 2.86Å; R75-E79 HydrophobicContact CG-CG 4.39Å; R75-E79 IonicContact CZ-OE1 3.04Å; R75-E79 IonicContact NE-OE1 3.98Å; R75-E79 PolarHBondContact NE-OE1 3.01Å; R75-E79 IonicContact NE-OE2 3.04Å; R75-E79 IonicContact NH2-OE1 2.89Å; R75-E79 PolarHBondContact NH2-OE1 3.23Å; R75-E79 WeakPolarHBondContact O-CB 3.37Å; R75-E79 WeakPolarHBondContact O-CG 3.37Å; R75-E79 PolarHBondContact O-N 3.48Å; R75-Q95 HydrophobicContact CB-CB 4.14Å
76	T	94.1	Very high	91.1	Very high	93 Å²	93	70.4 Å²	70.4	57%	0.571	41%	0.411	S	S	*	.	H	α-helix	trans	-61.5	-40.8	179.9	-57.1	0	0	0	0	111.4	E72 K73 E79 S80	E72-T76 PolarHBondContact O-N 3.01Å; E72-T76 PolarHBondContact O-OG1 3.04Å; K73-T76 PolarHBondContact O-N 3.03Å; T76-E79 PolarHBondContact O-N 3.41Å; T76-S80 WeakPolarHBondContact O-CB 3.06Å; T76-S80 PolarHBondContact O-N 2.89Å; T76-S80 PolarHBondContact O-OG 3.32Å
77	Q	93.6	Very high	91.5	Very high	66 Å²	66	75 Å²	75	31%	0.308	43%	0.429	S	S	.	.	H	α-helix	trans	-64.6	-44.3	177.6	-175.6	172	-20.7	0	0	111.7	K73 A74 R75 S80 Q81 M103	K73-Q77 WeakPolarHBondContact O-CB 3.38Å; K73-Q77 PolarHBondContact O-N 3.28Å; A74-Q77 PolarHBondContact O-N 2.96Å; R75-Q77 VanDerWaalsContact C-N 3.3Å; R75-Q77 PolarHBondContact O-N 3.35Å; Q77-S80 PolarHBondContact O-N 3.48Å; Q77-S80 PolarHBondContact O-OG 2.9Å; Q77-Q81 WeakPolarHBondContact O-CG 3.17Å; Q77-M103 HydrophobicContact CB-CE 4.03Å; Q77-M103 HydrophobicContact CG-CE 3.82Å
78	I	94.4	Very high	92.1	Very high	1 Å²	1	70.8 Å²	70.8	1%	0.005	40%	0.402	C	S	.	.	H	α-helix	trans	-59.3	-54.1	174.2	-71.1	166.9	0	0	0	110.5	A74 R75 S80 Q81 L82 L91 Y98 M103 V151	A74-I78 WeakPolarHBondContact O-CB 3.15Å; A74-I78 VanDerWaalsContact O-CG1 3.23Å; A74-I78 WeakPolarHBondContact O-CG1 3.44Å; A74-I78 PolarHBondContact O-N 2.68Å; R75-I78 PolarHBondContact O-N 2.86Å; I78-S80 PolarHBondContact O-N 2.96Å; I78-Q81 PolarHBondContact O-N 3.4Å; I78-Q81 VanDerWaalsContact O-N 3.15Å; I78-L82 HydrophobicContact CG2-CD1 3.81Å; I78-L82 HydrophobicContact CG2-CG 4.36Å; I78-L82 WeakPolarHBondContact O-CG 3.34Å; I78-L82 PolarHBondContact O-N 3.29Å; I78-L91 HydrophobicContact CG2-CD1 3.96Å; I78-Y98 HydrophobicContact CD1-CD2 3.84Å; I78-Y98 HydrophobicContact CD1-CG 4.27Å; I78-M103 HydrophobicContact CG1-CE 4.03Å; I78-V151 HydrophobicContact CG1-CG2 4Å; I78-V151 HydrophobicContact CG2-CG1 3.71Å; I78-V151 HydrophobicContact CG2-CG2 4.12Å
79	E	93.9	Very high	92.8	Very high	86 Å²	86	63.9 Å²	63.9	40%	0.402	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-34	-177.5	-73.1	175.3	166.6	0	0	112.1	R75 T76 Q81 L91	R75-E79 HydrophobicContact CG-CG 4.39Å; R75-E79 IonicContact CZ-OE1 3.04Å; R75-E79 IonicContact NE-OE1 3.98Å; R75-E79 PolarHBondContact NE-OE1 3.01Å; R75-E79 IonicContact NE-OE2 3.04Å; R75-E79 IonicContact NH2-OE1 2.89Å; R75-E79 PolarHBondContact NH2-OE1 3.23Å; R75-E79 WeakPolarHBondContact O-CB 3.37Å; R75-E79 WeakPolarHBondContact O-CG 3.37Å; R75-E79 PolarHBondContact O-N 3.48Å; T76-E79 PolarHBondContact O-N 3.41Å; E79-Q81 VanDerWaalsContact C-N 3.29Å; E79-Q81 PolarHBondContact O-N 2.89Å; E79-L91 HydrophobicContact CG-CD2 4.36Å; E79-L91 WeakPolarHBondContact OE1-CD2 3.34Å
80	S	92.9	Very high	93.2	Very high	89 Å²	89	62.4 Å²	62.4	62%	0.622	36%	0.356	S	S	*	.	H	α-helix	trans	-70	-19.9	-180	73.4	0	0	0	0	115.2	T76 Q77 I78	T76-S80 WeakPolarHBondContact O-CB 3.06Å; T76-S80 PolarHBondContact O-N 2.89Å; T76-S80 PolarHBondContact O-OG 3.32Å; Q77-S80 PolarHBondContact O-N 3.48Å; Q77-S80 PolarHBondContact O-OG 2.9Å; I78-S80 PolarHBondContact O-N 2.96Å
81	Q	91.2	Very high	93.5	Very high	74 Å²	74	61.5 Å²	61.5	35%	0.346	35%	0.349	S	S	.	.	H	α-helix	trans	-103.1	-16.8	-173.9	-66.6	175.7	-0.9	0	0	113	Q77 I78 E79 A148	Q77-Q81 WeakPolarHBondContact O-CG 3.17Å; I78-Q81 PolarHBondContact O-N 3.4Å; I78-Q81 VanDerWaalsContact O-N 3.15Å; E79-Q81 VanDerWaalsContact C-N 3.29Å; E79-Q81 PolarHBondContact O-N 2.89Å; Q81-A148 HydrophobicContact CB-CB 4.36Å; Q81-A148 WeakPolarHBondContact O-CB 3.47Å
82	L	92.7	Very high	93.6	Very high	21 Å²	21	65.5 Å²	65.5	11%	0.11	37%	0.368	C	S	.	.	S	Bend	trans	-77.4	153.7	-175.7	-69.4	174.9	0	0	0	112.5	I78 Y86 P88 A148 V151 V152	I78-L82 HydrophobicContact CG2-CD1 3.81Å; I78-L82 HydrophobicContact CG2-CG 4.36Å; I78-L82 WeakPolarHBondContact O-CG 3.34Å; I78-L82 PolarHBondContact O-N 3.29Å; L82-Y86 HydrophobicContact CB-CD1 4.34Å; L82-Y86 HydrophobicContact CD1-CD1 4.17Å; L82-Y86 HydrophobicContact CD1-CE1 4.25Å; L82-Y86 HydrophobicContact CD2-CD1 4Å; L82-Y86 HydrophobicContact CD2-CE1 3.96Å; L82-Y86 HydrophobicContact CG-CD1 4.41Å; L82-P88 VanDerWaalsContact CD1-CD 3.46Å; L82-P88 HydrophobicContact CD1-CG 3.43Å; L82-P88 VanDerWaalsContact CD1-CG 3.43Å; L82-A148 HydrophobicContact CD2-CB 4.4Å; L82-V151 HydrophobicContact CD1-CG1 4.34Å; L82-V151 HydrophobicContact CD2-CB 4.16Å; L82-V151 HydrophobicContact CD2-CG1 3.99Å; L82-V152 HydrophobicContact CD2-CG2 4.22Å
83	P	91.3	Very high	93.8	Very high	40 Å²	40	61.4 Å²	61.4	26%	0.26	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-57.9	145.6	174.7	-24.5	35	0	0	0	112.6	G85 Y86 L138 V144	P83-G85 PolarHBondContact O-N 3.14Å; P83-Y86 PolarHBondContact O-N 2.89Å; P83-Y86 VanDerWaalsContact O-N 3.13Å; P83-L138 HydrophobicContact CG-CD2 4.28Å; P83-V144 HydrophobicContact CG-CG2 3.57Å
84	A	88.5	Confident	93.9	Very high	110 Å²	110	54.4 Å²	54.4	91%	0.909	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	128.2	176.1	0	0	0	0	0	111.1
85	G	89.3	Confident	94	Very high	91 Å²	91	55.7 Å²	55.7	94%	0.938	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	-3.2	178.8	0	0	0	0	0	115.5	P83	P83-G85 PolarHBondContact O-N 3.14Å
86	Y	93.9	Very high	93.9	Very high	28 Å²	28	53.3 Å²	53.3	11%	0.11	32%	0.318	C	S	.	.			trans	-98.4	127.8	171.7	174.4	-117.3	0	0	0	111.5	L82 P83 P88 L138 V152 D155	L82-Y86 HydrophobicContact CB-CD1 4.34Å; L82-Y86 HydrophobicContact CD1-CD1 4.17Å; L82-Y86 HydrophobicContact CD1-CE1 4.25Å; L82-Y86 HydrophobicContact CD2-CD1 4Å; L82-Y86 HydrophobicContact CD2-CE1 3.96Å; L82-Y86 HydrophobicContact CG-CD1 4.41Å; P83-Y86 PolarHBondContact O-N 2.89Å; P83-Y86 VanDerWaalsContact O-N 3.13Å; Y86-P88 HydrophobicContact CE1-CG 3.93Å; Y86-L138 HydrophobicContact CD1-CD1 4.07Å; Y86-L138 HydrophobicContact CD2-CD1 3.48Å; Y86-L138 VanDerWaalsContact CD2-CD1 3.48Å; Y86-L138 HydrophobicContact CE1-CD1 4.05Å; Y86-L138 HydrophobicContact CE2-CD1 3.48Å; Y86-L138 VanDerWaalsContact CE2-CD1 3.48Å; Y86-L138 HydrophobicContact CG-CD1 3.78Å; Y86-L138 HydrophobicContact CG-CD2 4.4Å; Y86-V152 HydrophobicContact CD1-CG2 4.3Å; Y86-V152 HydrophobicContact CE1-CG2 3.6Å; Y86-D155 WeakPolarHBondContact OH-CB 3.42Å; Y86-D155 PolarHBondContact OH-OD2 3.32Å
87	K	94.7	Very high	94	Very high	139 Å²	139	48.9 Å²	48.9	60%	0.604	29%	0.291	S	S	*	.			trans	-122.7	123.3	169.1	-175.1	177.1	179.9	179	0	108	V89 L91	K87-V89 PolarHBondContact O-N 3.29Å; K87-L91 HydrophobicContact CG-CD2 4.32Å
88	P	96.6	Very high	94.1	Very high	6 Å²	6	45.7 Å²	45.7	4%	0.039	28%	0.276	C	S	.	.			trans	-56.9	138.9	177.5	-25	35.3	0	0	0	110.9	L82 Y86 Y90 L91 L94 V151 D155	L82-P88 VanDerWaalsContact CD1-CD 3.46Å; L82-P88 HydrophobicContact CD1-CG 3.43Å; L82-P88 VanDerWaalsContact CD1-CG 3.43Å; Y86-P88 HydrophobicContact CE1-CG 3.93Å; P88-Y90 PolarHBondContact O-N 3.04Å; P88-L91 HydrophobicContact CB-CB 4.25Å; P88-L91 HydrophobicContact CG-CD1 4.29Å; P88-L91 PolarHBondContact O-N 2.78Å; P88-L94 HydrophobicContact CB-CD1 3.89Å; P88-V151 HydrophobicContact CG-CG1 4.09Å; P88-D155 WeakPolarHBondContact CA-OD2 3.2Å; P88-D155 HydrophobicContact CB-CB 4.12Å
89	V	97.3	Very high	94.1	Very high	60 Å²	60	46 Å²	46	36%	0.364	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-37.1	178.6	177.8	0	0	0	0	110.2	K87 Q131 W135 D155 L183	K87-V89 PolarHBondContact O-N 3.29Å; V89-Q131 HydrophobicContact CG2-CG 4.09Å; V89-W135 HydrophobicContact CB-CZ2 4.38Å; V89-W135 HydrophobicContact CG2-CZ2 4.08Å; V89-D155 PolarHBondContact N-OD1 2.9Å; V89-D155 PolarHBondContact N-OD2 2.9Å; V89-L183 HydrophobicContact CG1-CB 4.15Å; V89-L183 HydrophobicContact CG1-CD1 3.9Å; V89-L183 HydrophobicContact CG2-CD1 4.19Å
90	Y	97.4	Very high	94.1	Very high	5 Å²	5	42.7 Å²	42.7	2%	0.02	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	28.4	-174.8	-59.2	-75.9	0	0	0	113	P88 N92 Q93 L94 W135 D155 M158 G159 A184	P88-Y90 PolarHBondContact O-N 3.04Å; Y90-N92 PolarHBondContact O-N 3.04Å; Y90-N92 VanDerWaalsContact O-N 3.12Å; Y90-Q93 PolarHBondContact O-N 3.31Å; Y90-Q93 PolarHBondContact O-OE1 3.25Å; Y90-Q93 VanDerWaalsContact O-OE1 3.09Å; Y90-L94 WeakPolarHBondContact O-CG 3.49Å; Y90-L94 PolarHBondContact O-N 3.43Å; Y90-W135 HydrophobicContact CE2-CH2 4.21Å; Y90-W135 HydrophobicContact CE2-CZ2 4.18Å; Y90-D155 WeakPolarHBondContact CD2-O 3.34Å; Y90-D155 VanDerWaalsContact CD2-OD1 3.32Å; Y90-D155 WeakPolarHBondContact CD2-OD1 3.5Å; Y90-D155 PolarHBondContact N-OD1 3.34Å; Y90-M158 HydrophobicContact CD1-CB 4.19Å; Y90-M158 HydrophobicContact CD1-CE 4.27Å; Y90-M158 HydrophobicContact CD2-CB 3.41Å; Y90-M158 VanDerWaalsContact CD2-CB 3.41Å; Y90-M158 HydrophobicContact CD2-CG 4.49Å; Y90-M158 HydrophobicContact CE2-CB 3.86Å; Y90-M158 HydrophobicContact CG-CB 3.59Å; Y90-M158 HydrophobicContact CG-CE 4.42Å; Y90-M158 HydrophobicContact CG-CG 4.32Å; Y90-G159 VanDerWaalsContact CE2-CA 3.49Å; Y90-G159 VanDerWaalsContact CE2-N 3.27Å; Y90-G159 WeakPolarHBondContact OH-CA 3.47Å; Y90-A184 VanDerWaalsContact CE1-O 3.23Å; Y90-A184 WeakPolarHBondContact CE1-O 3.41Å; Y90-A184 PolarHBondContact OH-O 3.38Å
91	L	96	Very high	94.1	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-50.1	-42	-174.8	-178.9	63.1	0	0	0	113.4	I78 E79 K87 P88 Q93 L94 Q95	I78-L91 HydrophobicContact CG2-CD1 3.96Å; E79-L91 HydrophobicContact CG-CD2 4.36Å; E79-L91 WeakPolarHBondContact OE1-CD2 3.34Å; K87-L91 HydrophobicContact CG-CD2 4.32Å; P88-L91 HydrophobicContact CB-CB 4.25Å; P88-L91 HydrophobicContact CG-CD1 4.29Å; P88-L91 PolarHBondContact O-N 2.78Å; L91-Q93 VanDerWaalsContact C-N 3.31Å; L91-Q93 PolarHBondContact O-N 3.27Å; L91-L94 PolarHBondContact O-N 3.22Å; L91-Q95 WeakPolarHBondContact O-CG 3.23Å; L91-Q95 PolarHBondContact O-N 3.42Å
92	N	94.3	Very high	94.2	Very high	99 Å²	99	44.1 Å²	44.1	53%	0.529	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-32.8	-179	-68.5	-11.1	0	0	0	113	Y90 Q95	Y90-N92 PolarHBondContact O-N 3.04Å; Y90-N92 VanDerWaalsContact O-N 3.12Å; N92-Q95 WeakPolarHBondContact O-CG 3.43Å
93	Q	95.2	Very high	94.2	Very high	36 Å²	36	44.7 Å²	44.7	17%	0.168	27%	0.267	C	S	.	.	H	α-helix	trans	-81.3	-41.5	176.2	-64.1	80	1.2	0	0	110.3	M60 Y90 L91 Q95 L96 L97 M158 T185	M60-Q93 HydrophobicContact CE-CB 3.95Å; M60-Q93 HydrophobicContact CE-CG 3.9Å; Y90-Q93 PolarHBondContact O-N 3.31Å; Y90-Q93 PolarHBondContact O-OE1 3.25Å; Y90-Q93 VanDerWaalsContact O-OE1 3.09Å; L91-Q93 VanDerWaalsContact C-N 3.31Å; L91-Q93 PolarHBondContact O-N 3.27Å; Q93-Q95 PolarHBondContact O-N 3.47Å; Q93-L96 PolarHBondContact O-N 3.36Å; Q93-L97 WeakPolarHBondContact O-CG 3.49Å; Q93-L97 PolarHBondContact O-N 3.23Å; Q93-M158 HydrophobicContact CB-CE 3.71Å; Q93-M158 HydrophobicContact CG-CE 3.91Å; Q93-T185 HydrophobicContact CG-CG2 3.97Å; Q93-T185 PolarHBondContact NE2-OG1 2.84Å
94	L	96.1	Very high	94.3	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-43.9	179.1	-65.6	177.3	0	0	0	111.5	P88 Y90 L91 L96 L97 Y98 V151 D155 M158	P88-L94 HydrophobicContact CB-CD1 3.89Å; Y90-L94 WeakPolarHBondContact O-CG 3.49Å; Y90-L94 PolarHBondContact O-N 3.43Å; L91-L94 PolarHBondContact O-N 3.22Å; L94-L96 PolarHBondContact O-N 2.93Å; L94-L97 HydrophobicContact CD2-CD1 4.47Å; L94-L97 PolarHBondContact O-N 3.49Å; L94-L97 VanDerWaalsContact O-N 3.14Å; L94-Y98 HydrophobicContact CB-CD2 4.28Å; L94-Y98 HydrophobicContact CB-CE2 4.4Å; L94-Y98 HydrophobicContact CD2-CE2 4.39Å; L94-Y98 VanDerWaalsContact O-CD2 3.25Å; L94-Y98 WeakPolarHBondContact O-CD2 3.44Å; L94-Y98 PolarHBondContact O-N 3.5Å; L94-V151 HydrophobicContact CD1-CG1 4.26Å; L94-D155 HydrophobicContact CD1-CB 3.79Å; L94-M158 HydrophobicContact CD2-CG 4.25Å
95	Q	94.7	Very high	94.7	Very high	30 Å²	30	44.5 Å²	44.5	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-57	-35.5	177.1	68.1	175.7	38.6	0	0	112.1	R75 L91 N92 Q93 A99	R75-Q95 HydrophobicContact CB-CB 4.14Å; L91-Q95 WeakPolarHBondContact O-CG 3.23Å; L91-Q95 PolarHBondContact O-N 3.42Å; N92-Q95 WeakPolarHBondContact O-CG 3.43Å; Q93-Q95 PolarHBondContact O-N 3.47Å; Q95-A99 WeakPolarHBondContact O-CB 3.4Å; Q95-A99 PolarHBondContact O-N 3.48Å
96	L	94.6	Very high	95	Very high	42 Å²	42	40.4 Å²	40.4	22%	0.22	20%	0.204	C	C	.	.	H	α-helix	trans	-74	-42.7	178.1	-63.8	176.6	0	0	0	111.2	M60 L66 A71 Q93 L94 A100	M60-L96 HydrophobicContact CG-CB 4.04Å; M60-L96 HydrophobicContact CG-CD1 4.25Å; L66-L96 HydrophobicContact CD1-CD2 4.11Å; A71-L96 HydrophobicContact CB-CD2 4.09Å; Q93-L96 PolarHBondContact O-N 3.36Å; L94-L96 PolarHBondContact O-N 2.93Å; L96-A100 VanDerWaalsContact O-CB 3.23Å; L96-A100 WeakPolarHBondContact O-CB 3.41Å; L96-A100 PolarHBondContact O-N 3.06Å
97	L	95.5	Very high	95.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-47.7	177.6	-71.6	176.8	0	0	0	111.9	A56 M60 Q93 L94 A100 R101 M106 I191 W194 Q195	A56-L97 HydrophobicContact CB-CD2 3.84Å; M60-L97 HydrophobicContact CG-CD2 4.35Å; M60-L97 HydrophobicContact SD-CD1 4.35Å; M60-L97 HydrophobicContact SD-CD2 3.48Å; M60-L97 WeakPolarHBondContact SD-CD2 3.48Å; M60-L97 HydrophobicContact SD-CG 3.74Å; Q93-L97 WeakPolarHBondContact O-CG 3.49Å; Q93-L97 PolarHBondContact O-N 3.23Å; L94-L97 HydrophobicContact CD2-CD1 4.47Å; L94-L97 PolarHBondContact O-N 3.49Å; L94-L97 VanDerWaalsContact O-N 3.14Å; L97-A100 PolarHBondContact O-N 3.39Å; L97-R101 WeakPolarHBondContact O-CG 3.48Å; L97-R101 PolarHBondContact O-N 3.49Å; L97-M106 HydrophobicContact CB-CE 4.34Å; L97-I191 HydrophobicContact CD2-CG2 4.38Å; L97-W194 HydrophobicContact CD1-CZ3 4.01Å; L97-Q195 HydrophobicContact CD2-CG 3.92Å
98	Y	95.7	Very high	95.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-70.9	-37.7	179	-78.7	-78.9	0	0	0	112.6	I78 L94 A100 R101 D102 M103 M106 M147 D150 V151 S154	I78-Y98 HydrophobicContact CD1-CD2 3.84Å; I78-Y98 HydrophobicContact CD1-CG 4.27Å; L94-Y98 HydrophobicContact CB-CD2 4.28Å; L94-Y98 HydrophobicContact CB-CE2 4.4Å; L94-Y98 HydrophobicContact CD2-CE2 4.39Å; L94-Y98 VanDerWaalsContact O-CD2 3.25Å; L94-Y98 WeakPolarHBondContact O-CD2 3.44Å; L94-Y98 PolarHBondContact O-N 3.5Å; Y98-A100 VanDerWaalsContact C-N 3.33Å; Y98-A100 PolarHBondContact O-N 2.91Å; Y98-R101 CarbonylContact O-C 3.58Å; Y98-R101 PolarHBondContact O-N 3.48Å; Y98-R101 VanDerWaalsContact O-N 3.15Å; Y98-D102 PolarHBondContact O-N 2.97Å; Y98-M103 PolarHBondContact O-N 2.75Å; Y98-M106 HydrophobicContact CD1-CE 4.28Å; Y98-M106 HydrophobicContact CD2-CE 3.93Å; Y98-M106 HydrophobicContact CE1-CE 3.84Å; Y98-M106 HydrophobicContact CE2-CE 3.41Å; Y98-M106 VanDerWaalsContact CE2-CE 3.41Å; Y98-M106 HydrophobicContact CG-CE 4.33Å; Y98-M147 HydrophobicContact CD1-CE 3.28Å; Y98-M147 HydrophobicContact CE1-CE 3.23Å; Y98-M147 HydrophobicContact CE1-SD 4.06Å; Y98-M147 HydrophobicContact CG-CE 4.26Å; Y98-D150 PolarHBondContact OH-O 2.98Å; Y98-D150 VanDerWaalsContact OH-O 3.04Å; Y98-D150 PolarHBondContact OH-OD1 3.38Å; Y98-V151 HydrophobicContact CE2-CG2 3.98Å; Y98-V151 VanDerWaalsContact OH-CA 3.29Å; Y98-V151 WeakPolarHBondContact OH-CA 3.33Å; Y98-V151 PolarHBondContact OH-N 2.88Å; Y98-S154 PolarHBondContact OH-OG 2.8Å
99	A	95.2	Very high	95.1	Very high	8 Å²	8	42.5 Å²	42.5	7%	0.066	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-39.6	174.2	0	0	0	0	0	111.8	L66 A70 A74 Q95 R101 D102	L66-A99 HydrophobicContact CD2-CB 3.36Å; A70-A99 HydrophobicContact CB-CB 4.3Å; A74-A99 HydrophobicContact CB-CB 3.78Å; Q95-A99 WeakPolarHBondContact O-CB 3.4Å; Q95-A99 PolarHBondContact O-N 3.48Å; A99-R101 PolarHBondContact O-N 3.22Å; A99-D102 PolarHBondContact O-N 3.37Å
100	A	93.6	Very high	95	Very high	15 Å²	15	50 Å²	50	12%	0.124	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-20	175	0	0	0	0	0	113.8	A56 I59 L96 L97 Y98	A56-A100 HydrophobicContact CB-CB 3.8Å; I59-A100 HydrophobicContact CB-CB 4.44Å; I59-A100 HydrophobicContact CD1-CB 3.47Å; I59-A100 VanDerWaalsContact CD1-CB 3.47Å; I59-A100 HydrophobicContact CG2-CB 4.27Å; L96-A100 VanDerWaalsContact O-CB 3.23Å; L96-A100 WeakPolarHBondContact O-CB 3.41Å; L96-A100 PolarHBondContact O-N 3.06Å; L97-A100 PolarHBondContact O-N 3.39Å; Y98-A100 VanDerWaalsContact C-N 3.33Å; Y98-A100 PolarHBondContact O-N 2.91Å
101	R	93.1	Very high	94.9	Very high	56 Å²	56	55.2 Å²	55.2	21%	0.211	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	18.2	179.1	-62.6	-176	73.1	77.1	4.5	112.6	L97 Y98 A99 M103 Q104 D199	L97-R101 WeakPolarHBondContact O-CG 3.48Å; L97-R101 PolarHBondContact O-N 3.49Å; Y98-R101 CarbonylContact O-C 3.58Å; Y98-R101 PolarHBondContact O-N 3.48Å; Y98-R101 VanDerWaalsContact O-N 3.15Å; A99-R101 PolarHBondContact O-N 3.22Å; R101-M103 PolarHBondContact O-N 3.04Å; R101-M103 VanDerWaalsContact O-N 3.11Å; R101-Q104 VanDerWaalsContact O-CB 3.25Å; R101-Q104 WeakPolarHBondContact O-CB 3.27Å; R101-Q104 WeakPolarHBondContact O-CG 3.39Å; R101-Q104 PolarHBondContact O-N 3.2Å; R101-D199 IonicContact CZ-OD1 3.98Å; R101-D199 IonicContact NH1-OD1 2.95Å; R101-D199 PolarHBondContact NH1-OD1 3.46Å
102	D	92.4	Very high	95	Very high	137 Å²	137	55.1 Å²	55.1	73%	0.733	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	37.4	-178.3	-63.6	-48.8	0	0	0	113.7	Y98 A99 Q104	Y98-D102 PolarHBondContact O-N 2.97Å; A99-D102 PolarHBondContact O-N 3.37Å; D102-Q104 PolarHBondContact O-N 2.95Å
103	M	93.2	Very high	95.1	Very high	33 Å²	33	51.3 Å²	51.3	16%	0.163	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	18.2	-175.9	-59.8	-60.1	-64.2	0	0	115.3	A74 Q77 I78 Y98 R101 M147	A74-M103 HydrophobicContact CB-SD 3.51Å; A74-M103 VanDerWaalsContact CB-SD 3.51Å; Q77-M103 HydrophobicContact CB-CE 4.03Å; Q77-M103 HydrophobicContact CG-CE 3.82Å; I78-M103 HydrophobicContact CG1-CE 4.03Å; Y98-M103 PolarHBondContact O-N 2.75Å; R101-M103 PolarHBondContact O-N 3.04Å; R101-M103 VanDerWaalsContact O-N 3.11Å; M103-M147 HydrophobicContact CE-CE 3.71Å; M103-M147 WeakPolarHBondContact O-CE 3.37Å
104	Q	93.8	Very high	95.1	Very high	110 Å²	110	55.8 Å²	55.8	51%	0.514	27%	0.267	S	S	.	.			trans	-66.1	136.5	171	-64.3	-65.4	-22.3	0	0	110.7	R101 D102	R101-Q104 VanDerWaalsContact O-CB 3.25Å; R101-Q104 WeakPolarHBondContact O-CB 3.27Å; R101-Q104 WeakPolarHBondContact O-CG 3.39Å; R101-Q104 PolarHBondContact O-N 3.2Å; D102-Q104 PolarHBondContact O-N 2.95Å
105	P	95.6	Very high	95.1	Very high	37 Å²	37	57 Å²	57	24%	0.24	28%	0.277	C	S	.	.			trans	-60.9	143	177.1	25.1	-33.7	0	0	0	111.4	E108 D150	P105-E108 HydrophobicContact CB-CG 4.03Å; P105-E108 HydrophobicContact CG-CG 3.51Å; P105-E108 VanDerWaalsContact CG-OE1 3.29Å; P105-E108 WeakPolarHBondContact CG-OE1 3.42Å; P105-D150 WeakPolarHBondContact CB-OD2 3.45Å
106	M	96.6	Very high	95.3	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.025	27%	0.27	C	S	.	.	S	Bend	trans	-93	-11	176.7	-70.2	-171.6	-81.4	0	0	112.5	L97 Y98 D150 S154 W194 L198	L97-M106 HydrophobicContact CB-CE 4.34Å; Y98-M106 HydrophobicContact CD1-CE 4.28Å; Y98-M106 HydrophobicContact CD2-CE 3.93Å; Y98-M106 HydrophobicContact CE1-CE 3.84Å; Y98-M106 HydrophobicContact CE2-CE 3.41Å; Y98-M106 VanDerWaalsContact CE2-CE 3.41Å; Y98-M106 HydrophobicContact CG-CE 4.33Å; M106-D150 PolarHBondContact N-OD1 2.92Å; M106-D150 PolarHBondContact N-OD2 3.07Å; M106-S154 WeakPolarHBondContact CE-OG 3.39Å; M106-W194 HydrophobicContact CE-CH2 4.23Å; M106-W194 HydrophobicContact CE-CZ2 4.46Å; M106-W194 HydrophobicContact SD-CH2 4.23Å; M106-W194 HydrophobicContact SD-CZ2 4.08Å; M106-L198 HydrophobicContact CB-CD1 4.01Å; M106-L198 HydrophobicContact CB-CD2 4.32Å; M106-L198 HydrophobicContact CG-CD1 3.87Å; M106-L198 WeakPolarHBondContact O-CD2 3.34Å; M106-L198 HydrophobicContact SD-CD1 3.76Å
107	W	97.1	Very high	95.4	Very high	13 Å²	13	56.1 Å²	56.1	5%	0.049	27%	0.271	C	S	.	.			trans	-120.6	35.9	-171.4	-64.7	94.4	0	0	0	113.9	N109 V113 F116 D150 L153 S154 M157 W194 L203 V207	W107-N109 VanDerWaalsContact C-N 3.28Å; W107-N109 PolarHBondContact O-N 2.89Å; W107-V113 HydrophobicContact CB-CG2 3.75Å; W107-V113 HydrophobicContact CD2-CG2 4.4Å; W107-V113 HydrophobicContact CE3-CG2 3.79Å; W107-V113 HydrophobicContact CG-CG2 4.45Å; W107-V113 VanDerWaalsContact O-CG2 3.3Å; W107-V113 WeakPolarHBondContact O-CG2 3.29Å; W107-F116 HydrophobicContact CH2-CB 3.95Å; W107-F116 AromaticContact CH2-CD1 3.47Å; W107-F116 HydrophobicContact CH2-CD1 3.47Å; W107-F116 VanDerWaalsContact CH2-CD1 3.47Å; W107-F116 HydrophobicContact CH2-CD2 4.45Å; W107-F116 HydrophobicContact CH2-CE1 4.1Å; W107-F116 AromaticContact CH2-CG 3.69Å; W107-F116 HydrophobicContact CH2-CG 3.69Å; W107-F116 HydrophobicContact CZ2-CD1 4.05Å; W107-F116 HydrophobicContact CZ2-CE1 4.3Å; W107-F116 HydrophobicContact CZ3-CB 3.78Å; W107-F116 AromaticContact CZ3-CD1 3.89Å; W107-F116 HydrophobicContact CZ3-CD1 3.89Å; W107-F116 HydrophobicContact CZ3-CG 4.02Å; W107-D150 WeakPolarHBondContact CA-OD2 3.32Å; W107-D150 VanDerWaalsContact CB-OD2 3.27Å; W107-D150 WeakPolarHBondContact CB-OD2 3.37Å; W107-D150 PolarHBondContact N-OD2 2.94Å; W107-L153 HydrophobicContact CB-CD1 3.72Å; W107-L153 HydrophobicContact CD2-CB 3.87Å; W107-L153 HydrophobicContact CD2-CD1 4.06Å; W107-L153 HydrophobicContact CD2-CG 4.46Å; W107-L153 HydrophobicContact CG-CB 3.79Å; W107-L153 HydrophobicContact CG-CD1 3.69Å; W107-L153 HydrophobicContact CG-CG 4.36Å; W107-L153 HydrophobicContact CZ2-CB 4.38Å; W107-S154 PolarHBondContact NE1-OG 3.3Å; W107-M157 HydrophobicContact CH2-CB 4.45Å; W107-M157 HydrophobicContact CH2-CG 4.33Å; W107-M157 HydrophobicContact CH2-SD 4.19Å; W107-M157 HydrophobicContact CZ2-CB 3.8Å; W107-M157 HydrophobicContact CZ2-CG 3.96Å; W107-M157 HydrophobicContact CZ2-SD 4.41Å; W107-W194 HydrophobicContact CZ2-CZ2 4.09Å; W107-L203 HydrophobicContact CE3-CD2 4.13Å; W107-L203 HydrophobicContact CZ3-CD2 4.27Å; W107-V207 HydrophobicContact CH2-CG2 4.49Å; W107-V207 HydrophobicContact CZ3-CG2 4.41Å
108	E	94.2	Very high	95.4	Very high	143 Å²	143	60.4 Å²	60.4	67%	0.668	29%	0.292	S	S	*	.			trans	-65.3	-31.8	175.3	-61	-168.2	142.7	0	0	113	P105 R110	P105-E108 HydrophobicContact CB-CG 4.03Å; P105-E108 HydrophobicContact CG-CG 3.51Å; P105-E108 VanDerWaalsContact CG-OE1 3.29Å; P105-E108 WeakPolarHBondContact CG-OE1 3.42Å; E108-R110 PolarHBondContact O-N 3.29Å; E108-R110 VanDerWaalsContact O-N 3.15Å
109	N	95.5	Very high	95.5	Very high	61 Å²	61	60.9 Å²	60.9	33%	0.326	29%	0.294	S	S	.	.			trans	-73.9	106.9	-179.1	-173.4	-51.6	0	0	0	110.9	W107 D111 A112 V113 P204	W107-N109 VanDerWaalsContact C-N 3.28Å; W107-N109 PolarHBondContact O-N 2.89Å; N109-D111 VanDerWaalsContact C-N 3.31Å; N109-D111 PolarHBondContact O-N 3.42Å; N109-D111 WeakPolarHBondContact OD1-CB 3.44Å; N109-D111 PolarHBondContact OD1-N 3.46Å; N109-A112 HydrophobicContact CB-CB 4.06Å; N109-A112 PolarHBondContact O-N 3.05Å; N109-A112 PolarHBondContact OD1-N 3.35Å; N109-V113 WeakPolarHBondContact O-CG2 3.45Å; N109-V113 PolarHBondContact O-N 3.06Å; N109-P204 WeakPolarHBondContact ND2-CG 3.35Å
110	R	95	Very high	95.6	Very high	217 Å²	217	60.6 Å²	60.6	82%	0.819	29%	0.291	S	S	*	.	H	α-helix	trans	-62.5	-33.4	-177.2	-66	-174.8	177.6	-174.3	-0.4	113.9	E108 V113 K114	E108-R110 PolarHBondContact O-N 3.29Å; E108-R110 VanDerWaalsContact O-N 3.15Å; R110-V113 PolarHBondContact O-N 3.43Å; R110-K114 WeakPolarHBondContact O-CB 3.39Å; R110-K114 PolarHBondContact O-N 2.76Å
111	D	95.8	Very high	95.7	Very high	115 Å²	115	61.4 Å²	61.4	62%	0.615	30%	0.298	S	S	*	.	H	α-helix	trans	-69.8	-42.6	179	-65	-37	0	0	0	110.7	N109 K114 A115	N109-D111 VanDerWaalsContact C-N 3.31Å; N109-D111 PolarHBondContact O-N 3.42Å; N109-D111 WeakPolarHBondContact OD1-CB 3.44Å; N109-D111 PolarHBondContact OD1-N 3.46Å; D111-K114 PolarHBondContact O-N 3.39Å; D111-A115 WeakPolarHBondContact O-CB 3.35Å; D111-A115 PolarHBondContact O-N 2.8Å
112	A	97.2	Very high	95.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-42.6	173.4	0	0	0	0	0	112.1	N109 A115 F116 L203 P204	N109-A112 HydrophobicContact CB-CB 4.06Å; N109-A112 PolarHBondContact O-N 3.05Å; N109-A112 PolarHBondContact OD1-N 3.35Å; A112-A115 PolarHBondContact O-N 3.46Å; A112-F116 WeakPolarHBondContact O-CB 3.45Å; A112-F116 PolarHBondContact O-N 3.41Å; A112-L203 HydrophobicContact CB-CB 4.21Å; A112-L203 HydrophobicContact CB-CD2 3.53Å; A112-L203 HydrophobicContact CB-CG 3.64Å; A112-P204 HydrophobicContact CB-CG 4.12Å
113	V	97.2	Very high	96.1	Very high	20 Å²	20	52.6 Å²	52.6	12%	0.121	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-49.8	175.1	173.4	0	0	0	0	110.7	W107 N109 R110 A115 F116 Q117 L153	W107-V113 HydrophobicContact CB-CG2 3.75Å; W107-V113 HydrophobicContact CD2-CG2 4.4Å; W107-V113 HydrophobicContact CE3-CG2 3.79Å; W107-V113 HydrophobicContact CG-CG2 4.45Å; W107-V113 VanDerWaalsContact O-CG2 3.3Å; W107-V113 WeakPolarHBondContact O-CG2 3.29Å; N109-V113 WeakPolarHBondContact O-CG2 3.45Å; N109-V113 PolarHBondContact O-N 3.06Å; R110-V113 PolarHBondContact O-N 3.43Å; V113-A115 PolarHBondContact O-N 3.26Å; V113-F116 PolarHBondContact O-N 3.5Å; V113-Q117 HydrophobicContact CG1-CG 4.31Å; V113-Q117 WeakPolarHBondContact O-CB 3.25Å; V113-Q117 VanDerWaalsContact O-CG 3.27Å; V113-Q117 WeakPolarHBondContact O-CG 3.23Å; V113-Q117 PolarHBondContact O-N 2.79Å; V113-L153 HydrophobicContact CG1-CD1 4.08Å; V113-L153 HydrophobicContact CG2-CD1 4.09Å
114	K	96	Very high	96.3	Very high	130 Å²	130	51.3 Å²	51.3	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-60.8	-48	-179.6	-176.4	-177.7	176.4	-173.5	0	111.5	R110 D111 F116 Q117 Q118	R110-K114 WeakPolarHBondContact O-CB 3.39Å; R110-K114 PolarHBondContact O-N 2.76Å; D111-K114 PolarHBondContact O-N 3.39Å; K114-F116 VanDerWaalsContact C-N 3.35Å; K114-F116 PolarHBondContact O-N 2.9Å; K114-Q117 PolarHBondContact O-N 2.73Å; K114-Q118 WeakPolarHBondContact O-CG 3.44Å; K114-Q118 PolarHBondContact O-N 2.91Å
115	A	96.2	Very high	96.5	Very high	26 Å²	26	48.7 Å²	48.7	22%	0.215	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-42.5	179.3	0	0	0	0	0	111.8	D111 A112 V113 Q118 Q119 V207	D111-A115 WeakPolarHBondContact O-CB 3.35Å; D111-A115 PolarHBondContact O-N 2.8Å; A112-A115 PolarHBondContact O-N 3.46Å; V113-A115 PolarHBondContact O-N 3.26Å; A115-Q118 PolarHBondContact O-N 3.37Å; A115-Q119 WeakPolarHBondContact O-CG 3.44Å; A115-Q119 PolarHBondContact O-N 2.97Å; A115-V207 HydrophobicContact CB-CG1 3.79Å
116	F	98.1	Very high	96.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.4	-42.5	179.1	178.9	-122.3	0	0	0	111.8	W107 A112 V113 K114 Q118 Q119 L120 L153 A156 M157 Y160 V207	W107-F116 HydrophobicContact CH2-CB 3.95Å; W107-F116 AromaticContact CH2-CD1 3.47Å; W107-F116 HydrophobicContact CH2-CD1 3.47Å; W107-F116 VanDerWaalsContact CH2-CD1 3.47Å; W107-F116 HydrophobicContact CH2-CD2 4.45Å; W107-F116 HydrophobicContact CH2-CE1 4.1Å; W107-F116 AromaticContact CH2-CG 3.69Å; W107-F116 HydrophobicContact CH2-CG 3.69Å; W107-F116 HydrophobicContact CZ2-CD1 4.05Å; W107-F116 HydrophobicContact CZ2-CE1 4.3Å; W107-F116 HydrophobicContact CZ3-CB 3.78Å; W107-F116 AromaticContact CZ3-CD1 3.89Å; W107-F116 HydrophobicContact CZ3-CD1 3.89Å; W107-F116 HydrophobicContact CZ3-CG 4.02Å; A112-F116 WeakPolarHBondContact O-CB 3.45Å; A112-F116 PolarHBondContact O-N 3.41Å; V113-F116 PolarHBondContact O-N 3.5Å; K114-F116 VanDerWaalsContact C-N 3.35Å; K114-F116 PolarHBondContact O-N 2.9Å; F116-Q118 VanDerWaalsContact C-N 3.31Å; F116-Q118 PolarHBondContact O-N 3.37Å; F116-Q119 PolarHBondContact O-N 3.17Å; F116-L120 HydrophobicContact CZ-CD1 4.16Å; F116-L120 WeakPolarHBondContact O-CB 3.45Å; F116-L120 PolarHBondContact O-N 2.9Å; F116-L153 HydrophobicContact CD1-CD2 4.02Å; F116-L153 HydrophobicContact CE1-CD2 4.34Å; F116-A156 HydrophobicContact CE1-CB 4.06Å; F116-A156 HydrophobicContact CZ-CB 4.11Å; F116-M157 HydrophobicContact CD2-SD 3.81Å; F116-M157 HydrophobicContact CE1-CB 4.17Å; F116-M157 HydrophobicContact CE1-SD 4.44Å; F116-M157 HydrophobicContact CE2-SD 3.45Å; F116-M157 WeakPolarHBondContact CE2-SD 3.46Å; F116-M157 HydrophobicContact CG-SD 4.47Å; F116-M157 HydrophobicContact CZ-CB 3.93Å; F116-M157 HydrophobicContact CZ-SD 3.82Å; F116-Y160 AromaticContact CE2-CD1 3.89Å; F116-Y160 HydrophobicContact CE2-CD1 3.89Å; F116-Y160 AromaticContact CE2-CG 3.89Å; F116-Y160 HydrophobicContact CE2-CG 3.89Å; F116-V207 HydrophobicContact CB-CG1 3.76Å; F116-V207 HydrophobicContact CB-CG2 4.38Å
117	Q	96.7	Very high	96.5	Very high	52 Å²	52	49.4 Å²	49.4	24%	0.243	25%	0.253	C	S	.	.	H	α-helix	trans	-63.3	-36	178.1	-74	-172.7	-20.9	0	0	112.9	V113 K114 L120 A121 L153	V113-Q117 HydrophobicContact CG1-CG 4.31Å; V113-Q117 WeakPolarHBondContact O-CB 3.25Å; V113-Q117 VanDerWaalsContact O-CG 3.27Å; V113-Q117 WeakPolarHBondContact O-CG 3.23Å; V113-Q117 PolarHBondContact O-N 2.79Å; K114-Q117 PolarHBondContact O-N 2.73Å; Q117-L120 PolarHBondContact O-N 3.3Å; Q117-A121 WeakPolarHBondContact O-CB 3.3Å; Q117-A121 PolarHBondContact O-N 3.43Å; Q117-L153 HydrophobicContact CG-CD2 4Å
118	Q	95.2	Very high	96.5	Very high	91 Å²	91	49.6 Å²	49.6	43%	0.425	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-51	172.8	-74.1	172.4	-29.7	0	0	111.1	K114 A115 F116 L120 A121 E122	K114-Q118 WeakPolarHBondContact O-CG 3.44Å; K114-Q118 PolarHBondContact O-N 2.91Å; A115-Q118 PolarHBondContact O-N 3.37Å; F116-Q118 VanDerWaalsContact C-N 3.31Å; F116-Q118 PolarHBondContact O-N 3.37Å; Q118-L120 VanDerWaalsContact C-N 3.3Å; Q118-L120 PolarHBondContact O-N 3.24Å; Q118-A121 WeakPolarHBondContact O-CB 3.29Å; Q118-A121 PolarHBondContact O-N 3.18Å; Q118-E122 WeakPolarHBondContact O-CG 3.47Å; Q118-E122 PolarHBondContact O-N 2.96Å
119	Q	97.3	Very high	96.6	Very high	10 Å²	10	43.3 Å²	43.3	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-37.2	177.8	-68.3	-178.8	39.7	0	0	112.8	A115 F116 E122 V123 Y160 V207 A211	A115-Q119 WeakPolarHBondContact O-CG 3.44Å; A115-Q119 PolarHBondContact O-N 2.97Å; F116-Q119 PolarHBondContact O-N 3.17Å; Q119-E122 PolarHBondContact O-N 3.14Å; Q119-V123 PolarHBondContact O-N 3.19Å; Q119-V123 VanDerWaalsContact O-N 3.13Å; Q119-Y160 PolarHBondContact OE1-OH 3.15Å; Q119-Y160 VanDerWaalsContact OE1-OH 3.07Å; Q119-V207 PolarHBondContact NE2-O 3.42Å; Q119-A211 HydrophobicContact CG-CB 4.4Å
120	L	97.8	Very high	96.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-41.4	176.7	-168.6	71.5	0	0	0	111.2	F116 Q117 Q118 V123 A124 F132 W135 V136 L139 A156	F116-L120 HydrophobicContact CZ-CD1 4.16Å; F116-L120 WeakPolarHBondContact O-CB 3.45Å; F116-L120 PolarHBondContact O-N 2.9Å; Q117-L120 PolarHBondContact O-N 3.3Å; Q118-L120 VanDerWaalsContact C-N 3.3Å; Q118-L120 PolarHBondContact O-N 3.24Å; L120-V123 PolarHBondContact O-N 3.17Å; L120-A124 VanDerWaalsContact O-CB 3.31Å; L120-A124 WeakPolarHBondContact O-CB 3.49Å; L120-A124 PolarHBondContact O-N 3.4Å; L120-F132 HydrophobicContact CD1-CD1 3.57Å; L120-F132 HydrophobicContact CD1-CE1 4.1Å; L120-W135 HydrophobicContact CD2-CB 4.25Å; L120-V136 HydrophobicContact CD2-CG2 4.04Å; L120-V136 HydrophobicContact CG-CG2 3.95Å; L120-L139 HydrophobicContact CD2-CD1 3.56Å; L120-A156 HydrophobicContact CD1-CB 4.17Å; L120-A156 HydrophobicContact CD2-CB 3.94Å
121	A	96.1	Very high	96.8	Very high	33 Å²	33	35 Å²	35	27%	0.273	20%	0.199	S	C	.	.	H	α-helix	trans	-63.1	-43.1	175.7	0	0	0	0	0	111.6	Q117 Q118 V123 A124 I125	Q117-A121 WeakPolarHBondContact O-CB 3.3Å; Q117-A121 PolarHBondContact O-N 3.43Å; Q118-A121 WeakPolarHBondContact O-CB 3.29Å; Q118-A121 PolarHBondContact O-N 3.18Å; A121-V123 VanDerWaalsContact C-N 3.33Å; A121-V123 PolarHBondContact O-N 2.97Å; A121-A124 PolarHBondContact O-N 3.22Å; A121-I125 WeakPolarHBondContact O-CB 3.48Å; A121-I125 WeakPolarHBondContact O-CD1 3.39Å; A121-I125 WeakPolarHBondContact O-CG1 3.43Å; A121-I125 PolarHBondContact O-N 2.89Å
122	E	96.2	Very high	97	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.033	17%	0.17	C	C	.	.	H	α-helix	trans	-58.8	-43.9	175.4	-67.3	-179.9	-111.2	0	0	112	Q118 Q119 A126 Y217 H221 L224 A360	Q118-E122 WeakPolarHBondContact O-CG 3.47Å; Q118-E122 PolarHBondContact O-N 2.96Å; Q119-E122 PolarHBondContact O-N 3.14Å; E122-A126 PolarHBondContact O-N 3.35Å; E122-Y217 PolarHBondContact OE1-OH 3.03Å; E122-Y217 WeakPolarHBondContact OE2-CE2 3.4Å; E122-H221 VanDerWaalsContact CD-CE1 3.41Å; E122-H221 IonicContact OE1-CE1 3.81Å; E122-H221 PolarHBondContact OE1-CE1 3.24Å; E122-H221 IonicContact OE1-ND1 3.03Å; E122-H221 PolarHBondContact OE1-ND1 3.24Å; E122-H221 IonicContact OE2-CE1 2.74Å; E122-H221 IonicContact OE2-ND1 3.85Å; E122-H221 PolarHBondContact OE2-ND1 3.43Å; E122-L224 HydrophobicContact CB-CD2 4.5Å; E122-L224 HydrophobicContact CG-CD2 3.93Å; E122-A360 WeakPolarHBondContact O-CB 3.49Å
123	V	97.1	Very high	96.9	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-69.6	-37.6	177.7	166.2	0	0	0	0	112.4	Q119 L120 A121 A126 F128 F132 Y160 F163 Q364	Q119-V123 PolarHBondContact O-N 3.19Å; Q119-V123 VanDerWaalsContact O-N 3.13Å; L120-V123 PolarHBondContact O-N 3.17Å; A121-V123 VanDerWaalsContact C-N 3.33Å; A121-V123 PolarHBondContact O-N 2.97Å; V123-A126 WeakPolarHBondContact O-CB 3.49Å; V123-A126 PolarHBondContact O-N 3.41Å; V123-F128 HydrophobicContact CG1-CE1 4.03Å; V123-F128 HydrophobicContact CG1-CZ 3.63Å; V123-F132 HydrophobicContact CG1-CB 4.19Å; V123-F132 HydrophobicContact CG1-CD1 3.86Å; V123-F132 HydrophobicContact CG1-CD2 3.27Å; V123-F132 HydrophobicContact CG1-CE1 3.99Å; V123-F132 HydrophobicContact CG1-CE2 3.42Å; V123-F132 VanDerWaalsContact CG1-CE2 3.42Å; V123-F132 HydrophobicContact CG1-CG 3.52Å; V123-F132 HydrophobicContact CG1-CZ 3.79Å; V123-Y160 HydrophobicContact CB-CE2 4.31Å; V123-Y160 HydrophobicContact CG2-CD2 4.42Å; V123-Y160 HydrophobicContact CG2-CE2 3.64Å; V123-F163 HydrophobicContact CG2-CE1 4.15Å; V123-Q364 VanDerWaalsContact CG2-CD 3.45Å; V123-Q364 HydrophobicContact CG2-CG 4.02Å
124	A	97.6	Very high	96.9	Very high	6 Å²	6	36.9 Å²	36.9	5%	0.05	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-47.9	174.8	0	0	0	0	0	111.3	L120 A121 A126 G127 F132 N133 V136	L120-A124 VanDerWaalsContact O-CB 3.31Å; L120-A124 WeakPolarHBondContact O-CB 3.49Å; L120-A124 PolarHBondContact O-N 3.4Å; A121-A124 PolarHBondContact O-N 3.22Å; A124-A126 PolarHBondContact O-N 3.47Å; A124-G127 WeakPolarHBondContact O-CA 3.46Å; A124-G127 PolarHBondContact O-N 3.29Å; A124-F132 HydrophobicContact CB-CB 4.08Å; A124-N133 VanDerWaalsContact C-OD1 3.26Å; A124-N133 VanDerWaalsContact CA-OD1 3.29Å; A124-N133 WeakPolarHBondContact CA-OD1 3.31Å; A124-N133 VanDerWaalsContact CB-OD1 3.27Å; A124-N133 WeakPolarHBondContact CB-OD1 3.44Å; A124-N133 PolarHBondContact O-OD1 3.21Å; A124-V136 HydrophobicContact CB-CB 4.38Å; A124-V136 HydrophobicContact CB-CG2 3.66Å
125	I	97	Very high	97	Very high	54 Å²	54	30.7 Å²	30.7	28%	0.277	18%	0.176	S	C	.	.	H	α-helix	trans	-60	-33.9	178.3	-67.3	162.1	0	0	0	111.7	A121 G127 L224 L228 A356 G357 A360	A121-I125 WeakPolarHBondContact O-CB 3.48Å; A121-I125 WeakPolarHBondContact O-CD1 3.39Å; A121-I125 WeakPolarHBondContact O-CG1 3.43Å; A121-I125 PolarHBondContact O-N 2.89Å; I125-G127 PolarHBondContact O-N 2.84Å; I125-L224 HydrophobicContact CG2-CD1 4.49Å; I125-L228 HydrophobicContact CD1-CD1 3.64Å; I125-L228 HydrophobicContact CD1-CD2 4.03Å; I125-L228 HydrophobicContact CD1-CG 4.46Å; I125-A356 HydrophobicContact CG2-CB 4.39Å; I125-G357 WeakPolarHBondContact O-CA 3.46Å; I125-A360 HydrophobicContact CB-CB 4.01Å; I125-A360 HydrophobicContact CG2-CB 3.67Å
126	A	97.1	Very high	97.1	Very high	12 Å²	12	31.2 Å²	31.2	10%	0.099	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-22.6	175.2	0	0	0	0	0	113.6	E122 V123 A124 F128 A360 L361 Q364	E122-A126 PolarHBondContact O-N 3.35Å; V123-A126 WeakPolarHBondContact O-CB 3.49Å; V123-A126 PolarHBondContact O-N 3.41Å; A124-A126 PolarHBondContact O-N 3.47Å; A126-F128 VanDerWaalsContact C-N 3.28Å; A126-F128 HydrophobicContact CB-CD1 3.64Å; A126-F128 HydrophobicContact CB-CE1 3.7Å; A126-F128 PolarHBondContact O-N 3.13Å; A126-F128 VanDerWaalsContact O-N 3.12Å; A126-A360 HydrophobicContact CB-CB 4.12Å; A126-L361 HydrophobicContact CB-CB 4.15Å; A126-L361 HydrophobicContact CB-CD1 4.45Å; A126-Q364 HydrophobicContact CB-CG 4.33Å
127	G	96.1	Very high	97	Very high	46 Å²	46	37.2 Å²	37.2	47%	0.474	21%	0.205	S	C	.	.			trans	71.7	5.7	164.6	0	0	0	0	0	117.1	A124 I125 Q129	A124-G127 WeakPolarHBondContact O-CA 3.46Å; A124-G127 PolarHBondContact O-N 3.29Å; I125-G127 PolarHBondContact O-N 2.84Å; G127-Q129 VanDerWaalsContact C-N 3.34Å; G127-Q129 PolarHBondContact O-N 3.38Å
128	F	96	Very high	97	Very high	16 Å²	16	35.9 Å²	35.9	7%	0.07	20%	0.199	C	C	.	.	S	Bend	trans	-78	-16.3	-178.1	62.4	-94.2	0	0	0	113.9	V123 A126 F132 F163 L175 Y181 L361 Q364	V123-F128 HydrophobicContact CG1-CE1 4.03Å; V123-F128 HydrophobicContact CG1-CZ 3.63Å; A126-F128 VanDerWaalsContact C-N 3.28Å; A126-F128 HydrophobicContact CB-CD1 3.64Å; A126-F128 HydrophobicContact CB-CE1 3.7Å; A126-F128 PolarHBondContact O-N 3.13Å; A126-F128 VanDerWaalsContact O-N 3.12Å; F128-F132 HydrophobicContact CE2-CE2 4.17Å; F128-F132 HydrophobicContact CZ-CE2 4.38Å; F128-F163 HydrophobicContact CE1-CZ 4.34Å; F128-F163 AromaticContact CE2-CD2 3.81Å; F128-F163 HydrophobicContact CE2-CD2 3.81Å; F128-F163 AromaticContact CE2-CE2 3.48Å; F128-F163 HydrophobicContact CE2-CE2 3.48Å; F128-F163 VanDerWaalsContact CE2-CE2 3.48Å; F128-F163 HydrophobicContact CE2-CZ 4.01Å; F128-F163 HydrophobicContact CZ-CD2 4.06Å; F128-F163 HydrophobicContact CZ-CE1 4.05Å; F128-F163 AromaticContact CZ-CE2 3.45Å; F128-F163 HydrophobicContact CZ-CE2 3.45Å; F128-F163 VanDerWaalsContact CZ-CE2 3.45Å; F128-F163 AromaticContact CZ-CZ 3.46Å; F128-F163 HydrophobicContact CZ-CZ 3.46Å; F128-F163 VanDerWaalsContact CZ-CZ 3.46Å; F128-L175 HydrophobicContact CD1-CD2 4.08Å; F128-L175 HydrophobicContact CD2-CD2 4.45Å; F128-L175 HydrophobicContact CE1-CD2 3.98Å; F128-L175 HydrophobicContact CE2-CD2 4.35Å; F128-L175 HydrophobicContact CG-CD2 4.32Å; F128-L175 HydrophobicContact CZ-CD2 4.11Å; F128-Y181 HydrophobicContact CD2-CE1 4.03Å; F128-Y181 HydrophobicContact CE2-CE1 4.01Å; F128-L361 HydrophobicContact CD1-CD1 4Å; F128-Q364 HydrophobicContact CE1-CB 4.46Å; F128-Q364 HydrophobicContact CE1-CG 4.05Å
129	Q	97.6	Very high	97	Very high	12 Å²	12	32 Å²	32	6%	0.056	18%	0.182	C	C	.	.			trans	-139.5	106	178.5	168.3	57.8	-97.7	0	0	110.5	G127 Q131 F132 Y181 L183	G127-Q129 VanDerWaalsContact C-N 3.34Å; G127-Q129 PolarHBondContact O-N 3.38Å; Q129-Q131 HydrophobicContact CG-CB 4.35Å; Q129-Q131 PolarHBondContact O-N 3.22Å; Q129-Q131 VanDerWaalsContact O-N 3.13Å; Q129-Q131 VanDerWaalsContact OE1-N 3.15Å; Q129-F132 HydrophobicContact CB-CD2 3.6Å; Q129-F132 HydrophobicContact CB-CE2 3.8Å; Q129-F132 HydrophobicContact CG-CD2 3.54Å; Q129-F132 HydrophobicContact CG-CE2 3.66Å; Q129-F132 PolarHBondContact O-N 3.3Å; Q129-Y181 HydrophobicContact CB-CE1 3.8Å; Q129-Y181 HydrophobicContact CG-CE1 4.13Å; Q129-Y181 PolarHBondContact NE2-O 2.96Å; Q129-L183 HydrophobicContact CG-CD2 4.49Å
130	P	97.5	Very high	96.9	Very high	71 Å²	71	36.4 Å²	36.4	46%	0.461	21%	0.209	S	C	.	.	H	α-helix	trans	-58.3	-26.4	-175.7	-27.9	35.5	0	0	0	115.5	F132 N133 K134 P180	P130-F132 PolarHBondContact O-N 3.03Å; P130-N133 WeakPolarHBondContact O-CB 3.35Å; P130-N133 PolarHBondContact O-N 3.39Å; P130-N133 VanDerWaalsContact O-N 3.15Å; P130-K134 PolarHBondContact O-N 2.95Å; P130-P180 HydrophobicContact CG-CG 3.95Å
131	Q	97.9	Very high	96.8	Very high	31 Å²	31	39.9 Å²	39.9	15%	0.145	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-30.5	179.7	-175.6	62.4	38.8	0	0	112.7	V89 Q129 N133 K134 W135 L183	V89-Q131 HydrophobicContact CG2-CG 4.09Å; Q129-Q131 HydrophobicContact CG-CB 4.35Å; Q129-Q131 PolarHBondContact O-N 3.22Å; Q129-Q131 VanDerWaalsContact O-N 3.13Å; Q129-Q131 VanDerWaalsContact OE1-N 3.15Å; Q131-N133 VanDerWaalsContact C-N 3.33Å; Q131-N133 PolarHBondContact O-N 2.92Å; Q131-K134 WeakPolarHBondContact O-CB 3.34Å; Q131-K134 PolarHBondContact O-N 3.24Å; Q131-W135 HydrophobicContact CB-CH2 4.26Å; Q131-W135 HydrophobicContact CB-CZ3 4.31Å; Q131-W135 HydrophobicContact CG-CD2 3.86Å; Q131-W135 HydrophobicContact CG-CE3 3.96Å; Q131-W135 HydrophobicContact CG-CH2 3.35Å; Q131-W135 HydrophobicContact CG-CZ2 3.31Å; Q131-W135 HydrophobicContact CG-CZ3 3.71Å; Q131-W135 VanDerWaalsContact NE2-CE2 3.29Å; Q131-W135 VanDerWaalsContact NE2-NE1 3.14Å; Q131-W135 PolarHBondContact O-N 2.99Å; Q131-L183 HydrophobicContact CB-CD1 3.7Å; Q131-L183 HydrophobicContact CG-CD1 3.58Å
132	F	98.1	Very high	96.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.4	-38.9	175.2	-68.4	-66.9	0	0	0	112.2	L120 V123 A124 F128 Q129 P130 K134 W135 V136 Y160 F163	L120-F132 HydrophobicContact CD1-CD1 3.57Å; L120-F132 HydrophobicContact CD1-CE1 4.1Å; V123-F132 HydrophobicContact CG1-CB 4.19Å; V123-F132 HydrophobicContact CG1-CD1 3.86Å; V123-F132 HydrophobicContact CG1-CD2 3.27Å; V123-F132 HydrophobicContact CG1-CE1 3.99Å; V123-F132 HydrophobicContact CG1-CE2 3.42Å; V123-F132 VanDerWaalsContact CG1-CE2 3.42Å; V123-F132 HydrophobicContact CG1-CG 3.52Å; V123-F132 HydrophobicContact CG1-CZ 3.79Å; A124-F132 HydrophobicContact CB-CB 4.08Å; F128-F132 HydrophobicContact CE2-CE2 4.17Å; F128-F132 HydrophobicContact CZ-CE2 4.38Å; Q129-F132 HydrophobicContact CB-CD2 3.6Å; Q129-F132 HydrophobicContact CB-CE2 3.8Å; Q129-F132 HydrophobicContact CG-CD2 3.54Å; Q129-F132 HydrophobicContact CG-CE2 3.66Å; Q129-F132 PolarHBondContact O-N 3.3Å; P130-F132 PolarHBondContact O-N 3.03Å; F132-K134 VanDerWaalsContact C-N 3.32Å; F132-K134 PolarHBondContact O-N 3.47Å; F132-W135 AromaticContact CD1-CE3 3.56Å; F132-W135 HydrophobicContact CD1-CE3 3.56Å; F132-W135 AromaticContact CD1-CZ3 3.53Å; F132-W135 HydrophobicContact CD1-CZ3 3.53Å; F132-W135 HydrophobicContact CE1-CE3 4.07Å; F132-W135 AromaticContact CE1-CZ3 3.61Å; F132-W135 HydrophobicContact CE1-CZ3 3.61Å; F132-W135 HydrophobicContact CG-CE3 4.25Å; F132-W135 HydrophobicContact CG-CZ3 4.22Å; F132-W135 HydrophobicContact CZ-CZ3 4.36Å; F132-W135 PolarHBondContact O-N 2.92Å; F132-V136 WeakPolarHBondContact O-CG2 3.43Å; F132-V136 PolarHBondContact O-N 2.75Å; F132-Y160 HydrophobicContact CE1-CD2 4.01Å; F132-Y160 HydrophobicContact CZ-CD2 4.45Å; F132-F163 HydrophobicContact CZ-CB 4Å; F132-F163 HydrophobicContact CZ-CG 4.36Å
133	N	96.6	Very high	96.5	Very high	63 Å²	63	46 Å²	46	34%	0.337	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-43.6	173.9	-65.9	-6.6	0	0	0	110.9	A124 P130 Q131 W135 V136 E137	A124-N133 VanDerWaalsContact C-OD1 3.26Å; A124-N133 VanDerWaalsContact CA-OD1 3.29Å; A124-N133 WeakPolarHBondContact CA-OD1 3.31Å; A124-N133 VanDerWaalsContact CB-OD1 3.27Å; A124-N133 WeakPolarHBondContact CB-OD1 3.44Å; A124-N133 PolarHBondContact O-OD1 3.21Å; P130-N133 WeakPolarHBondContact O-CB 3.35Å; P130-N133 PolarHBondContact O-N 3.39Å; P130-N133 VanDerWaalsContact O-N 3.15Å; Q131-N133 VanDerWaalsContact C-N 3.33Å; Q131-N133 PolarHBondContact O-N 2.92Å; N133-W135 VanDerWaalsContact C-N 3.33Å; N133-W135 PolarHBondContact O-N 3.31Å; N133-V136 PolarHBondContact O-N 3.5Å; N133-V136 VanDerWaalsContact O-N 3.14Å; N133-E137 WeakPolarHBondContact O-CG 3.29Å; N133-E137 PolarHBondContact O-N 3.47Å
134	K	96.8	Very high	96.4	Very high	112 Å²	112	46 Å²	46	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-61.8	-40	179.7	-145.8	176.3	-173.6	179.9	0	112.4	P130 Q131 F132 L138	P130-K134 PolarHBondContact O-N 2.95Å; Q131-K134 WeakPolarHBondContact O-CB 3.34Å; Q131-K134 PolarHBondContact O-N 3.24Å; F132-K134 VanDerWaalsContact C-N 3.32Å; F132-K134 PolarHBondContact O-N 3.47Å; K134-L138 WeakPolarHBondContact O-CG 3.22Å; K134-L138 PolarHBondContact O-N 3.08Å
135	W	98	Very high	96.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-67.9	-41	173.2	-68.6	-45.7	0	0	0	112.3	V89 Y90 L120 Q131 F132 N133 L138 L139 D155 A156 L183	V89-W135 HydrophobicContact CB-CZ2 4.38Å; V89-W135 HydrophobicContact CG2-CZ2 4.08Å; Y90-W135 HydrophobicContact CE2-CH2 4.21Å; Y90-W135 HydrophobicContact CE2-CZ2 4.18Å; L120-W135 HydrophobicContact CD2-CB 4.25Å; Q131-W135 HydrophobicContact CB-CH2 4.26Å; Q131-W135 HydrophobicContact CB-CZ3 4.31Å; Q131-W135 HydrophobicContact CG-CD2 3.86Å; Q131-W135 HydrophobicContact CG-CE3 3.96Å; Q131-W135 HydrophobicContact CG-CH2 3.35Å; Q131-W135 HydrophobicContact CG-CZ2 3.31Å; Q131-W135 HydrophobicContact CG-CZ3 3.71Å; Q131-W135 VanDerWaalsContact NE2-CE2 3.29Å; Q131-W135 VanDerWaalsContact NE2-NE1 3.14Å; Q131-W135 PolarHBondContact O-N 2.99Å; F132-W135 AromaticContact CD1-CE3 3.56Å; F132-W135 HydrophobicContact CD1-CE3 3.56Å; F132-W135 AromaticContact CD1-CZ3 3.53Å; F132-W135 HydrophobicContact CD1-CZ3 3.53Å; F132-W135 HydrophobicContact CE1-CE3 4.07Å; F132-W135 AromaticContact CE1-CZ3 3.61Å; F132-W135 HydrophobicContact CE1-CZ3 3.61Å; F132-W135 HydrophobicContact CG-CE3 4.25Å; F132-W135 HydrophobicContact CG-CZ3 4.22Å; F132-W135 HydrophobicContact CZ-CZ3 4.36Å; F132-W135 PolarHBondContact O-N 2.92Å; N133-W135 VanDerWaalsContact C-N 3.33Å; N133-W135 PolarHBondContact O-N 3.31Å; W135-L138 PolarHBondContact O-N 3.19Å; W135-L139 WeakPolarHBondContact O-CB 3.27Å; W135-L139 WeakPolarHBondContact O-CG 3.17Å; W135-L139 PolarHBondContact O-N 2.74Å; W135-D155 PolarHBondContact NE1-OD2 3.39Å; W135-A156 HydrophobicContact CB-CB 3.92Å; W135-A156 HydrophobicContact CD2-CB 3.77Å; W135-A156 HydrophobicContact CE3-CB 4.01Å; W135-A156 HydrophobicContact CG-CB 3.73Å; W135-L183 HydrophobicContact CH2-CD1 4.22Å
136	V	97.3	Very high	96.1	Very high	37 Å²	37	51.1 Å²	51.1	22%	0.224	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-44.1	176.1	170.3	0	0	0	0	111.2	L120 A124 F132 N133 L138 L139 T140	L120-V136 HydrophobicContact CD2-CG2 4.04Å; L120-V136 HydrophobicContact CG-CG2 3.95Å; A124-V136 HydrophobicContact CB-CB 4.38Å; A124-V136 HydrophobicContact CB-CG2 3.66Å; F132-V136 WeakPolarHBondContact O-CG2 3.43Å; F132-V136 PolarHBondContact O-N 2.75Å; N133-V136 PolarHBondContact O-N 3.5Å; N133-V136 VanDerWaalsContact O-N 3.14Å; V136-L138 PolarHBondContact O-N 2.81Å; V136-L139 CarbonylContact O-C 3.51Å; V136-L139 PolarHBondContact O-N 3.43Å; V136-L139 VanDerWaalsContact O-N 3.13Å; V136-T140 HydrophobicContact CG1-CG2 4.31Å; V136-T140 WeakPolarHBondContact O-CG2 3.23Å; V136-T140 PolarHBondContact O-N 3.15Å; V136-T140 PolarHBondContact O-OG1 3.43Å
137	E	96	Very high	95.9	Very high	126 Å²	126	52.1 Å²	52.1	59%	0.589	32%	0.319	S	S	*	.	H	α-helix	trans	-57.5	-45.1	175.4	-73.9	169.3	-169.3	0	0	112.2	N133 L139 T140 D141	N133-E137 WeakPolarHBondContact O-CG 3.29Å; N133-E137 PolarHBondContact O-N 3.47Å; E137-L139 VanDerWaalsContact C-N 3.33Å; E137-L139 PolarHBondContact O-N 3.36Å; E137-T140 PolarHBondContact O-N 3.43Å; E137-T140 PolarHBondContact O-OG1 2.96Å; E137-D141 PolarHBondContact O-N 3.34Å; E137-D141 VanDerWaalsContact O-N 3.12Å
138	L	96.5	Very high	95.9	Very high	24 Å²	24	50.3 Å²	50.3	13%	0.126	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-36.8	175.3	-71.7	165.2	0	0	0	112.3	P83 Y86 K134 W135 V136 T140 D141 V144 V152	P83-L138 HydrophobicContact CG-CD2 4.28Å; Y86-L138 HydrophobicContact CD1-CD1 4.07Å; Y86-L138 HydrophobicContact CD2-CD1 3.48Å; Y86-L138 VanDerWaalsContact CD2-CD1 3.48Å; Y86-L138 HydrophobicContact CE1-CD1 4.05Å; Y86-L138 HydrophobicContact CE2-CD1 3.48Å; Y86-L138 VanDerWaalsContact CE2-CD1 3.48Å; Y86-L138 HydrophobicContact CG-CD1 3.78Å; Y86-L138 HydrophobicContact CG-CD2 4.4Å; K134-L138 WeakPolarHBondContact O-CG 3.22Å; K134-L138 PolarHBondContact O-N 3.08Å; W135-L138 PolarHBondContact O-N 3.19Å; V136-L138 PolarHBondContact O-N 2.81Å; L138-T140 VanDerWaalsContact C-N 3.32Å; L138-D141 PolarHBondContact O-N 3.03Å; L138-V144 HydrophobicContact CD2-CG2 4.39Å; L138-V144 VanDerWaalsContact O-CB 3.27Å; L138-V144 WeakPolarHBondContact O-CB 3.35Å; L138-V144 VanDerWaalsContact O-CG2 3.29Å; L138-V144 WeakPolarHBondContact O-CG2 3.3Å; L138-V152 HydrophobicContact CB-CG1 3.87Å; L138-V152 HydrophobicContact CD1-CG1 4.31Å
139	L	96.2	Very high	95.9	Very high	11 Å²	11	52.8 Å²	52.8	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-78.5	-15.6	-179.5	-68.4	171.9	0	0	0	113.4	L120 W135 V136 E137 R149 V152 L153	L120-L139 HydrophobicContact CD2-CD1 3.56Å; W135-L139 WeakPolarHBondContact O-CB 3.27Å; W135-L139 WeakPolarHBondContact O-CG 3.17Å; W135-L139 PolarHBondContact O-N 2.74Å; V136-L139 CarbonylContact O-C 3.51Å; V136-L139 PolarHBondContact O-N 3.43Å; V136-L139 VanDerWaalsContact O-N 3.13Å; E137-L139 VanDerWaalsContact C-N 3.33Å; E137-L139 PolarHBondContact O-N 3.36Å; L139-R149 HydrophobicContact CD2-CG 4.03Å; L139-R149 PolarHBondContact O-NH1 2.95Å; L139-R149 PolarHBondContact O-NH2 3.08Å; L139-V152 HydrophobicContact CD1-CG1 4.47Å; L139-V152 HydrophobicContact CD2-CB 4.11Å; L139-V152 HydrophobicContact CD2-CG1 3.67Å; L139-V152 HydrophobicContact CG-CG1 3.77Å; L139-L153 HydrophobicContact CD1-CD2 3.82Å; L139-L153 HydrophobicContact CD2-CD2 3.8Å; L139-L153 HydrophobicContact CD2-CG 3.72Å; L139-L153 HydrophobicContact CG-CD2 4.48Å
140	T	95	Very high	95.9	Very high	102 Å²	102	52.7 Å²	52.7	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-93.6	-16.6	172	56.6	0	0	0	0	113	V136 E137 L138 P142	V136-T140 HydrophobicContact CG1-CG2 4.31Å; V136-T140 WeakPolarHBondContact O-CG2 3.23Å; V136-T140 PolarHBondContact O-N 3.15Å; V136-T140 PolarHBondContact O-OG1 3.43Å; E137-T140 PolarHBondContact O-N 3.43Å; E137-T140 PolarHBondContact O-OG1 2.96Å; L138-T140 VanDerWaalsContact C-N 3.32Å; T140-P142 VanDerWaalsContact O-CD 3.31Å; T140-P142 WeakPolarHBondContact O-CD 3.45Å
141	D	95.2	Very high	95.9	Very high	73 Å²	73	49.4 Å²	49.4	39%	0.39	29%	0.287	S	S	.	.			trans	-67.3	117.9	173.3	-175.3	-8.2	0	0	0	111.3	E137 L138 G143 V144	E137-D141 PolarHBondContact O-N 3.34Å; E137-D141 VanDerWaalsContact O-N 3.12Å; L138-D141 PolarHBondContact O-N 3.03Å; D141-G143 PolarHBondContact O-N 2.98Å; D141-G143 PolarHBondContact OD1-N 3.05Å; D141-V144 HydrophobicContact CB-CG2 3.97Å; D141-V144 PolarHBondContact O-N 2.94Å; D141-V144 VanDerWaalsContact O-N 3.08Å
142	P	93.9	Very high	95.9	Very high	116 Å²	116	47.9 Å²	47.9	75%	0.753	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.1	176.2	-22.1	34.3	0	0	0	114.3	T140 V144	T140-P142 VanDerWaalsContact O-CD 3.31Å; T140-P142 WeakPolarHBondContact O-CD 3.45Å; P142-V144 VanDerWaalsContact C-N 3.26Å; P142-V144 PolarHBondContact O-N 3.36Å
143	G	93.1	Very high	95.9	Very high	52 Å²	52	48.1 Å²	48.1	54%	0.536	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.2	175.3	0	0	0	0	0	113.4	D141 N145	D141-G143 PolarHBondContact O-N 2.98Å; D141-G143 PolarHBondContact OD1-N 3.05Å; G143-N145 PolarHBondContact O-N 3.44Å
144	V	94.1	Very high	96	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.018	27%	0.265	C	S	.	.			trans	-89.7	91	178.1	-174.2	0	0	0	0	109.7	P83 L138 D141 P142 R149 V152	P83-V144 HydrophobicContact CG-CG2 3.57Å; L138-V144 HydrophobicContact CD2-CG2 4.39Å; L138-V144 VanDerWaalsContact O-CB 3.27Å; L138-V144 WeakPolarHBondContact O-CB 3.35Å; L138-V144 VanDerWaalsContact O-CG2 3.29Å; L138-V144 WeakPolarHBondContact O-CG2 3.3Å; D141-V144 HydrophobicContact CB-CG2 3.97Å; D141-V144 PolarHBondContact O-N 2.94Å; D141-V144 VanDerWaalsContact O-N 3.08Å; P142-V144 VanDerWaalsContact C-N 3.26Å; P142-V144 PolarHBondContact O-N 3.36Å; V144-R149 HydrophobicContact CG1-CB 4.14Å; V144-V152 HydrophobicContact CG1-CG2 4.08Å
145	N	94.2	Very high	96	Very high	107 Å²	107	39.8 Å²	39.8	57%	0.572	24%	0.242	S	C	*	.			trans	-128.3	175.6	-176.5	62.6	49.6	0	0	0	112.6	G143 M147 A148 R149	G143-N145 PolarHBondContact O-N 3.44Å; N145-M147 PolarHBondContact O-N 3.04Å; N145-A148 WeakPolarHBondContact O-CB 3.37Å; N145-A148 PolarHBondContact O-N 3.19Å; N145-R149 PolarHBondContact O-N 3.4Å
146	G	94	Very high	96.1	Very high	59 Å²	59	39.8 Å²	39.8	61%	0.608	24%	0.242	S	C	*	.	H	α-helix	trans	52.8	-134.8	179.2	0	0	0	0	0	112.9	A148 R149 D150	G146-A148 VanDerWaalsContact C-N 3.32Å; G146-A148 PolarHBondContact O-N 2.85Å; G146-R149 WeakPolarHBondContact O-CB 3.35Å; G146-R149 PolarHBondContact O-N 2.92Å; G146-D150 PolarHBondContact O-N 3.24Å
147	M	94.5	Very high	96.1	Very high	33 Å²	33	38 Å²	38	16%	0.163	23%	0.231	C	C	.	.	H	α-helix	trans	-69.1	-27.1	-178.1	-175.9	66.1	164.3	0	0	113.3	Y98 M103 N145 R149 D150 V151	Y98-M147 HydrophobicContact CD1-CE 3.28Å; Y98-M147 HydrophobicContact CE1-CE 3.23Å; Y98-M147 HydrophobicContact CE1-SD 4.06Å; Y98-M147 HydrophobicContact CG-CE 4.26Å; M103-M147 HydrophobicContact CE-CE 3.71Å; M103-M147 WeakPolarHBondContact O-CE 3.37Å; N145-M147 PolarHBondContact O-N 3.04Å; M147-R149 VanDerWaalsContact C-N 3.28Å; M147-R149 PolarHBondContact O-N 3.49Å; M147-D150 WeakPolarHBondContact O-CB 3.26Å; M147-D150 PolarHBondContact O-N 3.23Å; M147-D150 HydrophobicContact SD-CB 4.02Å; M147-V151 WeakPolarHBondContact O-CG2 3.42Å; M147-V151 PolarHBondContact O-N 3.45Å
148	A	95.5	Very high	96.2	Very high	9 Å²	9	32 Å²	32	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-41.4	173	0	0	0	0	0	111.3	Q81 L82 N145 G146 V151 V152	Q81-A148 HydrophobicContact CB-CB 4.36Å; Q81-A148 WeakPolarHBondContact O-CB 3.47Å; L82-A148 HydrophobicContact CD2-CB 4.4Å; N145-A148 WeakPolarHBondContact O-CB 3.37Å; N145-A148 PolarHBondContact O-N 3.19Å; G146-A148 VanDerWaalsContact C-N 3.32Å; G146-A148 PolarHBondContact O-N 2.85Å; A148-V151 PolarHBondContact O-N 3.34Å; A148-V152 VanDerWaalsContact O-CG2 3.3Å; A148-V152 WeakPolarHBondContact O-CG2 3.41Å; A148-V152 PolarHBondContact O-N 2.87Å; A148-V152 VanDerWaalsContact O-N 3.08Å
149	R	96.5	Very high	96.3	Very high	67 Å²	67	30.9 Å²	30.9	25%	0.253	20%	0.197	S	C	.	.	H	α-helix	trans	-66.1	-40.8	175	-168.5	-178.3	-177.6	80.3	-0.8	112.3	L139 V144 N145 G146 M147 V151 V152 L153	L139-R149 HydrophobicContact CD2-CG 4.03Å; L139-R149 PolarHBondContact O-NH1 2.95Å; L139-R149 PolarHBondContact O-NH2 3.08Å; V144-R149 HydrophobicContact CG1-CB 4.14Å; N145-R149 PolarHBondContact O-N 3.4Å; G146-R149 WeakPolarHBondContact O-CB 3.35Å; G146-R149 PolarHBondContact O-N 2.92Å; M147-R149 VanDerWaalsContact C-N 3.28Å; M147-R149 PolarHBondContact O-N 3.49Å; R149-V151 VanDerWaalsContact C-N 3.33Å; R149-V151 PolarHBondContact O-N 3.5Å; R149-V152 PolarHBondContact O-N 3.35Å; R149-L153 HydrophobicContact CG-CD1 4.37Å; R149-L153 WeakPolarHBondContact O-CG 3.27Å; R149-L153 PolarHBondContact O-N 3.4Å
150	D	97.4	Very high	96.4	Very high	11 Å²	11	30.4 Å²	30.4	6%	0.059	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-44.3	177	-157.5	-80.5	0	0	0	111.2	Y98 P105 M106 W107 G146 M147 L153 S154	Y98-D150 PolarHBondContact OH-O 2.98Å; Y98-D150 VanDerWaalsContact OH-O 3.04Å; Y98-D150 PolarHBondContact OH-OD1 3.38Å; P105-D150 WeakPolarHBondContact CB-OD2 3.45Å; M106-D150 PolarHBondContact N-OD1 2.92Å; M106-D150 PolarHBondContact N-OD2 3.07Å; W107-D150 WeakPolarHBondContact CA-OD2 3.32Å; W107-D150 VanDerWaalsContact CB-OD2 3.27Å; W107-D150 WeakPolarHBondContact CB-OD2 3.37Å; W107-D150 PolarHBondContact N-OD2 2.94Å; G146-D150 PolarHBondContact O-N 3.24Å; M147-D150 WeakPolarHBondContact O-CB 3.26Å; M147-D150 PolarHBondContact O-N 3.23Å; M147-D150 HydrophobicContact SD-CB 4.02Å; D150-L153 PolarHBondContact O-N 2.89Å; D150-S154 WeakPolarHBondContact O-CB 3.18Å; D150-S154 PolarHBondContact O-N 3.48Å; D150-S154 PolarHBondContact O-OG 3.41Å
151	V	97.1	Very high	96.6	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-45.3	175.9	174	0	0	0	0	111.4	I78 L82 P88 L94 Y98 M147 A148 R149 L153 S154 D155	I78-V151 HydrophobicContact CG1-CG2 4Å; I78-V151 HydrophobicContact CG2-CG1 3.71Å; I78-V151 HydrophobicContact CG2-CG2 4.12Å; L82-V151 HydrophobicContact CD1-CG1 4.34Å; L82-V151 HydrophobicContact CD2-CB 4.16Å; L82-V151 HydrophobicContact CD2-CG1 3.99Å; P88-V151 HydrophobicContact CG-CG1 4.09Å; L94-V151 HydrophobicContact CD1-CG1 4.26Å; Y98-V151 HydrophobicContact CE2-CG2 3.98Å; Y98-V151 VanDerWaalsContact OH-CA 3.29Å; Y98-V151 WeakPolarHBondContact OH-CA 3.33Å; Y98-V151 PolarHBondContact OH-N 2.88Å; M147-V151 WeakPolarHBondContact O-CG2 3.42Å; M147-V151 PolarHBondContact O-N 3.45Å; A148-V151 PolarHBondContact O-N 3.34Å; R149-V151 VanDerWaalsContact C-N 3.33Å; R149-V151 PolarHBondContact O-N 3.5Å; V151-L153 PolarHBondContact O-N 3.5Å; V151-S154 WeakPolarHBondContact O-CB 3.37Å; V151-S154 PolarHBondContact O-N 2.71Å; V151-D155 PolarHBondContact O-N 3.23Å
152	V	97.6	Very high	96.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.4	-42.8	177.7	174.4	0	0	0	0	111.2	L82 Y86 L138 L139 V144 A148 R149 S154 D155 A156	L82-V152 HydrophobicContact CD2-CG2 4.22Å; Y86-V152 HydrophobicContact CD1-CG2 4.3Å; Y86-V152 HydrophobicContact CE1-CG2 3.6Å; L138-V152 HydrophobicContact CB-CG1 3.87Å; L138-V152 HydrophobicContact CD1-CG1 4.31Å; L139-V152 HydrophobicContact CD1-CG1 4.47Å; L139-V152 HydrophobicContact CD2-CB 4.11Å; L139-V152 HydrophobicContact CD2-CG1 3.67Å; L139-V152 HydrophobicContact CG-CG1 3.77Å; V144-V152 HydrophobicContact CG1-CG2 4.08Å; A148-V152 VanDerWaalsContact O-CG2 3.3Å; A148-V152 WeakPolarHBondContact O-CG2 3.41Å; A148-V152 PolarHBondContact O-N 2.87Å; A148-V152 VanDerWaalsContact O-N 3.08Å; R149-V152 PolarHBondContact O-N 3.35Å; V152-S154 VanDerWaalsContact C-N 3.27Å; V152-S154 PolarHBondContact O-N 3.03Å; V152-D155 PolarHBondContact O-N 3.17Å; V152-A156 WeakPolarHBondContact O-CB 3.41Å; V152-A156 PolarHBondContact O-N 3.28Å
153	L	98.2	Very high	96.9	Very high	4 Å²	4	17 Å²	17	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-59.3	-40.5	174.5	-76.5	167.2	0	0	0	111.5	W107 V113 F116 Q117 L139 R149 D150 V151 A156 M157	W107-L153 HydrophobicContact CB-CD1 3.72Å; W107-L153 HydrophobicContact CD2-CB 3.87Å; W107-L153 HydrophobicContact CD2-CD1 4.06Å; W107-L153 HydrophobicContact CD2-CG 4.46Å; W107-L153 HydrophobicContact CG-CB 3.79Å; W107-L153 HydrophobicContact CG-CD1 3.69Å; W107-L153 HydrophobicContact CG-CG 4.36Å; W107-L153 HydrophobicContact CZ2-CB 4.38Å; V113-L153 HydrophobicContact CG1-CD1 4.08Å; V113-L153 HydrophobicContact CG2-CD1 4.09Å; F116-L153 HydrophobicContact CD1-CD2 4.02Å; F116-L153 HydrophobicContact CE1-CD2 4.34Å; Q117-L153 HydrophobicContact CG-CD2 4Å; L139-L153 HydrophobicContact CD1-CD2 3.82Å; L139-L153 HydrophobicContact CD2-CD2 3.8Å; L139-L153 HydrophobicContact CD2-CG 3.72Å; L139-L153 HydrophobicContact CG-CD2 4.48Å; R149-L153 HydrophobicContact CG-CD1 4.37Å; R149-L153 WeakPolarHBondContact O-CG 3.27Å; R149-L153 PolarHBondContact O-N 3.4Å; D150-L153 PolarHBondContact O-N 2.89Å; V151-L153 PolarHBondContact O-N 3.5Å; L153-A156 PolarHBondContact O-N 2.98Å; L153-M157 WeakPolarHBondContact O-CB 3.42Å; L153-M157 PolarHBondContact O-N 3.35Å
154	S	98.2	Very high	97.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-69.8	-39.7	179.3	-56	0	0	0	0	112.7	Y98 M106 W107 D150 V151 V152 M157 M158	Y98-S154 PolarHBondContact OH-OG 2.8Å; M106-S154 WeakPolarHBondContact CE-OG 3.39Å; W107-S154 PolarHBondContact NE1-OG 3.3Å; D150-S154 WeakPolarHBondContact O-CB 3.18Å; D150-S154 PolarHBondContact O-N 3.48Å; D150-S154 PolarHBondContact O-OG 3.41Å; V151-S154 WeakPolarHBondContact O-CB 3.37Å; V151-S154 PolarHBondContact O-N 2.71Å; V152-S154 VanDerWaalsContact C-N 3.27Å; V152-S154 PolarHBondContact O-N 3.03Å; S154-M157 PolarHBondContact O-N 3.03Å; S154-M158 WeakPolarHBondContact O-CG 3.26Å; S154-M158 PolarHBondContact O-N 2.73Å
155	D	98.2	Very high	97.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.4	-46.7	173.5	-167.1	47.9	0	0	0	111.2	Y86 P88 V89 Y90 L94 W135 V151 V152 M157 M158 G159	Y86-D155 WeakPolarHBondContact OH-CB 3.42Å; Y86-D155 PolarHBondContact OH-OD2 3.32Å; P88-D155 WeakPolarHBondContact CA-OD2 3.2Å; P88-D155 HydrophobicContact CB-CB 4.12Å; V89-D155 PolarHBondContact N-OD1 2.9Å; V89-D155 PolarHBondContact N-OD2 2.9Å; Y90-D155 WeakPolarHBondContact CD2-O 3.34Å; Y90-D155 VanDerWaalsContact CD2-OD1 3.32Å; Y90-D155 WeakPolarHBondContact CD2-OD1 3.5Å; Y90-D155 PolarHBondContact N-OD1 3.34Å; L94-D155 HydrophobicContact CD1-CB 3.79Å; W135-D155 PolarHBondContact NE1-OD2 3.39Å; V151-D155 PolarHBondContact O-N 3.23Å; V152-D155 PolarHBondContact O-N 3.17Å; D155-M157 VanDerWaalsContact C-N 3.32Å; D155-M157 PolarHBondContact O-N 3.31Å; D155-M158 PolarHBondContact O-N 3.43Å; D155-G159 PolarHBondContact O-N 3.48Å
156	A	98.5	Very high	97.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.1	-41.7	174.5	0	0	0	0	0	112.1	F116 L120 W135 V152 L153 G159 Y160	F116-A156 HydrophobicContact CE1-CB 4.06Å; F116-A156 HydrophobicContact CZ-CB 4.11Å; L120-A156 HydrophobicContact CD1-CB 4.17Å; L120-A156 HydrophobicContact CD2-CB 3.94Å; W135-A156 HydrophobicContact CB-CB 3.92Å; W135-A156 HydrophobicContact CD2-CB 3.77Å; W135-A156 HydrophobicContact CE3-CB 4.01Å; W135-A156 HydrophobicContact CG-CB 3.73Å; V152-A156 WeakPolarHBondContact O-CB 3.41Å; V152-A156 PolarHBondContact O-N 3.28Å; L153-A156 PolarHBondContact O-N 2.98Å; A156-G159 PolarHBondContact O-N 3.09Å; A156-Y160 WeakPolarHBondContact O-CB 3.49Å; A156-Y160 PolarHBondContact O-N 3.12Å
157	M	98.5	Very high	97.6	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.2	-41.9	178.2	-172.5	61.5	164	0	0	112	W107 F116 L153 S154 D155 G159 Y160 L161 W194 F206 V207 L210	W107-M157 HydrophobicContact CH2-CB 4.45Å; W107-M157 HydrophobicContact CH2-CG 4.33Å; W107-M157 HydrophobicContact CH2-SD 4.19Å; W107-M157 HydrophobicContact CZ2-CB 3.8Å; W107-M157 HydrophobicContact CZ2-CG 3.96Å; W107-M157 HydrophobicContact CZ2-SD 4.41Å; F116-M157 HydrophobicContact CD2-SD 3.81Å; F116-M157 HydrophobicContact CE1-CB 4.17Å; F116-M157 HydrophobicContact CE1-SD 4.44Å; F116-M157 HydrophobicContact CE2-SD 3.45Å; F116-M157 WeakPolarHBondContact CE2-SD 3.46Å; F116-M157 HydrophobicContact CG-SD 4.47Å; F116-M157 HydrophobicContact CZ-CB 3.93Å; F116-M157 HydrophobicContact CZ-SD 3.82Å; L153-M157 WeakPolarHBondContact O-CB 3.42Å; L153-M157 PolarHBondContact O-N 3.35Å; S154-M157 PolarHBondContact O-N 3.03Å; D155-M157 VanDerWaalsContact C-N 3.32Å; D155-M157 PolarHBondContact O-N 3.31Å; M157-G159 VanDerWaalsContact C-N 3.33Å; M157-G159 PolarHBondContact O-N 3.28Å; M157-Y160 PolarHBondContact O-N 2.76Å; M157-L161 HydrophobicContact CE-CD1 4.38Å; M157-L161 HydrophobicContact CE-CD2 4.13Å; M157-L161 HydrophobicContact CE-CG 4.28Å; M157-L161 HydrophobicContact CG-CD1 4.15Å; M157-L161 HydrophobicContact CG-CG 4.28Å; M157-L161 WeakPolarHBondContact O-CB 3.29Å; M157-L161 VanDerWaalsContact O-CG 3.26Å; M157-L161 WeakPolarHBondContact O-CG 3.38Å; M157-L161 PolarHBondContact O-N 2.78Å; M157-L161 HydrophobicContact SD-CG 4.32Å; M157-W194 HydrophobicContact CB-CH2 4.11Å; M157-W194 HydrophobicContact CB-CZ2 4.18Å; M157-W194 HydrophobicContact CB-CZ3 4.47Å; M157-W194 HydrophobicContact CE-CG 4.31Å; M157-W194 HydrophobicContact CG-CD2 3.98Å; M157-W194 HydrophobicContact CG-CE3 4.16Å; M157-W194 HydrophobicContact CG-CH2 4.09Å; M157-W194 HydrophobicContact CG-CZ2 3.91Å; M157-W194 HydrophobicContact CG-CZ3 4.21Å; M157-F206 HydrophobicContact CE-CD1 3.95Å; M157-F206 HydrophobicContact CE-CE1 3.31Å; M157-F206 HydrophobicContact CE-CZ 4.24Å; M157-V207 HydrophobicContact CE-CG2 4.46Å; M157-L210 HydrophobicContact CE-CD1 3.41Å; M157-L210 VanDerWaalsContact CE-CD1 3.41Å; M157-L210 HydrophobicContact SD-CD1 4.16Å
158	M	98.5	Very high	97.5	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.4	-43.9	175	-75	-70.3	-73.9	0	0	112.1	Y90 Q93 L94 S154 D155 H162 T185 P186 I191 W194	Y90-M158 HydrophobicContact CD1-CB 4.19Å; Y90-M158 HydrophobicContact CD1-CE 4.27Å; Y90-M158 HydrophobicContact CD2-CB 3.41Å; Y90-M158 VanDerWaalsContact CD2-CB 3.41Å; Y90-M158 HydrophobicContact CD2-CG 4.49Å; Y90-M158 HydrophobicContact CE2-CB 3.86Å; Y90-M158 HydrophobicContact CG-CB 3.59Å; Y90-M158 HydrophobicContact CG-CE 4.42Å; Y90-M158 HydrophobicContact CG-CG 4.32Å; Q93-M158 HydrophobicContact CB-CE 3.71Å; Q93-M158 HydrophobicContact CG-CE 3.91Å; L94-M158 HydrophobicContact CD2-CG 4.25Å; S154-M158 WeakPolarHBondContact O-CG 3.26Å; S154-M158 PolarHBondContact O-N 2.73Å; D155-M158 PolarHBondContact O-N 3.43Å; M158-H162 WeakPolarHBondContact O-CB 3.38Å; M158-H162 PolarHBondContact O-N 3.13Å; M158-T185 HydrophobicContact CE-CG2 4.09Å; M158-P186 HydrophobicContact CE-CG 3.94Å; M158-P186 HydrophobicContact SD-CG 3.97Å; M158-I191 HydrophobicContact CE-CD1 3.75Å; M158-I191 HydrophobicContact CE-CG1 4.43Å; M158-I191 HydrophobicContact SD-CD1 4.07Å; M158-I191 HydrophobicContact SD-CG1 4.13Å; M158-W194 HydrophobicContact CG-CZ3 4.09Å; M158-W194 HydrophobicContact SD-CZ3 3.98Å
159	G	98.4	Very high	97.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.1	-39	175.4	0	0	0	0	0	113.6	Y90 D155 A156 M157 H162 F163	Y90-G159 VanDerWaalsContact CE2-CA 3.49Å; Y90-G159 VanDerWaalsContact CE2-N 3.27Å; Y90-G159 WeakPolarHBondContact OH-CA 3.47Å; D155-G159 PolarHBondContact O-N 3.48Å; A156-G159 PolarHBondContact O-N 3.09Å; M157-G159 VanDerWaalsContact C-N 3.33Å; M157-G159 PolarHBondContact O-N 3.28Å; G159-H162 PolarHBondContact O-N 2.93Å; G159-F163 PolarHBondContact O-N 3.15Å
160	Y	98.5	Very high	97.5	Very high	1 Å²	1	21.8 Å²	21.8	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-65.9	-46.5	176.4	-166.8	-105	0	0	0	111.6	F116 Q119 V123 F132 A156 M157 H162 F163 I164 L210 R367	F116-Y160 AromaticContact CE2-CD1 3.89Å; F116-Y160 HydrophobicContact CE2-CD1 3.89Å; F116-Y160 AromaticContact CE2-CG 3.89Å; F116-Y160 HydrophobicContact CE2-CG 3.89Å; Q119-Y160 PolarHBondContact OE1-OH 3.15Å; Q119-Y160 VanDerWaalsContact OE1-OH 3.07Å; V123-Y160 HydrophobicContact CB-CE2 4.31Å; V123-Y160 HydrophobicContact CG2-CD2 4.42Å; V123-Y160 HydrophobicContact CG2-CE2 3.64Å; F132-Y160 HydrophobicContact CE1-CD2 4.01Å; F132-Y160 HydrophobicContact CZ-CD2 4.45Å; A156-Y160 WeakPolarHBondContact O-CB 3.49Å; A156-Y160 PolarHBondContact O-N 3.12Å; M157-Y160 PolarHBondContact O-N 2.76Å; Y160-H162 VanDerWaalsContact C-N 3.31Å; Y160-H162 PolarHBondContact O-N 2.92Å; Y160-F163 WeakPolarHBondContact O-CA 3.49Å; Y160-F163 WeakPolarHBondContact O-CB 3.35Å; Y160-F163 PolarHBondContact O-N 2.74Å; Y160-F163 VanDerWaalsContact O-N 3.12Å; Y160-I164 HydrophobicContact CD1-CG1 3.99Å; Y160-I164 HydrophobicContact CE1-CD1 4.21Å; Y160-I164 HydrophobicContact CE1-CG1 3.74Å; Y160-I164 WeakPolarHBondContact O-CG1 3.49Å; Y160-I164 PolarHBondContact O-N 3.43Å; Y160-L210 HydrophobicContact CD1-CD1 4.12Å; Y160-L210 HydrophobicContact CE1-CB 3.81Å; Y160-L210 HydrophobicContact CE1-CD1 4.12Å; Y160-R367 PolarHBondContact OH-NH2 3.44Å
161	L	98.4	Very high	97.5	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-61.6	-39	174.8	-70	178.7	0	0	0	111.8	M157 F163 I164 A165 P186 V190 W194 F206 L210	M157-L161 HydrophobicContact CE-CD1 4.38Å; M157-L161 HydrophobicContact CE-CD2 4.13Å; M157-L161 HydrophobicContact CE-CG 4.28Å; M157-L161 HydrophobicContact CG-CD1 4.15Å; M157-L161 HydrophobicContact CG-CG 4.28Å; M157-L161 WeakPolarHBondContact O-CB 3.29Å; M157-L161 VanDerWaalsContact O-CG 3.26Å; M157-L161 WeakPolarHBondContact O-CG 3.38Å; M157-L161 PolarHBondContact O-N 2.78Å; M157-L161 HydrophobicContact SD-CG 4.32Å; L161-F163 VanDerWaalsContact C-N 3.32Å; L161-F163 PolarHBondContact O-N 3.47Å; L161-I164 PolarHBondContact O-N 3.46Å; L161-A165 WeakPolarHBondContact O-CB 3.38Å; L161-A165 PolarHBondContact O-N 3.3Å; L161-P186 HydrophobicContact CB-CB 4.03Å; L161-P186 HydrophobicContact CB-CG 4.12Å; L161-V190 HydrophobicContact CB-CG1 3.93Å; L161-V190 HydrophobicContact CD1-CG1 4.3Å; L161-V190 HydrophobicContact CD2-CG1 3.81Å; L161-V190 HydrophobicContact CG-CG1 4.22Å; L161-W194 HydrophobicContact CD1-CB 4.05Å; L161-W194 HydrophobicContact CD1-CD2 4.25Å; L161-W194 HydrophobicContact CD1-CE3 3.88Å; L161-W194 HydrophobicContact CD1-CG 4.35Å; L161-F206 HydrophobicContact CD2-CE1 4.43Å; L161-F206 HydrophobicContact CD2-CZ 3.95Å; L161-L210 HydrophobicContact CD2-CD1 3.89Å; L161-L210 HydrophobicContact CD2-CD2 3.93Å
162	H	98.3	Very high	97.3	Very high	10 Å²	10	24.7 Å²	24.7	5%	0.046	14%	0.144	C	C	.	.	H	α-helix	trans	-61	-43.1	173.7	169.2	-117.5	0	0	0	111.4	M158 G159 Y160 N166 W174 Y181 A184 P186	M158-H162 WeakPolarHBondContact O-CB 3.38Å; M158-H162 PolarHBondContact O-N 3.13Å; G159-H162 PolarHBondContact O-N 2.93Å; Y160-H162 VanDerWaalsContact C-N 3.31Å; Y160-H162 PolarHBondContact O-N 2.92Å; H162-N166 PolarHBondContact CD2-ND2 3.22Å; H162-N166 PolarHBondContact O-N 3.12Å; H162-N166 PolarHBondContact O-ND2 2.88Å; H162-W174 AromaticContact CE1-CH2 3.86Å; H162-W174 AromaticContact NE2-CH2 3.95Å; H162-Y181 AromaticContact CE1-CD2 3.98Å; H162-Y181 AromaticContact CE1-CE2 3.74Å; H162-Y181 AromaticContact ND1-CE2 3.82Å; H162-A184 WeakPolarHBondContact CB-O 3.35Å; H162-A184 PolarHBondContact CD2-O 3.37Å; H162-A184 VanDerWaalsContact CD2-O 3.31Å; H162-A184 PolarHBondContact CE1-N 3.44Å; H162-A184 PolarHBondContact ND1-O 3.18Å; H162-P186 HydrophobicContact CB-CB 4.22Å
163	F	98.1	Very high	97.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-56.7	175.2	167.1	-115.4	0	0	0	111.7	V123 F128 F132 G159 Y160 L161 A165 N166 I167 W174 L175 Q364	V123-F163 HydrophobicContact CG2-CE1 4.15Å; F128-F163 HydrophobicContact CE1-CZ 4.34Å; F128-F163 AromaticContact CE2-CD2 3.81Å; F128-F163 HydrophobicContact CE2-CD2 3.81Å; F128-F163 AromaticContact CE2-CE2 3.48Å; F128-F163 HydrophobicContact CE2-CE2 3.48Å; F128-F163 VanDerWaalsContact CE2-CE2 3.48Å; F128-F163 HydrophobicContact CE2-CZ 4.01Å; F128-F163 HydrophobicContact CZ-CD2 4.06Å; F128-F163 HydrophobicContact CZ-CE1 4.05Å; F128-F163 AromaticContact CZ-CE2 3.45Å; F128-F163 HydrophobicContact CZ-CE2 3.45Å; F128-F163 VanDerWaalsContact CZ-CE2 3.45Å; F128-F163 AromaticContact CZ-CZ 3.46Å; F128-F163 HydrophobicContact CZ-CZ 3.46Å; F128-F163 VanDerWaalsContact CZ-CZ 3.46Å; F132-F163 HydrophobicContact CZ-CB 4Å; F132-F163 HydrophobicContact CZ-CG 4.36Å; G159-F163 PolarHBondContact O-N 3.15Å; Y160-F163 WeakPolarHBondContact O-CA 3.49Å; Y160-F163 WeakPolarHBondContact O-CB 3.35Å; Y160-F163 PolarHBondContact O-N 2.74Å; Y160-F163 VanDerWaalsContact O-N 3.12Å; L161-F163 VanDerWaalsContact C-N 3.32Å; L161-F163 PolarHBondContact O-N 3.47Å; F163-A165 PolarHBondContact O-N 2.98Å; F163-N166 PolarHBondContact O-N 3.48Å; F163-I167 HydrophobicContact CD2-CD1 4.07Å; F163-I167 HydrophobicContact CD2-CG1 4.32Å; F163-I167 HydrophobicContact CE1-CG1 4.46Å; F163-I167 HydrophobicContact CE2-CD1 3.33Å; F163-I167 HydrophobicContact CE2-CG1 3.9Å; F163-I167 HydrophobicContact CZ-CD1 3.63Å; F163-I167 HydrophobicContact CZ-CG1 3.96Å; F163-I167 PolarHBondContact O-N 3.31Å; F163-W174 HydrophobicContact CD2-CE3 4.03Å; F163-W174 HydrophobicContact CD2-CZ3 4.3Å; F163-L175 HydrophobicContact CE2-CD2 3.98Å; F163-L175 HydrophobicContact CZ-CD2 4.06Å; F163-Q364 HydrophobicContact CZ-CB 4.45Å
164	I	97.5	Very high	97.2	Very high	34 Å²	34	34.4 Å²	34.4	17%	0.174	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-46.4	-176.2	-62.7	-50.6	0	0	0	111.9	Y160 L161 N166 I167	Y160-I164 HydrophobicContact CD1-CG1 3.99Å; Y160-I164 HydrophobicContact CE1-CD1 4.21Å; Y160-I164 HydrophobicContact CE1-CG1 3.74Å; Y160-I164 WeakPolarHBondContact O-CG1 3.49Å; Y160-I164 PolarHBondContact O-N 3.43Å; L161-I164 PolarHBondContact O-N 3.46Å; I164-N166 PolarHBondContact O-N 2.97Å; I164-N166 VanDerWaalsContact O-N 3.16Å; I164-I167 PolarHBondContact O-N 3.47Å
165	A	97.3	Very high	97.1	Very high	36 Å²	36	34.5 Å²	34.5	30%	0.298	18%	0.181	S	C	.	.	H	α-helix	trans	-62.2	-25.8	-177.5	0	0	0	0	0	113.6	L161 F163 P187 V190	L161-A165 WeakPolarHBondContact O-CB 3.38Å; L161-A165 PolarHBondContact O-N 3.3Å; F163-A165 PolarHBondContact O-N 2.98Å; A165-P187 HydrophobicContact CB-CG 4.18Å; A165-V190 HydrophobicContact CB-CG2 3.94Å
166	N	97.6	Very high	97	Very high	42 Å²	42	39.5 Å²	39.5	23%	0.225	20%	0.201	C	C	.	.	H	α-helix	trans	-102.8	-5.2	-176.3	-75.6	-82.6	0	0	0	113.6	H162 F163 I164 P168 V169 K170 W174	H162-N166 PolarHBondContact CD2-ND2 3.22Å; H162-N166 PolarHBondContact O-N 3.12Å; H162-N166 PolarHBondContact O-ND2 2.88Å; F163-N166 PolarHBondContact O-N 3.48Å; I164-N166 PolarHBondContact O-N 2.97Å; I164-N166 VanDerWaalsContact O-N 3.16Å; N166-P168 VanDerWaalsContact C-CD 3.48Å; N166-V169 PolarHBondContact O-N 3.03Å; N166-V169 VanDerWaalsContact O-N 3.17Å; N166-K170 HydrophobicContact CB-CG 4.4Å; N166-K170 WeakPolarHBondContact O-CB 3.37Å; N166-K170 PolarHBondContact O-N 3.16Å; N166-W174 HydrophobicContact CB-CE3 4.46Å; N166-W174 HydrophobicContact CB-CH2 3.27Å; N166-W174 HydrophobicContact CB-CZ2 4.25Å; N166-W174 HydrophobicContact CB-CZ3 3.39Å
167	I	96.1	Very high	96.8	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-52.1	-46	176.5	-81.7	-59.3	0	0	0	112.9	F163 I164 V169 K170 G171 L175 R367 L368	F163-I167 HydrophobicContact CD2-CD1 4.07Å; F163-I167 HydrophobicContact CD2-CG1 4.32Å; F163-I167 HydrophobicContact CE1-CG1 4.46Å; F163-I167 HydrophobicContact CE2-CD1 3.33Å; F163-I167 HydrophobicContact CE2-CG1 3.9Å; F163-I167 HydrophobicContact CZ-CD1 3.63Å; F163-I167 HydrophobicContact CZ-CG1 3.96Å; F163-I167 PolarHBondContact O-N 3.31Å; I164-I167 PolarHBondContact O-N 3.47Å; I167-V169 PolarHBondContact O-N 2.96Å; I167-V169 VanDerWaalsContact O-N 3.12Å; I167-K170 PolarHBondContact O-N 3.39Å; I167-G171 WeakPolarHBondContact O-CA 3.47Å; I167-G171 PolarHBondContact O-N 3.11Å; I167-L175 HydrophobicContact CD1-CD1 3.84Å; I167-L175 HydrophobicContact CD1-CD2 4.47Å; I167-L175 HydrophobicContact CD1-CG 4.13Å; I167-R367 HydrophobicContact CG2-CB 3.81Å; I167-L368 HydrophobicContact CG2-CD2 4.02Å
168	P	94.1	Very high	96.4	Very high	110 Å²	110	47.4 Å²	47.4	71%	0.714	26%	0.255	S	S	*	.	H	α-helix	trans	-58.5	-29.6	-178.2	-27.3	36.3	0	0	0	114.1	N166	N166-P168 VanDerWaalsContact C-CD 3.48Å
169	V	95.1	Very high	96.3	Very high	106 Å²	106	55.3 Å²	55.3	64%	0.642	29%	0.29	S	S	*	.	H	α-helix	trans	-102.9	-32.9	-175.4	-178	0	0	0	0	112.5	N166 I167	N166-V169 PolarHBondContact O-N 3.03Å; N166-V169 VanDerWaalsContact O-N 3.17Å; I167-V169 PolarHBondContact O-N 2.96Å; I167-V169 VanDerWaalsContact O-N 3.12Å
170	K	96.7	Very high	96.2	Very high	96 Å²	96	58.9 Å²	58.9	42%	0.417	31%	0.313	S	S	.	.	H	α-helix	trans	-118	-7.7	-170.3	-58.5	-60.1	-176.6	-168.1	0	114.2	N166 I167 T172 R173 W174	N166-K170 HydrophobicContact CB-CG 4.4Å; N166-K170 WeakPolarHBondContact O-CB 3.37Å; N166-K170 PolarHBondContact O-N 3.16Å; I167-K170 PolarHBondContact O-N 3.39Å; K170-T172 VanDerWaalsContact C-N 3.35Å; K170-T172 PolarHBondContact O-N 2.89Å; K170-R173 PolarHBondContact O-N 3.42Å; K170-W174 HydrophobicContact CB-CD2 3.69Å; K170-W174 HydrophobicContact CB-CE3 4.12Å; K170-W174 HydrophobicContact CB-CG 4.13Å; K170-W174 HydrophobicContact CB-CH2 4.31Å; K170-W174 HydrophobicContact CB-CZ2 3.87Å; K170-W174 HydrophobicContact CB-CZ3 4.4Å; K170-W174 HydrophobicContact CG-CZ2 4.01Å; K170-W174 PolarHBondContact O-N 3.04Å
171	G	95.9	Very high	96.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-32	-169.7	0	0	0	0	0	114.4	I167 R173 W174 L175	I167-G171 WeakPolarHBondContact O-CA 3.47Å; I167-G171 PolarHBondContact O-N 3.11Å; G171-R173 PolarHBondContact O-N 3.36Å; G171-W174 PolarHBondContact O-N 3.37Å; G171-L175 WeakPolarHBondContact O-CB 3.41Å; G171-L175 PolarHBondContact O-N 2.94Å
172	T	94	Very high	96.1	Very high	73 Å²	73	64 Å²	64	45%	0.448	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-28.4	173.2	53.5	0	0	0	0	112.7	K170 Y176	K170-T172 VanDerWaalsContact C-N 3.35Å; K170-T172 PolarHBondContact O-N 2.89Å; T172-Y176 WeakPolarHBondContact O-CB 3.44Å; T172-Y176 VanDerWaalsContact O-CD2 3.29Å; T172-Y176 WeakPolarHBondContact O-CD2 3.38Å
173	R	95.9	Very high	96	Very high	180 Å²	180	65.8 Å²	65.8	68%	0.679	36%	0.361	S	S	*	.	H	α-helix	trans	-87.5	-48.2	173.3	-179.9	175.7	170.4	177.6	-3.2	111.7	K170 G171 S177	K170-R173 PolarHBondContact O-N 3.42Å; G171-R173 PolarHBondContact O-N 3.36Å; R173-S177 WeakPolarHBondContact O-CB 3.31Å; R173-S177 PolarHBondContact O-N 3.47Å
174	W	97.3	Very high	96	Very high	28 Å²	28	68.2 Å²	68.2	11%	0.106	38%	0.381	C	S	.	.	H	α-helix	trans	-68.2	-35.1	-173.1	-68.6	-5.3	0	0	0	113.5	H162 F163 N166 K170 G171 Y181	H162-W174 AromaticContact CE1-CH2 3.86Å; H162-W174 AromaticContact NE2-CH2 3.95Å; F163-W174 HydrophobicContact CD2-CE3 4.03Å; F163-W174 HydrophobicContact CD2-CZ3 4.3Å; N166-W174 HydrophobicContact CB-CE3 4.46Å; N166-W174 HydrophobicContact CB-CH2 3.27Å; N166-W174 HydrophobicContact CB-CZ2 4.25Å; N166-W174 HydrophobicContact CB-CZ3 3.39Å; K170-W174 HydrophobicContact CB-CD2 3.69Å; K170-W174 HydrophobicContact CB-CE3 4.12Å; K170-W174 HydrophobicContact CB-CG 4.13Å; K170-W174 HydrophobicContact CB-CH2 4.31Å; K170-W174 HydrophobicContact CB-CZ2 3.87Å; K170-W174 HydrophobicContact CB-CZ3 4.4Å; K170-W174 HydrophobicContact CG-CZ2 4.01Å; K170-W174 PolarHBondContact O-N 3.04Å; G171-W174 PolarHBondContact O-N 3.37Å; W174-Y181 HydrophobicContact CB-CD1 4.23Å; W174-Y181 AromaticContact CD2-CD1 3.8Å; W174-Y181 HydrophobicContact CD2-CD1 3.8Å; W174-Y181 HydrophobicContact CD2-CD2 4.32Å; W174-Y181 HydrophobicContact CD2-CE1 4.17Å; W174-Y181 AromaticContact CD2-CG 3.9Å; W174-Y181 HydrophobicContact CD2-CG 3.9Å; W174-Y181 AromaticContact CE2-CD2 3.9Å; W174-Y181 AromaticContact CE2-CG 3.62Å; W174-Y181 HydrophobicContact CE3-CD1 4.3Å; W174-Y181 HydrophobicContact CE3-CE1 4.21Å; W174-Y181 AromaticContact CG-CD1 3.79Å; W174-Y181 HydrophobicContact CG-CD1 3.79Å; W174-Y181 HydrophobicContact CG-CE1 4.39Å; W174-Y181 HydrophobicContact CG-CG 4.14Å; W174-Y181 HydrophobicContact CH2-CD2 4.07Å; W174-Y181 HydrophobicContact CH2-CE2 4.14Å; W174-Y181 AromaticContact CZ2-CD2 3.78Å; W174-Y181 HydrophobicContact CZ2-CD2 3.78Å; W174-Y181 HydrophobicContact CZ2-CE2 4.31Å; W174-Y181 AromaticContact CZ2-CG 4Å; W174-Y181 HydrophobicContact CZ2-CG 4Å; W174-Y181 HydrophobicContact CZ3-CD2 4.48Å; W174-Y181 HydrophobicContact CZ3-CE2 4.26Å; W174-Y181 VanDerWaalsContact NE1-CB 3.34Å; W174-Y181 AromaticContact NE1-CG 3.73Å
175	L	97.2	Very high	95.9	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.005	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-0.7	-176.7	-58.3	178.3	0	0	0	114	F128 F163 I167 G171 L361 Q364 R365 L368	F128-L175 HydrophobicContact CD1-CD2 4.08Å; F128-L175 HydrophobicContact CD2-CD2 4.45Å; F128-L175 HydrophobicContact CE1-CD2 3.98Å; F128-L175 HydrophobicContact CE2-CD2 4.35Å; F128-L175 HydrophobicContact CG-CD2 4.32Å; F128-L175 HydrophobicContact CZ-CD2 4.11Å; F163-L175 HydrophobicContact CE2-CD2 3.98Å; F163-L175 HydrophobicContact CZ-CD2 4.06Å; I167-L175 HydrophobicContact CD1-CD1 3.84Å; I167-L175 HydrophobicContact CD1-CD2 4.47Å; I167-L175 HydrophobicContact CD1-CG 4.13Å; G171-L175 WeakPolarHBondContact O-CB 3.41Å; G171-L175 PolarHBondContact O-N 2.94Å; L175-L361 HydrophobicContact CD2-CD1 4.36Å; L175-Q364 HydrophobicContact CD1-CB 4.42Å; L175-Q364 HydrophobicContact CD2-CB 4.01Å; L175-R365 HydrophobicContact CB-CG 3.94Å; L175-R365 HydrophobicContact CD1-CG 4.03Å; L175-R365 PolarHBondContact O-NE 3.26Å; L175-R365 PolarHBondContact O-NH2 3.06Å; L175-L368 HydrophobicContact CD1-CD1 4.05Å; L175-L368 HydrophobicContact CD1-CG 4.34Å
176	Y	95.9	Very high	95.9	Very high	106 Å²	106	68.2 Å²	68.2	42%	0.416	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	-3.3	-179.2	-63	-92.3	0	0	0	113.6	T172 R365 L368 M411	T172-Y176 WeakPolarHBondContact O-CB 3.44Å; T172-Y176 VanDerWaalsContact O-CD2 3.29Å; T172-Y176 WeakPolarHBondContact O-CD2 3.38Å; Y176-R365 HydrophobicContact CE2-CG 4.17Å; Y176-L368 HydrophobicContact CE2-CD1 3.77Å; Y176-M411 HydrophobicContact CD1-CE 4.14Å; Y176-M411 HydrophobicContact CD1-SD 4.02Å; Y176-M411 HydrophobicContact CD2-CE 3.68Å; Y176-M411 HydrophobicContact CD2-SD 3.93Å; Y176-M411 HydrophobicContact CE1-CE 4.42Å; Y176-M411 HydrophobicContact CE1-SD 3.72Å; Y176-M411 HydrophobicContact CE2-CE 3.98Å; Y176-M411 HydrophobicContact CE2-SD 3.6Å; Y176-M411 HydrophobicContact CG-CE 3.75Å; Y176-M411 HydrophobicContact CG-SD 4.12Å
177	S	93.6	Very high	95.9	Very high	45 Å²	45	69 Å²	69	32%	0.315	39%	0.386	S	S	.	.			trans	-97.4	146.5	170.8	-167.7	0	0	0	0	110.7	R173 K179	R173-S177 WeakPolarHBondContact O-CB 3.31Å; R173-S177 PolarHBondContact O-N 3.47Å; S177-K179 VanDerWaalsContact C-N 3.27Å; S177-K179 PolarHBondContact OG-N 3.13Å
178	S	91	Very high	95.8	Very high	120 Å²	120	71.8 Å²	71.8	84%	0.839	40%	0.401	S	S	*	.	S	Bend	trans	-81.3	-5.9	167.8	55.6	0	0	0	0	113.3	P180	S178-P180 WeakPolarHBondContact O-CD 3.47Å
179	K	95.5	Very high	95.9	Very high	167 Å²	167	69.9 Å²	69.9	73%	0.726	39%	0.39	S	S	*	.	S	Bend	trans	-90	120.1	-179.6	-66.5	-175.7	180	-179.9	0	110.2	S177	S177-K179 VanDerWaalsContact C-N 3.27Å; S177-K179 PolarHBondContact OG-N 3.13Å
180	P	96.4	Very high	95.9	Very high	74 Å²	74	66 Å²	66	48%	0.481	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-59	141.7	174	-23.2	34.1	0	0	0	111.3	P130 S178	P130-P180 HydrophobicContact CG-CG 3.95Å; S178-P180 WeakPolarHBondContact O-CD 3.47Å
181	Y	97	Very high	95.9	Very high	23 Å²	23	61.5 Å²	61.5	9%	0.09	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-82.3	157.3	173.1	62.1	-88.7	0	0	0	111.1	F128 Q129 H162 W174 L183	F128-Y181 HydrophobicContact CD2-CE1 4.03Å; F128-Y181 HydrophobicContact CE2-CE1 4.01Å; Q129-Y181 HydrophobicContact CB-CE1 3.8Å; Q129-Y181 HydrophobicContact CG-CE1 4.13Å; Q129-Y181 PolarHBondContact NE2-O 2.96Å; H162-Y181 AromaticContact CE1-CD2 3.98Å; H162-Y181 AromaticContact CE1-CE2 3.74Å; H162-Y181 AromaticContact ND1-CE2 3.82Å; W174-Y181 HydrophobicContact CB-CD1 4.23Å; W174-Y181 AromaticContact CD2-CD1 3.8Å; W174-Y181 HydrophobicContact CD2-CD1 3.8Å; W174-Y181 HydrophobicContact CD2-CD2 4.32Å; W174-Y181 HydrophobicContact CD2-CE1 4.17Å; W174-Y181 AromaticContact CD2-CG 3.9Å; W174-Y181 HydrophobicContact CD2-CG 3.9Å; W174-Y181 AromaticContact CE2-CD2 3.9Å; W174-Y181 AromaticContact CE2-CG 3.62Å; W174-Y181 HydrophobicContact CE3-CD1 4.3Å; W174-Y181 HydrophobicContact CE3-CE1 4.21Å; W174-Y181 AromaticContact CG-CD1 3.79Å; W174-Y181 HydrophobicContact CG-CD1 3.79Å; W174-Y181 HydrophobicContact CG-CE1 4.39Å; W174-Y181 HydrophobicContact CG-CG 4.14Å; W174-Y181 HydrophobicContact CH2-CD2 4.07Å; W174-Y181 HydrophobicContact CH2-CE2 4.14Å; W174-Y181 AromaticContact CZ2-CD2 3.78Å; W174-Y181 HydrophobicContact CZ2-CD2 3.78Å; W174-Y181 HydrophobicContact CZ2-CE2 4.31Å; W174-Y181 AromaticContact CZ2-CG 4Å; W174-Y181 HydrophobicContact CZ2-CG 4Å; W174-Y181 HydrophobicContact CZ3-CD2 4.48Å; W174-Y181 HydrophobicContact CZ3-CE2 4.26Å; W174-Y181 VanDerWaalsContact NE1-CB 3.34Å; W174-Y181 AromaticContact NE1-CG 3.73Å; Y181-L183 HydrophobicContact CE2-CD2 3.86Å
182	A	97	Very high	96	Very high	88 Å²	88	62.2 Å²	62.2	73%	0.727	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-73	130.9	173.4	0	0	0	0	0	110.3
183	L	97	Very high	96.1	Very high	47 Å²	47	63.5 Å²	63.5	25%	0.246	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-71.1	136.2	173.8	-66.7	172.9	0	0	0	110.1	V89 Q129 Q131 W135 Y181	V89-L183 HydrophobicContact CG1-CB 4.15Å; V89-L183 HydrophobicContact CG1-CD1 3.9Å; V89-L183 HydrophobicContact CG2-CD1 4.19Å; Q129-L183 HydrophobicContact CG-CD2 4.49Å; Q131-L183 HydrophobicContact CB-CD1 3.7Å; Q131-L183 HydrophobicContact CG-CD1 3.58Å; W135-L183 HydrophobicContact CH2-CD1 4.22Å; Y181-L183 HydrophobicContact CE2-CD2 3.86Å
184	A	96.9	Very high	96.2	Very high	50 Å²	50	55 Å²	55	41%	0.413	32%	0.319	S	S	.	.			trans	-138.5	167.3	175.2	0	0	0	0	0	109.5	Y90 H162	Y90-A184 VanDerWaalsContact CE1-O 3.23Å; Y90-A184 WeakPolarHBondContact CE1-O 3.41Å; Y90-A184 PolarHBondContact OH-O 3.38Å; H162-A184 WeakPolarHBondContact CB-O 3.35Å; H162-A184 PolarHBondContact CD2-O 3.37Å; H162-A184 VanDerWaalsContact CD2-O 3.31Å; H162-A184 PolarHBondContact CE1-N 3.44Å; H162-A184 PolarHBondContact ND1-O 3.18Å
185	T	97.1	Very high	96.1	Very high	66 Å²	66	53.6 Å²	53.6	41%	0.405	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-64.8	133.8	177.2	-46.3	0	0	0	0	109.8	Q93 M158 I191	Q93-T185 HydrophobicContact CG-CG2 3.97Å; Q93-T185 PolarHBondContact NE2-OG1 2.84Å; M158-T185 HydrophobicContact CE-CG2 4.09Å; T185-I191 HydrophobicContact CG2-CD1 4.13Å
186	P	97.3	Very high	96.1	Very high	4 Å²	4	55 Å²	55	3%	0.026	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-60.8	157.6	170.1	20.1	-26.2	0	0	0	111.6	M158 L161 H162 L188 I191	M158-P186 HydrophobicContact CE-CG 3.94Å; M158-P186 HydrophobicContact SD-CG 3.97Å; L161-P186 HydrophobicContact CB-CB 4.03Å; L161-P186 HydrophobicContact CB-CG 4.12Å; H162-P186 HydrophobicContact CB-CB 4.22Å; P186-L188 PolarHBondContact O-N 3.13Å; P186-I191 HydrophobicContact CB-CG1 4.31Å; P186-I191 HydrophobicContact CG-CD1 3.96Å; P186-I191 HydrophobicContact CG-CG1 3.73Å
187	P	96.1	Very high	96.1	Very high	58 Å²	58	50.2 Å²	50.2	38%	0.377	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-53.9	138.9	172.2	-23.8	33.7	0	0	0	111.3	A165 S189 V190 I191	A165-P187 HydrophobicContact CB-CG 4.18Å; P187-S189 PolarHBondContact O-N 3.04Å; P187-S189 VanDerWaalsContact O-N 3.15Å; P187-V190 HydrophobicContact CB-CG2 4.15Å; P187-V190 HydrophobicContact CG-CG2 4.28Å; P187-V190 WeakPolarHBondContact O-CB 3.49Å; P187-V190 PolarHBondContact O-N 3.31Å; P187-I191 PolarHBondContact O-N 3.13Å
188	L	95.3	Very high	96.2	Very high	66 Å²	66	49.1 Å²	49.1	35%	0.346	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-32.8	-177	-176.1	67.4	0	0	0	112.4	T57 M60 A61 P186 V190 I191 N192	T57-L188 HydrophobicContact CG2-CD1 4.42Å; M60-L188 HydrophobicContact CB-CD1 4.06Å; M60-L188 HydrophobicContact CE-CD1 4.41Å; A61-L188 HydrophobicContact CB-CD2 3.79Å; P186-L188 PolarHBondContact O-N 3.13Å; L188-V190 VanDerWaalsContact C-N 3.28Å; L188-V190 PolarHBondContact O-N 3.27Å; L188-I191 PolarHBondContact O-N 3.35Å; L188-N192 WeakPolarHBondContact O-CB 3.27Å; L188-N192 PolarHBondContact O-N 3.44Å
189	S	95.2	Very high	96.3	Very high	69 Å²	69	47.4 Å²	47.4	48%	0.483	28%	0.276	S	S	.	.	H	α-helix	trans	-60.2	-35.7	174.4	52.6	0	0	0	0	113.1	P187 N192 Q193	P187-S189 PolarHBondContact O-N 3.04Å; P187-S189 VanDerWaalsContact O-N 3.15Å; S189-N192 WeakPolarHBondContact O-CB 3.48Å; S189-N192 PolarHBondContact O-N 2.89Å; S189-Q193 WeakPolarHBondContact O-CG 3.33Å; S189-Q193 PolarHBondContact O-N 3.02Å; S189-Q193 VanDerWaalsContact O-N 3.13Å
190	V	96.1	Very high	96.3	Very high	25 Å²	25	45.4 Å²	45.4	15%	0.152	27%	0.267	C	S	.	.	H	α-helix	trans	-74.9	-39.9	178.1	179.3	0	0	0	0	110.5	L161 A165 P187 L188 N192 Q193 W194	L161-V190 HydrophobicContact CB-CG1 3.93Å; L161-V190 HydrophobicContact CD1-CG1 4.3Å; L161-V190 HydrophobicContact CD2-CG1 3.81Å; L161-V190 HydrophobicContact CG-CG1 4.22Å; A165-V190 HydrophobicContact CB-CG2 3.94Å; P187-V190 HydrophobicContact CB-CG2 4.15Å; P187-V190 HydrophobicContact CG-CG2 4.28Å; P187-V190 WeakPolarHBondContact O-CB 3.49Å; P187-V190 PolarHBondContact O-N 3.31Å; L188-V190 VanDerWaalsContact C-N 3.28Å; L188-V190 PolarHBondContact O-N 3.27Å; V190-N192 PolarHBondContact O-N 2.81Å; V190-Q193 PolarHBondContact O-N 3.41Å; V190-W194 PolarHBondContact O-N 3.24Å
191	I	97.1	Very high	96.2	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-40.1	170.7	-55.4	177.1	0	0	0	110	T57 M60 L97 M158 T185 P186 P187 L188 Q193 W194 Q195	T57-I191 HydrophobicContact CG2-CB 4.41Å; T57-I191 HydrophobicContact CG2-CG2 3.95Å; M60-I191 HydrophobicContact CE-CD1 3.76Å; M60-I191 HydrophobicContact SD-CG2 4.09Å; L97-I191 HydrophobicContact CD2-CG2 4.38Å; M158-I191 HydrophobicContact CE-CD1 3.75Å; M158-I191 HydrophobicContact CE-CG1 4.43Å; M158-I191 HydrophobicContact SD-CD1 4.07Å; M158-I191 HydrophobicContact SD-CG1 4.13Å; T185-I191 HydrophobicContact CG2-CD1 4.13Å; P186-I191 HydrophobicContact CB-CG1 4.31Å; P186-I191 HydrophobicContact CG-CD1 3.96Å; P186-I191 HydrophobicContact CG-CG1 3.73Å; P187-I191 PolarHBondContact O-N 3.13Å; L188-I191 PolarHBondContact O-N 3.35Å; I191-Q193 PolarHBondContact O-N 2.66Å; I191-W194 WeakPolarHBondContact O-CB 3.45Å; I191-W194 PolarHBondContact O-N 3.03Å; I191-Q195 HydrophobicContact CG2-CG 4.28Å; I191-Q195 WeakPolarHBondContact O-CG 3.38Å; I191-Q195 PolarHBondContact O-N 3.46Å
192	N	96.5	Very high	96.1	Very high	15 Å²	15	48.8 Å²	48.8	8%	0.08	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-41.3	179.4	-172.9	63.9	0	0	0	112.6	P52 Q53 A54 T57 L188 S189 V190 W194 Q195 L196	P52-N192 PolarHBondContact O-ND2 2.88Å; Q53-N192 WeakPolarHBondContact CA-OD1 3.43Å; A54-N192 PolarHBondContact N-OD1 2.97Å; T57-N192 VanDerWaalsContact CG2-CA 3.46Å; T57-N192 HydrophobicContact CG2-CB 3.87Å; T57-N192 PolarHBondContact OG1-OD1 3.35Å; L188-N192 WeakPolarHBondContact O-CB 3.27Å; L188-N192 PolarHBondContact O-N 3.44Å; S189-N192 WeakPolarHBondContact O-CB 3.48Å; S189-N192 PolarHBondContact O-N 2.89Å; V190-N192 PolarHBondContact O-N 2.81Å; N192-W194 VanDerWaalsContact C-N 3.3Å; N192-W194 PolarHBondContact O-N 3.27Å; N192-Q195 PolarHBondContact O-N 3.25Å; N192-L196 WeakPolarHBondContact O-CB 3.32Å; N192-L196 WeakPolarHBondContact O-CG 3.44Å; N192-L196 PolarHBondContact O-N 2.86Å
193	Q	96.3	Very high	96.1	Very high	101 Å²	101	44.9 Å²	44.9	47%	0.472	26%	0.26	S	S	.	.	H	α-helix	trans	-59.7	-42.3	174.7	-70.6	172.8	-3.4	0	0	111.8	S189 V190 I191 A197 F206	S189-Q193 WeakPolarHBondContact O-CG 3.33Å; S189-Q193 PolarHBondContact O-N 3.02Å; S189-Q193 VanDerWaalsContact O-N 3.13Å; V190-Q193 PolarHBondContact O-N 3.41Å; I191-Q193 PolarHBondContact O-N 2.66Å; Q193-A197 WeakPolarHBondContact O-CB 3.32Å; Q193-A197 PolarHBondContact O-N 3.29Å; Q193-F206 HydrophobicContact CB-CE2 3.86Å
194	W	97.5	Very high	96.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-48.6	175.5	176.4	27.4	0	0	0	112.2	L97 M106 W107 M157 M158 L161 V190 I191 N192 A197 L198 F206	L97-W194 HydrophobicContact CD1-CZ3 4.01Å; M106-W194 HydrophobicContact CE-CH2 4.23Å; M106-W194 HydrophobicContact CE-CZ2 4.46Å; M106-W194 HydrophobicContact SD-CH2 4.23Å; M106-W194 HydrophobicContact SD-CZ2 4.08Å; W107-W194 HydrophobicContact CZ2-CZ2 4.09Å; M157-W194 HydrophobicContact CB-CH2 4.11Å; M157-W194 HydrophobicContact CB-CZ2 4.18Å; M157-W194 HydrophobicContact CB-CZ3 4.47Å; M157-W194 HydrophobicContact CE-CG 4.31Å; M157-W194 HydrophobicContact CG-CD2 3.98Å; M157-W194 HydrophobicContact CG-CE3 4.16Å; M157-W194 HydrophobicContact CG-CH2 4.09Å; M157-W194 HydrophobicContact CG-CZ2 3.91Å; M157-W194 HydrophobicContact CG-CZ3 4.21Å; M158-W194 HydrophobicContact CG-CZ3 4.09Å; M158-W194 HydrophobicContact SD-CZ3 3.98Å; L161-W194 HydrophobicContact CD1-CB 4.05Å; L161-W194 HydrophobicContact CD1-CD2 4.25Å; L161-W194 HydrophobicContact CD1-CE3 3.88Å; L161-W194 HydrophobicContact CD1-CG 4.35Å; V190-W194 PolarHBondContact O-N 3.24Å; I191-W194 WeakPolarHBondContact O-CB 3.45Å; I191-W194 PolarHBondContact O-N 3.03Å; N192-W194 VanDerWaalsContact C-N 3.3Å; N192-W194 PolarHBondContact O-N 3.27Å; W194-A197 WeakPolarHBondContact O-CB 3.34Å; W194-A197 PolarHBondContact O-N 2.87Å; W194-A197 VanDerWaalsContact O-N 3.17Å; W194-L198 HydrophobicContact CZ2-CD1 4.46Å; W194-L198 PolarHBondContact O-N 2.76Å; W194-F206 VanDerWaalsContact CA-CE1 3.45Å; W194-F206 VanDerWaalsContact CA-CZ 3.49Å; W194-F206 HydrophobicContact CB-CD1 4.34Å; W194-F206 HydrophobicContact CB-CE1 3.4Å; W194-F206 HydrophobicContact CB-CZ 3.54Å; W194-F206 AromaticContact CD1-CD1 3.94Å; W194-F206 AromaticContact CD1-CE1 3.6Å; W194-F206 HydrophobicContact CG-CD1 4.44Å; W194-F206 AromaticContact CG-CE1 3.68Å; W194-F206 HydrophobicContact CG-CE1 3.68Å; W194-F206 HydrophobicContact CG-CZ 4.31Å
195	Q	96.6	Very high	96.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.4	-41.1	-178.6	-66.6	-60.9	-56.1	0	0	112.2	A54 A56 T57 L97 I191 N192 A197 L198 D199	A54-Q195 HydrophobicContact CB-CB 3.52Å; A56-Q195 HydrophobicContact CB-CG 4.23Å; T57-Q195 HydrophobicContact CG2-CB 4.15Å; T57-Q195 HydrophobicContact CG2-CG 3.9Å; L97-Q195 HydrophobicContact CD2-CG 3.92Å; I191-Q195 HydrophobicContact CG2-CG 4.28Å; I191-Q195 WeakPolarHBondContact O-CG 3.38Å; I191-Q195 PolarHBondContact O-N 3.46Å; N192-Q195 PolarHBondContact O-N 3.25Å; Q195-A197 VanDerWaalsContact C-N 3.3Å; Q195-A197 PolarHBondContact O-N 3.2Å; Q195-L198 WeakPolarHBondContact O-CB 3.35Å; Q195-L198 PolarHBondContact O-N 3.06Å; Q195-D199 VanDerWaalsContact O-CG 3.26Å; Q195-D199 PolarHBondContact O-N 2.85Å
196	L	95.8	Very high	96.2	Very high	29 Å²	29	45.5 Å²	45.5	15%	0.152	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-38.1	172.1	-74.1	176.8	0	0	0	112.7	P52 A54 N192 L198 D199 K200	P52-L196 HydrophobicContact CB-CD1 4.47Å; P52-L196 HydrophobicContact CB-CD2 4.35Å; P52-L196 HydrophobicContact CG-CD1 4.02Å; P52-L196 WeakPolarHBondContact O-CD1 3.5Å; A54-L196 HydrophobicContact CB-CD2 4.07Å; A54-L196 HydrophobicContact CB-CG 4.22Å; N192-L196 WeakPolarHBondContact O-CB 3.32Å; N192-L196 WeakPolarHBondContact O-CG 3.44Å; N192-L196 PolarHBondContact O-N 2.86Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 2.95Å; L196-D199 PolarHBondContact O-N 3.49Å; L196-K200 WeakPolarHBondContact O-CB 3.5Å; L196-K200 WeakPolarHBondContact O-CG 3.48Å; L196-K200 PolarHBondContact O-N 3.38Å
197	A	96.3	Very high	96.2	Very high	6 Å²	6	45.3 Å²	45.3	5%	0.05	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-34.8	177.1	0	0	0	0	0	111.6	Q193 W194 Q195 G201 Q202 L203 F206	Q193-A197 WeakPolarHBondContact O-CB 3.32Å; Q193-A197 PolarHBondContact O-N 3.29Å; W194-A197 WeakPolarHBondContact O-CB 3.34Å; W194-A197 PolarHBondContact O-N 2.87Å; W194-A197 VanDerWaalsContact O-N 3.17Å; Q195-A197 VanDerWaalsContact C-N 3.3Å; Q195-A197 PolarHBondContact O-N 3.2Å; A197-G201 PolarHBondContact O-N 2.91Å; A197-Q202 CarbonylContact O-C 3.5Å; A197-Q202 WeakPolarHBondContact O-CA 3.45Å; A197-Q202 PolarHBondContact O-N 3.09Å; A197-L203 PolarHBondContact O-N 3.33Å; A197-F206 HydrophobicContact CB-CB 3.47Å; A197-F206 VanDerWaalsContact CB-CB 3.47Å; A197-F206 HydrophobicContact CB-CD1 4.23Å; A197-F206 HydrophobicContact CB-CD2 4.29Å; A197-F206 HydrophobicContact CB-CG 3.76Å
198	L	95.4	Very high	96.2	Very high	22 Å²	22	45.2 Å²	45.2	12%	0.115	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-51.6	170.3	-71	169.1	0	0	0	111.2	M106 W194 Q195 L196 K200 G201 L203	M106-L198 HydrophobicContact CB-CD1 4.01Å; M106-L198 HydrophobicContact CB-CD2 4.32Å; M106-L198 HydrophobicContact CG-CD1 3.87Å; M106-L198 WeakPolarHBondContact O-CD2 3.34Å; M106-L198 HydrophobicContact SD-CD1 3.76Å; W194-L198 HydrophobicContact CZ2-CD1 4.46Å; W194-L198 PolarHBondContact O-N 2.76Å; Q195-L198 WeakPolarHBondContact O-CB 3.35Å; Q195-L198 PolarHBondContact O-N 3.06Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 2.95Å; L198-K200 VanDerWaalsContact C-N 3.27Å; L198-K200 PolarHBondContact O-N 3.32Å; L198-G201 PolarHBondContact O-N 3.34Å; L198-G201 VanDerWaalsContact O-N 3.08Å; L198-L203 HydrophobicContact CD2-CB 4.24Å; L198-L203 HydrophobicContact CD2-CD1 3.71Å; L198-L203 HydrophobicContact CD2-CD2 3.64Å; L198-L203 HydrophobicContact CD2-CG 4.04Å; L198-L203 HydrophobicContact CG-CD1 4.12Å
199	D	93.9	Very high	96.2	Very high	84 Å²	84	44.4 Å²	44.4	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-33.3	-176	-63.5	-20.4	0	0	0	112.7	R101 Q195 L196	R101-D199 IonicContact CZ-OD1 3.98Å; R101-D199 IonicContact NH1-OD1 2.95Å; R101-D199 PolarHBondContact NH1-OD1 3.46Å; Q195-D199 VanDerWaalsContact O-CG 3.26Å; Q195-D199 PolarHBondContact O-N 2.85Å; L196-D199 PolarHBondContact O-N 3.49Å
200	K	94.5	Very high	96.3	Very high	125 Å²	125	41.9 Å²	41.9	54%	0.543	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.2	178	-65.5	178.5	-179.4	-178	0	114	L196 L198 Q202	L196-K200 WeakPolarHBondContact O-CB 3.5Å; L196-K200 WeakPolarHBondContact O-CG 3.48Å; L196-K200 PolarHBondContact O-N 3.38Å; L198-K200 VanDerWaalsContact C-N 3.27Å; L198-K200 PolarHBondContact O-N 3.32Å; K200-Q202 HydrophobicContact CB-CG 4.09Å; K200-Q202 PolarHBondContact O-N 3.27Å
201	G	94.8	Very high	96.3	Very high	60 Å²	60	41.1 Å²	41.1	62%	0.619	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	20.9	-175	0	0	0	0	0	114.4	A197 L198	A197-G201 PolarHBondContact O-N 2.91Å; L198-G201 PolarHBondContact O-N 3.34Å; L198-G201 VanDerWaalsContact O-N 3.08Å
202	Q	96.1	Very high	96.3	Very high	108 Å²	108	41.3 Å²	41.3	51%	0.505	25%	0.248	S	C	.	.			trans	-100.5	17.8	-177.6	-66.7	-179.5	-33	0	0	113	A197 K200 P204 T205 F206	A197-Q202 CarbonylContact O-C 3.5Å; A197-Q202 WeakPolarHBondContact O-CA 3.45Å; A197-Q202 PolarHBondContact O-N 3.09Å; K200-Q202 HydrophobicContact CB-CG 4.09Å; K200-Q202 PolarHBondContact O-N 3.27Å; Q202-P204 VanDerWaalsContact C-CD 3.5Å; Q202-T205 PolarHBondContact O-N 3.12Å; Q202-F206 PolarHBondContact O-N 3.4Å
203	L	96.6	Very high	96.2	Very high	6 Å²	6	45.7 Å²	45.7	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-53.9	-43.2	-178.8	-173.6	68.6	0	0	0	113.5	W107 A112 A197 L198 T205 F206 V207	W107-L203 HydrophobicContact CE3-CD2 4.13Å; W107-L203 HydrophobicContact CZ3-CD2 4.27Å; A112-L203 HydrophobicContact CB-CB 4.21Å; A112-L203 HydrophobicContact CB-CD2 3.53Å; A112-L203 HydrophobicContact CB-CG 3.64Å; A197-L203 PolarHBondContact O-N 3.33Å; L198-L203 HydrophobicContact CD2-CB 4.24Å; L198-L203 HydrophobicContact CD2-CD1 3.71Å; L198-L203 HydrophobicContact CD2-CD2 3.64Å; L198-L203 HydrophobicContact CD2-CG 4.04Å; L198-L203 HydrophobicContact CG-CD1 4.12Å; L203-T205 PolarHBondContact O-N 3.48Å; L203-F206 HydrophobicContact CD1-CD1 4.32Å; L203-F206 PolarHBondContact O-N 3.22Å; L203-V207 HydrophobicContact CD1-CG2 4.26Å; L203-V207 HydrophobicContact CG-CG2 4.35Å; L203-V207 WeakPolarHBondContact O-CG2 3.23Å; L203-V207 PolarHBondContact O-N 3.1Å
204	P	97.1	Very high	96.2	Very high	40 Å²	40	42.2 Å²	42.2	26%	0.26	25%	0.252	S	S	.	.	H	α-helix	trans	-59.4	-44.3	177.2	-24.7	34.7	0	0	0	113.3	N109 A112 Q202 V207 A208	N109-P204 WeakPolarHBondContact ND2-CG 3.35Å; A112-P204 HydrophobicContact CB-CG 4.12Å; Q202-P204 VanDerWaalsContact C-CD 3.5Å; P204-V207 PolarHBondContact O-N 2.88Å; P204-A208 WeakPolarHBondContact O-CB 3.25Å; P204-A208 PolarHBondContact O-N 3.48Å
205	T	97.2	Very high	96	Very high	106 Å²	106	47 Å²	47	65%	0.65	28%	0.283	S	S	*	.	H	α-helix	trans	-65.2	-42.2	178.3	-53	0	0	0	0	111.3	Q202 L203 A208 G209	Q202-T205 PolarHBondContact O-N 3.12Å; L203-T205 PolarHBondContact O-N 3.48Å; T205-A208 PolarHBondContact O-N 2.9Å; T205-G209 PolarHBondContact O-N 2.99Å
206	F	97.5	Very high	95.9	Very high	30 Å²	30	52.3 Å²	52.3	13%	0.132	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-49.4	176.1	174.3	-109.7	0	0	0	111.4	M157 L161 Q193 W194 A197 Q202 L203 A208 G209 L210	M157-F206 HydrophobicContact CE-CD1 3.95Å; M157-F206 HydrophobicContact CE-CE1 3.31Å; M157-F206 HydrophobicContact CE-CZ 4.24Å; L161-F206 HydrophobicContact CD2-CE1 4.43Å; L161-F206 HydrophobicContact CD2-CZ 3.95Å; Q193-F206 HydrophobicContact CB-CE2 3.86Å; W194-F206 VanDerWaalsContact CA-CE1 3.45Å; W194-F206 VanDerWaalsContact CA-CZ 3.49Å; W194-F206 HydrophobicContact CB-CD1 4.34Å; W194-F206 HydrophobicContact CB-CE1 3.4Å; W194-F206 HydrophobicContact CB-CZ 3.54Å; W194-F206 AromaticContact CD1-CD1 3.94Å; W194-F206 AromaticContact CD1-CE1 3.6Å; W194-F206 HydrophobicContact CG-CD1 4.44Å; W194-F206 AromaticContact CG-CE1 3.68Å; W194-F206 HydrophobicContact CG-CE1 3.68Å; W194-F206 HydrophobicContact CG-CZ 4.31Å; A197-F206 HydrophobicContact CB-CB 3.47Å; A197-F206 VanDerWaalsContact CB-CB 3.47Å; A197-F206 HydrophobicContact CB-CD1 4.23Å; A197-F206 HydrophobicContact CB-CD2 4.29Å; A197-F206 HydrophobicContact CB-CG 3.76Å; Q202-F206 PolarHBondContact O-N 3.4Å; L203-F206 HydrophobicContact CD1-CD1 4.32Å; L203-F206 PolarHBondContact O-N 3.22Å; F206-A208 PolarHBondContact O-N 3.3Å; F206-G209 PolarHBondContact O-N 3.27Å; F206-L210 HydrophobicContact CE1-CD1 4.14Å; F206-L210 HydrophobicContact CE2-CD2 4.36Å; F206-L210 HydrophobicContact CZ-CD1 4.35Å; F206-L210 HydrophobicContact CZ-CD2 4.25Å; F206-L210 WeakPolarHBondContact O-CG 3.18Å; F206-L210 PolarHBondContact O-N 3.16Å
207	V	97.8	Very high	95.9	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-44.3	177.7	171.3	0	0	0	0	111.2	W107 A115 F116 Q119 M157 L203 P204 G209 L210	W107-V207 HydrophobicContact CH2-CG2 4.49Å; W107-V207 HydrophobicContact CZ3-CG2 4.41Å; A115-V207 HydrophobicContact CB-CG1 3.79Å; F116-V207 HydrophobicContact CB-CG1 3.76Å; F116-V207 HydrophobicContact CB-CG2 4.38Å; Q119-V207 PolarHBondContact NE2-O 3.42Å; M157-V207 HydrophobicContact CE-CG2 4.46Å; L203-V207 HydrophobicContact CD1-CG2 4.26Å; L203-V207 HydrophobicContact CG-CG2 4.35Å; L203-V207 WeakPolarHBondContact O-CG2 3.23Å; L203-V207 PolarHBondContact O-N 3.1Å; P204-V207 PolarHBondContact O-N 2.88Å; V207-G209 VanDerWaalsContact C-N 3.29Å; V207-G209 PolarHBondContact O-N 2.99Å; V207-L210 WeakPolarHBondContact O-CB 3.35Å; V207-L210 PolarHBondContact O-N 2.9Å
208	A	96.1	Very high	95.9	Very high	57 Å²	57	56 Å²	56	47%	0.471	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-38.8	177.5	0	0	0	0	0	112.5	P204 T205 F206 L210 A211	P204-A208 WeakPolarHBondContact O-CB 3.25Å; P204-A208 PolarHBondContact O-N 3.48Å; T205-A208 PolarHBondContact O-N 2.9Å; F206-A208 PolarHBondContact O-N 3.3Å; A208-L210 PolarHBondContact O-N 2.83Å; A208-A211 PolarHBondContact O-N 3.44Å
209	G	96.3	Very high	95.9	Very high	48 Å²	48	57.7 Å²	57.7	50%	0.495	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-15.8	176	0	0	0	0	0	114.6	T205 F206 V207 Q213	T205-G209 PolarHBondContact O-N 2.99Å; F206-G209 PolarHBondContact O-N 3.27Å; V207-G209 VanDerWaalsContact C-N 3.29Å; V207-G209 PolarHBondContact O-N 2.99Å; G209-Q213 PolarHBondContact O-NE2 3.43Å
210	L	97.1	Very high	96.1	Very high	17 Å²	17	55.2 Å²	55.2	9%	0.089	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-17.3	177.2	-57.9	175.7	0	0	0	113.4	M157 Y160 L161 F206 V207 A208 R367	M157-L210 HydrophobicContact CE-CD1 3.41Å; M157-L210 VanDerWaalsContact CE-CD1 3.41Å; M157-L210 HydrophobicContact SD-CD1 4.16Å; Y160-L210 HydrophobicContact CD1-CD1 4.12Å; Y160-L210 HydrophobicContact CE1-CB 3.81Å; Y160-L210 HydrophobicContact CE1-CD1 4.12Å; L161-L210 HydrophobicContact CD2-CD1 3.89Å; L161-L210 HydrophobicContact CD2-CD2 3.93Å; F206-L210 HydrophobicContact CE1-CD1 4.14Å; F206-L210 HydrophobicContact CE2-CD2 4.36Å; F206-L210 HydrophobicContact CZ-CD1 4.35Å; F206-L210 HydrophobicContact CZ-CD2 4.25Å; F206-L210 WeakPolarHBondContact O-CG 3.18Å; F206-L210 PolarHBondContact O-N 3.16Å; V207-L210 WeakPolarHBondContact O-CB 3.35Å; V207-L210 PolarHBondContact O-N 2.9Å; A208-L210 PolarHBondContact O-N 2.83Å; L210-R367 PolarHBondContact O-NH1 2.86Å; L210-R367 PolarHBondContact O-NH2 3.35Å
211	A	96.4	Very high	96.2	Very high	8 Å²	8	50.8 Å²	50.8	7%	0.066	32%	0.318	C	S	.	.	S	Bend	trans	-64.1	161.8	177	0	0	0	0	0	111.7	Q119 A208 Q213 Y217 R367	Q119-A211 HydrophobicContact CG-CB 4.4Å; A208-A211 PolarHBondContact O-N 3.44Å; A211-Q213 PolarHBondContact O-N 3.47Å; A211-Q213 PolarHBondContact O-NE2 2.95Å; A211-Y217 HydrophobicContact CB-CE1 3.8Å; A211-R367 PolarHBondContact O-NH1 3.24Å
212	P	96.5	Very high	96.3	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.032	32%	0.321	C	S	.	.			trans	-57.2	126.9	170.9	-20.9	33.1	0	0	0	110.9	H214 Y217 I363 L366 R367	P212-H214 VanDerWaalsContact C-N 3.34Å; P212-Y217 HydrophobicContact CB-CD2 3.95Å; P212-Y217 HydrophobicContact CB-CG 4.1Å; P212-Y217 HydrophobicContact CG-CD2 3.84Å; P212-Y217 HydrophobicContact CG-CE2 3.98Å; P212-Y217 HydrophobicContact CG-CG 4.42Å; P212-Y217 VanDerWaalsContact O-CD1 3.26Å; P212-Y217 WeakPolarHBondContact O-CD1 3.45Å; P212-I363 HydrophobicContact CG-CG2 3.95Å; P212-L366 HydrophobicContact CB-CB 4.3Å; P212-R367 HydrophobicContact CB-CG 4.07Å; P212-R367 HydrophobicContact CG-CG 4.15Å
213	Q	94.8	Very high	96.3	Very high	108 Å²	108	52.6 Å²	52.6	51%	0.505	32%	0.318	S	S	.	.			trans	-88.9	-0.5	-175.6	-59.8	-58.8	-46.8	0	0	113.6	G209 A211 T371	G209-Q213 PolarHBondContact O-NE2 3.43Å; A211-Q213 PolarHBondContact O-N 3.47Å; A211-Q213 PolarHBondContact O-NE2 2.95Å; Q213-T371 HydrophobicContact CB-CG2 3.98Å; Q213-T371 WeakPolarHBondContact O-CG2 3.3Å
214	H	95.1	Very high	96.3	Very high	27 Å²	27	52.4 Å²	52.4	13%	0.125	32%	0.317	C	S	.	.	S	Bend	trans	-69.9	142.1	-176.2	-172	-93.4	0	0	0	112	P212 Q216 Y217 L366 P370	P212-H214 VanDerWaalsContact C-N 3.34Å; H214-Q216 WeakPolarHBondContact ND1-CB 3.24Å; H214-Q216 PolarHBondContact ND1-N 2.94Å; H214-Q216 PolarHBondContact O-N 3.31Å; H214-Y217 WeakPolarHBondContact O-CB 3.45Å; H214-Y217 PolarHBondContact O-N 2.98Å; H214-L366 HydrophobicContact CB-CB 3.8Å; H214-L366 HydrophobicContact CB-CD1 4.19Å; H214-L366 HydrophobicContact CB-CG 4.4Å; H214-P370 PolarHBondContact CD2-O 3.2Å
215	P	93.5	Very high	96.2	Very high	101 Å²	101	55 Å²	55	66%	0.656	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.8	-177.1	-29.4	35.3	0	0	0	115.5	Y217 T371	P215-Y217 VanDerWaalsContact C-N 3.26Å; P215-Y217 PolarHBondContact O-N 3.5Å; P215-T371 VanDerWaalsContact CD-O 3.27Å; P215-T371 WeakPolarHBondContact CD-O 3.5Å
216	Q	94.4	Very high	96.1	Very high	111 Å²	111	52.8 Å²	52.8	52%	0.519	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-11.2	177.3	-63.3	179	20.4	0	0	114.1	H214 A218 A219 M220 L366	H214-Q216 WeakPolarHBondContact ND1-CB 3.24Å; H214-Q216 PolarHBondContact ND1-N 2.94Å; H214-Q216 PolarHBondContact O-N 3.31Å; Q216-A218 PolarHBondContact O-N 3.35Å; Q216-A219 PolarHBondContact O-N 3.25Å; Q216-M220 HydrophobicContact CB-CG 4.5Å; Q216-M220 HydrophobicContact CB-SD 4.11Å; Q216-M220 WeakPolarHBondContact O-CB 3.41Å; Q216-M220 WeakPolarHBondContact O-CG 3.37Å; Q216-M220 PolarHBondContact O-N 2.71Å; Q216-L366 HydrophobicContact CB-CD1 4.32Å; Q216-L366 HydrophobicContact CB-CD2 4.44Å
217	Y	96.7	Very high	96	Very high	43 Å²	43	53 Å²	53	17%	0.169	32%	0.323	C	S	.	.	H	α-helix	trans	-56.5	-49.7	-174.2	172	-124.3	0	0	0	112	E122 A211 P212 H214 P215 A219 M220 H221 I363	E122-Y217 PolarHBondContact OE1-OH 3.03Å; E122-Y217 WeakPolarHBondContact OE2-CE2 3.4Å; A211-Y217 HydrophobicContact CB-CE1 3.8Å; P212-Y217 HydrophobicContact CB-CD2 3.95Å; P212-Y217 HydrophobicContact CB-CG 4.1Å; P212-Y217 HydrophobicContact CG-CD2 3.84Å; P212-Y217 HydrophobicContact CG-CE2 3.98Å; P212-Y217 HydrophobicContact CG-CG 4.42Å; P212-Y217 VanDerWaalsContact O-CD1 3.26Å; P212-Y217 WeakPolarHBondContact O-CD1 3.45Å; H214-Y217 WeakPolarHBondContact O-CB 3.45Å; H214-Y217 PolarHBondContact O-N 2.98Å; P215-Y217 VanDerWaalsContact C-N 3.26Å; P215-Y217 PolarHBondContact O-N 3.5Å; Y217-A219 PolarHBondContact O-N 2.99Å; Y217-M220 PolarHBondContact O-N 2.95Å; Y217-H221 HydrophobicContact CD2-CB 4.46Å; Y217-H221 HydrophobicContact CE2-CB 4.13Å; Y217-H221 VanDerWaalsContact O-CB 3.23Å; Y217-H221 WeakPolarHBondContact O-CB 3.17Å; Y217-H221 PolarHBondContact O-N 3.45Å; Y217-I363 HydrophobicContact CD2-CG2 3.77Å; Y217-I363 HydrophobicContact CE2-CG2 3.76Å
218	A	95.8	Very high	95.8	Very high	70 Å²	70	56.9 Å²	56.9	58%	0.579	34%	0.343	S	S	*	.	H	α-helix	trans	-59.9	-47.8	-176.3	0	0	0	0	0	112.5	Q216 H221 E222	Q216-A218 PolarHBondContact O-N 3.35Å; A218-H221 PolarHBondContact O-N 2.76Å; A218-E222 PolarHBondContact O-N 3.08Å
219	A	96.8	Very high	95.7	Very high	58 Å²	58	58.3 Å²	58.3	48%	0.479	35%	0.349	S	S	.	.	H	α-helix	trans	-66.6	-39	179.9	0	0	0	0	0	112.5	Q216 Y217 S223	Q216-A219 PolarHBondContact O-N 3.25Å; Y217-A219 PolarHBondContact O-N 2.99Å; A219-S223 WeakPolarHBondContact O-CB 3.36Å; A219-S223 PolarHBondContact O-N 3.11Å; A219-S223 PolarHBondContact O-OG 2.78Å
220	M	97.8	Very high	95.5	Very high	31 Å²	31	58.5 Å²	58.5	15%	0.153	34%	0.339	C	S	.	.	H	α-helix	trans	-69.7	-37.4	176.1	-69.8	178.3	70.3	0	0	111.7	Q216 Y217 S223 L224 L359 N362 I363 L366	Q216-M220 HydrophobicContact CB-CG 4.5Å; Q216-M220 HydrophobicContact CB-SD 4.11Å; Q216-M220 WeakPolarHBondContact O-CB 3.41Å; Q216-M220 WeakPolarHBondContact O-CG 3.37Å; Q216-M220 PolarHBondContact O-N 2.71Å; Y217-M220 PolarHBondContact O-N 2.95Å; M220-S223 WeakPolarHBondContact O-CB 3.5Å; M220-S223 PolarHBondContact O-N 3Å; M220-L224 WeakPolarHBondContact O-CB 3.21Å; M220-L224 PolarHBondContact O-N 3.14Å; M220-L359 HydrophobicContact CB-CD1 4.23Å; M220-L359 HydrophobicContact CE-CD1 3.59Å; M220-L359 HydrophobicContact CG-CD1 4.34Å; M220-N362 HydrophobicContact CE-CB 3.84Å; M220-I363 HydrophobicContact CB-CD1 4.05Å; M220-I363 HydrophobicContact CB-CG1 3.7Å; M220-I363 HydrophobicContact CE-CG1 3.9Å; M220-L366 HydrophobicContact SD-CD1 3.73Å; M220-L366 HydrophobicContact SD-CD2 4.03Å; M220-L366 HydrophobicContact SD-CG 4.14Å
221	H	96.6	Very high	95.3	Very high	33 Å²	33	63.9 Å²	63.9	15%	0.153	37%	0.373	C	S	.	.	H	α-helix	trans	-63.6	-46	175.3	-175.6	82.4	0	0	0	111.3	E122 Y217 A218 S223 L224 L225	E122-H221 VanDerWaalsContact CD-CE1 3.41Å; E122-H221 IonicContact OE1-CE1 3.81Å; E122-H221 PolarHBondContact OE1-CE1 3.24Å; E122-H221 IonicContact OE1-ND1 3.03Å; E122-H221 PolarHBondContact OE1-ND1 3.24Å; E122-H221 IonicContact OE2-CE1 2.74Å; E122-H221 IonicContact OE2-ND1 3.85Å; E122-H221 PolarHBondContact OE2-ND1 3.43Å; Y217-H221 HydrophobicContact CD2-CB 4.46Å; Y217-H221 HydrophobicContact CE2-CB 4.13Å; Y217-H221 VanDerWaalsContact O-CB 3.23Å; Y217-H221 WeakPolarHBondContact O-CB 3.17Å; Y217-H221 PolarHBondContact O-N 3.45Å; A218-H221 PolarHBondContact O-N 2.76Å; H221-S223 VanDerWaalsContact C-N 3.32Å; H221-S223 PolarHBondContact O-N 3.14Å; H221-L224 WeakPolarHBondContact O-CB 3.5Å; H221-L224 PolarHBondContact O-N 3.4Å; H221-L224 VanDerWaalsContact O-N 3.11Å; H221-L225 WeakPolarHBondContact O-CG 3.27Å; H221-L225 PolarHBondContact O-N 2.82Å
222	E	96.4	Very high	95.1	Very high	143 Å²	143	70.6 Å²	70.6	67%	0.668	40%	0.4	S	S	*	.	H	α-helix	trans	-58.9	-43.6	173.9	-174.3	178.7	-176.1	0	0	111.8	A218 L224 L225 A226	A218-E222 PolarHBondContact O-N 3.08Å; E222-L224 VanDerWaalsContact C-N 3.3Å; E222-L224 PolarHBondContact O-N 3Å; E222-L225 PolarHBondContact O-N 3.05Å; E222-A226 PolarHBondContact O-N 3.35Å
223	S	96	Very high	95.1	Very high	63 Å²	63	76 Å²	76	44%	0.441	44%	0.436	S	S	.	.	H	α-helix	trans	-61.7	-37.2	175.1	-60.6	0	0	0	0	112.3	A219 M220 H221 A226 L227	A219-S223 WeakPolarHBondContact O-CB 3.36Å; A219-S223 PolarHBondContact O-N 3.11Å; A219-S223 PolarHBondContact O-OG 2.78Å; M220-S223 WeakPolarHBondContact O-CB 3.5Å; M220-S223 PolarHBondContact O-N 3Å; H221-S223 VanDerWaalsContact C-N 3.32Å; H221-S223 PolarHBondContact O-N 3.14Å; S223-A226 PolarHBondContact O-N 3.24Å; S223-L227 WeakPolarHBondContact O-CG 3.44Å; S223-L227 PolarHBondContact O-N 2.89Å; S223-L227 VanDerWaalsContact O-N 3.11Å
224	L	97	Very high	95.1	Very high	2 Å²	2	72.4 Å²	72.4	1%	0.01	42%	0.418	C	S	.	.	H	α-helix	trans	-65.2	-45.2	175.2	178.3	63.6	0	0	0	111.1	E122 I125 M220 H221 E222 A226 L227 L228 A356 L359 A360 I363	E122-L224 HydrophobicContact CB-CD2 4.5Å; E122-L224 HydrophobicContact CG-CD2 3.93Å; I125-L224 HydrophobicContact CG2-CD1 4.49Å; M220-L224 WeakPolarHBondContact O-CB 3.21Å; M220-L224 PolarHBondContact O-N 3.14Å; H221-L224 WeakPolarHBondContact O-CB 3.5Å; H221-L224 PolarHBondContact O-N 3.4Å; H221-L224 VanDerWaalsContact O-N 3.11Å; E222-L224 VanDerWaalsContact C-N 3.3Å; E222-L224 PolarHBondContact O-N 3Å; L224-A226 VanDerWaalsContact C-N 3.32Å; L224-A226 PolarHBondContact O-N 3.38Å; L224-L227 PolarHBondContact O-N 3.47Å; L224-L228 HydrophobicContact CD1-CD1 4.2Å; L224-L228 HydrophobicContact CD1-CG 4.27Å; L224-L228 HydrophobicContact CG-CD1 3.99Å; L224-L228 HydrophobicContact CG-CG 4.48Å; L224-L228 VanDerWaalsContact O-CG 3.29Å; L224-L228 WeakPolarHBondContact O-CG 3.46Å; L224-L228 PolarHBondContact O-N 3.15Å; L224-A356 HydrophobicContact CD1-CB 3.6Å; L224-A356 WeakPolarHBondContact CD1-O 3.43Å; L224-L359 HydrophobicContact CB-CD2 3.9Å; L224-L359 HydrophobicContact CB-CG 4.43Å; L224-A360 HydrophobicContact CD1-CB 4.24Å; L224-A360 HydrophobicContact CD2-CB 4.06Å; L224-I363 HydrophobicContact CB-CD1 4.14Å; L224-I363 HydrophobicContact CD2-CD1 3.91Å
225	L	95.4	Very high	95.2	Very high	94 Å²	94	71.9 Å²	71.9	49%	0.492	42%	0.417	S	S	.	.	H	α-helix	trans	-60.3	-42	176.3	-66.1	179.1	0	0	0	111.7	H221 E222 L227 L228 S229	H221-L225 WeakPolarHBondContact O-CG 3.27Å; H221-L225 PolarHBondContact O-N 2.82Å; E222-L225 PolarHBondContact O-N 3.05Å; L225-L227 PolarHBondContact O-N 3.37Å; L225-L228 PolarHBondContact O-N 2.83Å; L225-S229 WeakPolarHBondContact O-CB 3.29Å; L225-S229 PolarHBondContact O-N 3.5Å
226	A	94.9	Very high	95.3	Very high	59 Å²	59	71 Å²	71	49%	0.488	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-45.8	175.7	0	0	0	0	0	111.7	E222 S223 L224 L228 S229	E222-A226 PolarHBondContact O-N 3.35Å; S223-A226 PolarHBondContact O-N 3.24Å; L224-A226 VanDerWaalsContact C-N 3.32Å; L224-A226 PolarHBondContact O-N 3.38Å; A226-L228 PolarHBondContact O-N 3.18Å; A226-S229 PolarHBondContact O-N 2.93Å; A226-S229 PolarHBondContact O-OG 3.2Å
227	L	95.2	Very high	95.3	Very high	36 Å²	36	66.1 Å²	66.1	19%	0.188	38%	0.381	C	S	.	.	H	α-helix	trans	-63.5	-39.5	177.4	-69.2	170.6	0	0	0	112.9	S223 L224 L225 S229 D230 P352 R355 A356 L359	S223-L227 WeakPolarHBondContact O-CG 3.44Å; S223-L227 PolarHBondContact O-N 2.89Å; S223-L227 VanDerWaalsContact O-N 3.11Å; L224-L227 PolarHBondContact O-N 3.47Å; L225-L227 PolarHBondContact O-N 3.37Å; L227-S229 VanDerWaalsContact C-N 3.32Å; L227-D230 PolarHBondContact O-N 3.27Å; L227-P352 HydrophobicContact CB-CB 4.49Å; L227-P352 HydrophobicContact CD2-CB 4.05Å; L227-R355 HydrophobicContact CD1-CB 4.1Å; L227-R355 HydrophobicContact CD1-CG 3.88Å; L227-R355 HydrophobicContact CD2-CB 4.37Å; L227-R355 HydrophobicContact CD2-CG 4.43Å; L227-A356 HydrophobicContact CB-CB 4.13Å; L227-A356 HydrophobicContact CD1-CB 4.47Å; L227-L359 HydrophobicContact CD1-CD2 3.82Å
228	L	93.4	Very high	95.2	Very high	80 Å²	80	69.4 Å²	69.4	42%	0.419	41%	0.406	S	S	.	.	H	α-helix	trans	-72.6	-25.6	179.3	-66.3	171.9	0	0	0	112.9	I125 L224 L225 A226 D230 A356	I125-L228 HydrophobicContact CD1-CD1 3.64Å; I125-L228 HydrophobicContact CD1-CD2 4.03Å; I125-L228 HydrophobicContact CD1-CG 4.46Å; L224-L228 HydrophobicContact CD1-CD1 4.2Å; L224-L228 HydrophobicContact CD1-CG 4.27Å; L224-L228 HydrophobicContact CG-CD1 3.99Å; L224-L228 HydrophobicContact CG-CG 4.48Å; L224-L228 VanDerWaalsContact O-CG 3.29Å; L224-L228 WeakPolarHBondContact O-CG 3.46Å; L224-L228 PolarHBondContact O-N 3.15Å; L225-L228 PolarHBondContact O-N 2.83Å; A226-L228 PolarHBondContact O-N 3.18Å; L228-D230 VanDerWaalsContact C-N 3.28Å; L228-A356 HydrophobicContact CD2-CB 3.85Å; L228-A356 HydrophobicContact CG-CB 4.32Å
229	S	93.6	Very high	95	Very high	87 Å²	87	67.3 Å²	67.3	61%	0.608	39%	0.391	S	S	*	.	H	α-helix	trans	-75	-16.9	177.1	75	0	0	0	0	113.7	L225 A226 L227 T231	L225-S229 WeakPolarHBondContact O-CB 3.29Å; L225-S229 PolarHBondContact O-N 3.5Å; A226-S229 PolarHBondContact O-N 2.93Å; A226-S229 PolarHBondContact O-OG 3.2Å; L227-S229 VanDerWaalsContact C-N 3.32Å; S229-T231 PolarHBondContact O-N 3.46Å; S229-T231 VanDerWaalsContact O-N 3.15Å
230	D	92.2	Very high	94.8	Very high	52 Å²	52	73.5 Å²	73.5	28%	0.278	41%	0.407	S	S	.	.			trans	-80.3	97.9	179.9	-168	-5.3	0	0	0	111.6	L227 L228 K232 R261 P352	L227-D230 PolarHBondContact O-N 3.27Å; L228-D230 VanDerWaalsContact C-N 3.28Å; D230-K232 WeakPolarHBondContact OD1-CB 3.44Å; D230-K232 PolarHBondContact OD1-N 3.13Å; D230-K232 VanDerWaalsContact OD1-N 3.08Å; D230-R261 IonicContact OD1-CZ 2.73Å; D230-R261 IonicContact OD1-NH2 3.19Å; D230-R261 PolarHBondContact OD1-NH2 3.29Å; D230-R261 IonicContact OD2-CZ 2.76Å; D230-R261 IonicContact OD2-NE 3.42Å; D230-R261 IonicContact OD2-NH2 3.67Å; D230-R261 PolarHBondContact OD2-NH2 3.32Å; D230-P352 HydrophobicContact CB-CB 4.2Å; D230-P352 HydrophobicContact CB-CG 4.2Å
231	T	92.1	Very high	94.6	Very high	131 Å²	131	75.9 Å²	75.9	80%	0.804	43%	0.432	S	S	*	.			trans	-92.4	-2.8	179.1	53.2	0	0	0	0	113.5	S229	S229-T231 PolarHBondContact O-N 3.46Å; S229-T231 VanDerWaalsContact O-N 3.15Å
232	K	93.6	Very high	94.6	Very high	148 Å²	148	77.2 Å²	77.2	64%	0.643	44%	0.442	S	S	*	.	S	Bend	trans	-78.9	137.4	-176.4	-63	174.7	-175.7	173.4	0	110.1	D230 W234 R261	D230-K232 WeakPolarHBondContact OD1-CB 3.44Å; D230-K232 PolarHBondContact OD1-N 3.13Å; D230-K232 VanDerWaalsContact OD1-N 3.08Å; K232-W234 PolarHBondContact O-N 3.11Å; K232-R261 PolarHBondContact O-NH2 3.22Å
233	P	94.8	Very high	94.6	Very high	119 Å²	119	71.1 Å²	71.1	77%	0.773	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-50.5	134.4	174.6	-26.2	34	0	0	0	111.6	R261	P233-R261 PolarHBondContact O-NH1 3.29Å
234	W	95.8	Very high	94.6	Very high	33 Å²	33	75.6 Å²	75.6	13%	0.125	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-82.4	126.4	180	-163.8	-108	0	0	0	110.3	K232 I258 R261 T262 L348 T351 P352	K232-W234 PolarHBondContact O-N 3.11Å; W234-I258 HydrophobicContact CZ2-CB 4.41Å; W234-I258 HydrophobicContact CZ2-CG1 4.32Å; W234-I258 HydrophobicContact CZ2-CG2 3.92Å; W234-R261 VanDerWaalsContact CE3-NH2 3.32Å; W234-R261 HydrophobicContact CH2-CB 3.76Å; W234-R261 HydrophobicContact CZ3-CB 3.79Å; W234-R261 HydrophobicContact CZ3-CG 4.47Å; W234-R261 VanDerWaalsContact CZ3-NE 3.29Å; W234-T262 HydrophobicContact CH2-CG2 3.93Å; W234-T262 HydrophobicContact CZ2-CG2 4.1Å; W234-L348 PolarHBondContact NE1-O 3.42Å; W234-T351 HydrophobicContact CB-CG2 3.84Å; W234-T351 HydrophobicContact CG-CG2 4.29Å; W234-P352 HydrophobicContact CD2-CG 4.26Å; W234-P352 HydrophobicContact CE3-CG 3.5Å; W234-P352 HydrophobicContact CH2-CG 4.49Å; W234-P352 HydrophobicContact CZ3-CG 3.65Å
235	P	96.1	Very high	94.6	Very high	16 Å²	16	78.5 Å²	78.5	10%	0.104	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-57.5	149.4	171.3	25.2	-37	0	0	0	111.4	A254 E257 I258	P235-A254 HydrophobicContact CB-CB 3.98Å; P235-E257 HydrophobicContact CB-CB 4.49Å; P235-E257 HydrophobicContact CG-CB 4.03Å; P235-E257 HydrophobicContact CG-CG 3.97Å; P235-I258 HydrophobicContact CB-CG1 4.19Å; P235-I258 HydrophobicContact CG-CD1 4.32Å; P235-I258 HydrophobicContact CG-CG1 3.49Å; P235-I258 VanDerWaalsContact CG-CG1 3.49Å
236	Q	95.7	Very high	94.5	Very high	81 Å²	81	76.5 Å²	76.5	38%	0.379	44%	0.442	S	S	.	.			trans	-129.7	134.8	-176.3	-66.7	-68.7	-41.5	0	0	110.6	N349	Q236-N349 PolarHBondContact NE2-O 3.23Å; Q236-N349 PolarHBondContact OE1-OD1 3.25Å
237	L	96	Very high	94.5	Very high	9 Å²	9	77.7 Å²	77.7	5%	0.047	44%	0.438	C	S	.	.			trans	-85.2	118	171	-50.2	-178.8	0	0	0	108.6	D251 A254 L255 I258 I340 R345 L348 N349	L237-D251 HydrophobicContact CB-CB 4.39Å; L237-D251 HydrophobicContact CD2-CB 3.84Å; L237-D251 WeakPolarHBondContact CD2-O 3.38Å; L237-A254 HydrophobicContact CD2-CB 3.96Å; L237-L255 HydrophobicContact CD1-CD1 4.36Å; L237-L255 HydrophobicContact CD2-CB 3.92Å; L237-I258 HydrophobicContact CD2-CD1 4.07Å; L237-I258 HydrophobicContact CG-CD1 4.04Å; L237-I340 HydrophobicContact CD1-CG2 4.29Å; L237-R345 HydrophobicContact CB-CG 4Å; L237-R345 HydrophobicContact CD1-CG 4.3Å; L237-L348 HydrophobicContact CD1-CB 3.9Å; L237-L348 HydrophobicContact CD1-CD1 3.62Å; L237-L348 HydrophobicContact CD1-CG 4.39Å; L237-N349 PolarHBondContact N-OD1 3.12Å; L237-N349 PolarHBondContact O-ND2 3.05Å
238	T	95	Very high	94.5	Very high	112 Å²	112	84.3 Å²	84.3	69%	0.687	46%	0.46	S	S	*	.			trans	-101.3	-21.1	-171.2	60.6	0	0	0	0	113.4	D251	T238-D251 PolarHBondContact N-OD1 2.85Å; T238-D251 PolarHBondContact OG1-OD1 3.12Å; T238-D251 VanDerWaalsContact OG1-OD1 3.05Å
239	G	91.3	Very high	94.5	Very high	26 Å²	26	81.5 Å²	81.5	27%	0.268	45%	0.448	S	S	.	.			trans	-62.2	143.2	176.5	0	0	0	0	0	111.8	D251 R345	G239-D251 WeakPolarHBondContact CA-OD2 3.34Å; G239-D251 PolarHBondContact N-OD1 3.09Å; G239-D251 PolarHBondContact N-OD2 3.04Å; G239-R345 VanDerWaalsContact O-CD 3.23Å; G239-R345 WeakPolarHBondContact O-CD 3.43Å; G239-R345 PolarHBondContact O-NE 3.18Å; G239-R345 PolarHBondContact O-NH1 3.13Å
240	K	92.1	Very high	94.5	Very high	188 Å²	188	81.2 Å²	81.2	82%	0.817	44%	0.439	S	S	*	.			trans	-99.3	-28.6	178.7	-65.6	-173.9	179.9	-177.1	0	113.3	R345	K240-R345 VanDerWaalsContact CA-NH1 3.27Å; K240-R345 PolarHBondContact O-NH1 3.16Å
241	A	93.8	Very high	94.6	Very high	82 Å²	82	79.4 Å²	79.4	68%	0.678	43%	0.429	S	S	*	.	S	Bend	trans	-73.5	144.7	179.1	0	0	0	0	0	111.4	L243 R345	A241-L243 PolarHBondContact O-N 3.36Å; A241-R345 PolarHBondContact O-NH2 2.98Å
242	T	96.4	Very high	94.8	Very high	60 Å²	60	73.2 Å²	73.2	37%	0.368	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-59.7	124.6	176.7	-58.9	0	0	0	0	110.9	R244 Q247 A339 I340	T242-R244 HydrophobicContact CG2-CG 4.29Å; T242-Q247 PolarHBondContact O-OE1 3.5Å; T242-A339 HydrophobicContact CG2-CB 4.24Å; T242-I340 WeakPolarHBondContact CA-O 3.39Å
243	L	96.4	Very high	94.8	Very high	15 Å²	15	69.2 Å²	69.2	8%	0.079	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-87.7	116.8	174.6	-176.8	64.4	0	0	0	109.3	A241 Q247 V252 Y317 I340	A241-L243 PolarHBondContact O-N 3.36Å; L243-Q247 HydrophobicContact CD1-CB 3.78Å; L243-V252 HydrophobicContact CD2-CG2 4.29Å; L243-Y317 HydrophobicContact CD2-CD1 4.03Å; L243-Y317 HydrophobicContact CD2-CG 4.04Å; L243-Y317 HydrophobicContact CG-CD1 3.78Å; L243-Y317 HydrophobicContact CG-CE1 4.39Å; L243-Y317 HydrophobicContact CG-CG 4.23Å; L243-I340 HydrophobicContact CB-CB 4.17Å; L243-I340 HydrophobicContact CD2-CD1 4.17Å; L243-I340 PolarHBondContact N-O 3.29Å; L243-I340 VanDerWaalsContact N-O 3.16Å; L243-I340 PolarHBondContact O-N 3.35Å
244	R	96.8	Very high	94.9	Very high	158 Å²	158	64.5 Å²	64.5	60%	0.596	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-102.1	152.3	179.4	-61.2	-174.5	178.1	-151.1	-1.1	111.4	T242 G246 Q247 Y317	T242-R244 HydrophobicContact CG2-CG 4.29Å; R244-G246 PolarHBondContact O-N 2.85Å; R244-Q247 HydrophobicContact CB-CG 4.28Å; R244-Q247 VanDerWaalsContact O-CB 3.28Å; R244-Q247 WeakPolarHBondContact O-CB 3.45Å; R244-Q247 WeakPolarHBondContact O-CG 3.48Å; R244-Q247 PolarHBondContact O-N 2.86Å; R244-Q247 VanDerWaalsContact O-N 3.11Å; R244-Y317 WeakPolarHBondContact O-CD1 3.03Å
245	P	95.7	Very high	94.9	Very high	63 Å²	63	63 Å²	63	41%	0.409	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.2	133.6	175.8	-31.7	36.6	0	0	0	113.4	Q247 Y317 V322	P245-Q247 VanDerWaalsContact C-N 3.31Å; P245-Q247 PolarHBondContact O-N 2.87Å; P245-Y317 HydrophobicContact CG-CE1 4.43Å; P245-V322 HydrophobicContact CB-CG1 4.35Å; P245-V322 HydrophobicContact CB-CG2 3.68Å; P245-V322 HydrophobicContact CG-CG1 3.96Å; P245-V322 HydrophobicContact CG-CG2 3.89Å
246	G	94.3	Very high	94.9	Very high	51 Å²	51	66.1 Å²	66.1	53%	0.526	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-10	179.8	0	0	0	0	0	116.1	R244 Y317	R244-G246 PolarHBondContact O-N 2.85Å; G246-Y317 WeakPolarHBondContact CA-O 2.82Å; G246-Y317 PolarHBondContact N-O 3.32Å
247	Q	94.5	Very high	94.9	Very high	85 Å²	85	66.2 Å²	66.2	40%	0.397	36%	0.356	S	S	.	.			trans	-74.3	152.4	177.6	-69.2	-178.2	-17.8	0	0	112.4	T242 L243 R244 P245 Y317	T242-Q247 PolarHBondContact O-OE1 3.5Å; L243-Q247 HydrophobicContact CD1-CB 3.78Å; R244-Q247 HydrophobicContact CB-CG 4.28Å; R244-Q247 VanDerWaalsContact O-CB 3.28Å; R244-Q247 WeakPolarHBondContact O-CB 3.45Å; R244-Q247 WeakPolarHBondContact O-CG 3.48Å; R244-Q247 PolarHBondContact O-N 2.86Å; R244-Q247 VanDerWaalsContact O-N 3.11Å; P245-Q247 VanDerWaalsContact C-N 3.31Å; P245-Q247 PolarHBondContact O-N 2.87Å; Q247-Y317 WeakPolarHBondContact O-CB 3.44Å; Q247-Y317 PolarHBondContact O-N 3.09Å
248	W	94.4	Very high	94.9	Very high	174 Å²	174	65.8 Å²	65.8	66%	0.659	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.6	172.4	-71.6	72.3	0	0	0	110.7	R314 A315 A316	W248-R314 HydrophobicContact CE3-CB 4.17Å; W248-R314 WeakPolarHBondContact CZ3-O 3.47Å; W248-A315 WeakPolarHBondContact CA-O 3.14Å; W248-A315 VanDerWaalsContact CE3-C 3.41Å; W248-A316 HydrophobicContact CD2-CB 4.04Å; W248-A316 HydrophobicContact CE3-CB 4.47Å; W248-A316 HydrophobicContact CG-CB 4.48Å; W248-A316 HydrophobicContact CH2-CB 4.38Å; W248-A316 HydrophobicContact CZ2-CB 3.92Å
249	S	93.9	Very high	94.9	Very high	22 Å²	22	60.5 Å²	60.5	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154.7	176.5	177	0	0	0	0	112.5	D251 A315	S249-D251 PolarHBondContact OG-N 3.12Å; S249-D251 VanDerWaalsContact OG-N 3.11Å; S249-A315 PolarHBondContact N-O 3.42Å; S249-A315 PolarHBondContact O-N 3.04Å
250	N	93.8	Very high	95.1	Very high	80 Å²	80	64.9 Å²	64.9	43%	0.428	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-20	171.4	-64	-1.9	0	0	0	111.8	P253 R314	N250-P253 WeakPolarHBondContact O-CD 3.46Å; N250-R314 WeakPolarHBondContact OD1-CG 3.43Å; N250-R314 PolarHBondContact OD1-NE 2.81Å
251	D	95.2	Very high	95.1	Very high	14 Å²	14	59.1 Å²	59.1	8%	0.075	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-10.2	-177.6	-67.6	-39.8	0	0	0	113	L237 T238 G239 S249 A254 L255	L237-D251 HydrophobicContact CB-CB 4.39Å; L237-D251 HydrophobicContact CD2-CB 3.84Å; L237-D251 WeakPolarHBondContact CD2-O 3.38Å; T238-D251 PolarHBondContact N-OD1 2.85Å; T238-D251 PolarHBondContact OG1-OD1 3.12Å; T238-D251 VanDerWaalsContact OG1-OD1 3.05Å; G239-D251 WeakPolarHBondContact CA-OD2 3.34Å; G239-D251 PolarHBondContact N-OD1 3.09Å; G239-D251 PolarHBondContact N-OD2 3.04Å; S249-D251 PolarHBondContact OG-N 3.12Å; S249-D251 VanDerWaalsContact OG-N 3.11Å; D251-A254 WeakPolarHBondContact O-CB 3.47Å; D251-A254 PolarHBondContact O-N 3.17Å; D251-A254 VanDerWaalsContact O-N 3.17Å; D251-L255 WeakPolarHBondContact O-CB 3.47Å; D251-L255 PolarHBondContact O-N 3.36Å
252	V	95.3	Very high	95	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-41	-175.1	171.7	0	0	0	0	113.5	L243 A254 L255 R256 A315 L321	L243-V252 HydrophobicContact CD2-CG2 4.29Å; V252-A254 PolarHBondContact O-N 2.79Å; V252-L255 WeakPolarHBondContact O-CB 3.45Å; V252-L255 PolarHBondContact O-N 2.96Å; V252-R256 PolarHBondContact O-N 3.36Å; V252-A315 HydrophobicContact CB-CB 3.87Å; V252-A315 HydrophobicContact CG1-CB 3.58Å; V252-A315 WeakPolarHBondContact CG2-O 3.36Å; V252-L321 HydrophobicContact CG1-CD1 3.63Å
253	P	94.2	Very high	94.8	Very high	64 Å²	64	55 Å²	55	42%	0.416	28%	0.28	S	S	.	.	H	α-helix	trans	-60.4	-43.3	174	-25.4	36	0	0	0	113	N250 R256 E257	N250-P253 WeakPolarHBondContact O-CD 3.46Å; P253-R256 PolarHBondContact O-N 2.91Å; P253-E257 PolarHBondContact O-N 3.32Å
254	A	95.9	Very high	94.6	Very high	21 Å²	21	55.3 Å²	55.3	17%	0.174	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-42.6	176.3	0	0	0	0	0	111.2	P235 L237 D251 V252 R256 E257 I258	P235-A254 HydrophobicContact CB-CB 3.98Å; L237-A254 HydrophobicContact CD2-CB 3.96Å; D251-A254 WeakPolarHBondContact O-CB 3.47Å; D251-A254 PolarHBondContact O-N 3.17Å; D251-A254 VanDerWaalsContact O-N 3.17Å; V252-A254 PolarHBondContact O-N 2.79Å; A254-R256 PolarHBondContact O-N 3.45Å; A254-E257 PolarHBondContact O-N 2.82Å; A254-I258 VanDerWaalsContact O-CG1 3.3Å; A254-I258 WeakPolarHBondContact O-CG1 3.39Å; A254-I258 PolarHBondContact O-N 3Å
255	L	96.6	Very high	94.1	Very high	1 Å²	1	49 Å²	49	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-46.6	175.5	176.5	64.7	0	0	0	112	L237 D251 V252 E257 I258 L259 Y317 V325 I340 L348	L237-L255 HydrophobicContact CD1-CD1 4.36Å; L237-L255 HydrophobicContact CD2-CB 3.92Å; D251-L255 WeakPolarHBondContact O-CB 3.47Å; D251-L255 PolarHBondContact O-N 3.36Å; V252-L255 WeakPolarHBondContact O-CB 3.45Å; V252-L255 PolarHBondContact O-N 2.96Å; L255-E257 VanDerWaalsContact C-N 3.32Å; L255-E257 PolarHBondContact O-N 3.29Å; L255-I258 PolarHBondContact O-N 3.45Å; L255-L259 HydrophobicContact CD1-CD1 3.79Å; L255-L259 HydrophobicContact CD1-CG 4.06Å; L255-L259 HydrophobicContact CD2-CD1 4.46Å; L255-L259 HydrophobicContact CG-CD1 3.77Å; L255-L259 HydrophobicContact CG-CG 4.41Å; L255-L259 VanDerWaalsContact O-CG 3.31Å; L255-L259 WeakPolarHBondContact O-CG 3.38Å; L255-L259 PolarHBondContact O-N 2.98Å; L255-Y317 HydrophobicContact CD2-CD2 3.89Å; L255-Y317 HydrophobicContact CD2-CE2 3.76Å; L255-V325 HydrophobicContact CD1-CG2 3.97Å; L255-V325 HydrophobicContact CD2-CG2 4.23Å; L255-I340 HydrophobicContact CD1-CD1 3.66Å; L255-I340 HydrophobicContact CD2-CD1 3.53Å; L255-I340 HydrophobicContact CG-CD1 4.22Å; L255-L348 HydrophobicContact CD1-CD1 3.84Å; L255-L348 HydrophobicContact CD1-CD2 4.3Å
256	R	95.7	Very high	93.1	Very high	82 Å²	82	52.6 Å²	52.6	31%	0.309	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-44.1	179	-173.1	176	-63.4	-86.1	2.3	111	V252 P253 A254 L259 Q260 L265 D318 E320 L321	V252-R256 PolarHBondContact O-N 3.36Å; P253-R256 PolarHBondContact O-N 2.91Å; A254-R256 PolarHBondContact O-N 3.45Å; R256-L259 PolarHBondContact O-N 2.93Å; R256-Q260 WeakPolarHBondContact O-CB 3.37Å; R256-Q260 PolarHBondContact O-N 3.15Å; R256-L265 HydrophobicContact CG-CD1 3.99Å; R256-D318 IonicContact NH2-OD1 3.2Å; R256-D318 IonicContact NH2-OD2 3.26Å; R256-D318 PolarHBondContact NH2-OD2 3.37Å; R256-E320 IonicContact NH1-OE2 3.75Å; R256-E320 PolarHBondContact NH1-OE2 3.35Å; R256-L321 HydrophobicContact CB-CD2 3.92Å; R256-L321 HydrophobicContact CG-CD2 4.07Å
257	E	95.2	Very high	91.4	Very high	83 Å²	83	52.4 Å²	52.4	39%	0.388	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-43.8	176.2	-171.3	-171.7	154.6	0	0	111.9	P235 P253 A254 L255 L259 Q260 R261	P235-E257 HydrophobicContact CB-CB 4.49Å; P235-E257 HydrophobicContact CG-CB 4.03Å; P235-E257 HydrophobicContact CG-CG 3.97Å; P253-E257 PolarHBondContact O-N 3.32Å; A254-E257 PolarHBondContact O-N 2.82Å; L255-E257 VanDerWaalsContact C-N 3.32Å; L255-E257 PolarHBondContact O-N 3.29Å; E257-L259 PolarHBondContact O-N 3.28Å; E257-Q260 PolarHBondContact O-N 3.26Å; E257-R261 HydrophobicContact CG-CG 4.37Å; E257-R261 WeakPolarHBondContact O-CB 3.45Å; E257-R261 WeakPolarHBondContact O-CG 3.38Å; E257-R261 PolarHBondContact O-N 3.28Å; E257-R261 IonicContact OE1-NH1 3.23Å; E257-R261 PolarHBondContact OE1-NH1 2.75Å
258	I	96.2	Very high	89.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-49.9	176	-68.2	167.9	0	0	0	110.7	W234 P235 L237 A254 L255 Q260 R261 T262 L348	W234-I258 HydrophobicContact CZ2-CB 4.41Å; W234-I258 HydrophobicContact CZ2-CG1 4.32Å; W234-I258 HydrophobicContact CZ2-CG2 3.92Å; P235-I258 HydrophobicContact CB-CG1 4.19Å; P235-I258 HydrophobicContact CG-CD1 4.32Å; P235-I258 HydrophobicContact CG-CG1 3.49Å; P235-I258 VanDerWaalsContact CG-CG1 3.49Å; L237-I258 HydrophobicContact CD2-CD1 4.07Å; L237-I258 HydrophobicContact CG-CD1 4.04Å; A254-I258 VanDerWaalsContact O-CG1 3.3Å; A254-I258 WeakPolarHBondContact O-CG1 3.39Å; A254-I258 PolarHBondContact O-N 3Å; L255-I258 PolarHBondContact O-N 3.45Å; I258-Q260 VanDerWaalsContact C-N 3.31Å; I258-Q260 PolarHBondContact O-N 2.8Å; I258-R261 PolarHBondContact O-N 3.46Å; I258-T262 WeakPolarHBondContact O-CB 3.39Å; I258-T262 WeakPolarHBondContact O-CG2 3.39Å; I258-T262 PolarHBondContact O-N 3.4Å; I258-T262 PolarHBondContact O-OG1 3.46Å; I258-L348 HydrophobicContact CD1-CB 4.27Å; I258-L348 HydrophobicContact CG2-CB 4.4Å; I258-L348 HydrophobicContact CG2-CD2 3.52Å
259	L	95.9	Very high	87.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.8	-32.6	-177.6	-65.9	168.9	0	0	0	112	L255 R256 E257 T262 G263 M264 L265 L321 A324 V325 F328 L348	L255-L259 HydrophobicContact CD1-CD1 3.79Å; L255-L259 HydrophobicContact CD1-CG 4.06Å; L255-L259 HydrophobicContact CD2-CD1 4.46Å; L255-L259 HydrophobicContact CG-CD1 3.77Å; L255-L259 HydrophobicContact CG-CG 4.41Å; L255-L259 VanDerWaalsContact O-CG 3.31Å; L255-L259 WeakPolarHBondContact O-CG 3.38Å; L255-L259 PolarHBondContact O-N 2.98Å; R256-L259 PolarHBondContact O-N 2.93Å; E257-L259 PolarHBondContact O-N 3.28Å; L259-T262 WeakPolarHBondContact CA-OG1 3.46Å; L259-T262 PolarHBondContact O-OG1 3.35Å; L259-G263 PolarHBondContact O-N 2.89Å; L259-M264 HydrophobicContact CB-CB 4.27Å; L259-M264 HydrophobicContact CD2-CB 3.93Å; L259-M264 HydrophobicContact CD2-CG 4.35Å; L259-M264 PolarHBondContact O-N 2.94Å; L259-L265 HydrophobicContact CB-CD2 4.09Å; L259-L265 HydrophobicContact CB-CG 3.94Å; L259-L265 PolarHBondContact O-N 3.37Å; L259-L321 HydrophobicContact CD1-CD2 3.87Å; L259-A324 HydrophobicContact CB-CB 4.4Å; L259-A324 HydrophobicContact CD1-CB 3.92Å; L259-A324 HydrophobicContact CD2-CB 4.32Å; L259-A324 HydrophobicContact CG-CB 4.44Å; L259-V325 HydrophobicContact CD1-CG2 3.73Å; L259-V325 HydrophobicContact CD2-CG2 4.19Å; L259-F328 HydrophobicContact CD2-CB 4.06Å; L259-L348 HydrophobicContact CD2-CD2 4.38Å
260	Q	94.2	Very high	84.8	Confident	119 Å²	119	54.6 Å²	54.6	56%	0.556	30%	0.3	S	S	*	.	H	α-helix	trans	-67.7	-49.8	173.1	-167.4	175.1	7.2	0	0	111.4	R256 E257 I258 T262 G263 L265	R256-Q260 WeakPolarHBondContact O-CB 3.37Å; R256-Q260 PolarHBondContact O-N 3.15Å; E257-Q260 PolarHBondContact O-N 3.26Å; I258-Q260 VanDerWaalsContact C-N 3.31Å; I258-Q260 PolarHBondContact O-N 2.8Å; Q260-T262 PolarHBondContact O-N 3.3Å; Q260-G263 PolarHBondContact O-N 2.86Å; Q260-L265 HydrophobicContact CB-CD1 3.73Å; Q260-L265 HydrophobicContact CG-CD1 4.29Å
261	R	93.2	Very high	82.4	Confident	66 Å²	66	55.4 Å²	55.4	25%	0.249	30%	0.303	C	S	.	.	H	α-helix	trans	-66.3	-22.5	-178.9	-71.1	174.1	70.8	173.3	-4.9	113.3	D230 K232 P233 W234 E257 I258	D230-R261 IonicContact OD1-CZ 2.73Å; D230-R261 IonicContact OD1-NH2 3.19Å; D230-R261 PolarHBondContact OD1-NH2 3.29Å; D230-R261 IonicContact OD2-CZ 2.76Å; D230-R261 IonicContact OD2-NE 3.42Å; D230-R261 IonicContact OD2-NH2 3.67Å; D230-R261 PolarHBondContact OD2-NH2 3.32Å; K232-R261 PolarHBondContact O-NH2 3.22Å; P233-R261 PolarHBondContact O-NH1 3.29Å; W234-R261 VanDerWaalsContact CE3-NH2 3.32Å; W234-R261 HydrophobicContact CH2-CB 3.76Å; W234-R261 HydrophobicContact CZ3-CB 3.79Å; W234-R261 HydrophobicContact CZ3-CG 4.47Å; W234-R261 VanDerWaalsContact CZ3-NE 3.29Å; E257-R261 HydrophobicContact CG-CG 4.37Å; E257-R261 WeakPolarHBondContact O-CB 3.45Å; E257-R261 WeakPolarHBondContact O-CG 3.38Å; E257-R261 PolarHBondContact O-N 3.28Å; E257-R261 IonicContact OE1-NH1 3.23Å; E257-R261 PolarHBondContact OE1-NH1 2.75Å; I258-R261 PolarHBondContact O-N 3.46Å
262	T	91.8	Very high	79.6	Confident	30 Å²	30	59.4 Å²	59.4	18%	0.184	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	1.1	173.5	52.9	0	0	0	0	113.7	W234 I258 L259 Q260 M264	W234-T262 HydrophobicContact CH2-CG2 3.93Å; W234-T262 HydrophobicContact CZ2-CG2 4.1Å; I258-T262 WeakPolarHBondContact O-CB 3.39Å; I258-T262 WeakPolarHBondContact O-CG2 3.39Å; I258-T262 PolarHBondContact O-N 3.4Å; I258-T262 PolarHBondContact O-OG1 3.46Å; L259-T262 WeakPolarHBondContact CA-OG1 3.46Å; L259-T262 PolarHBondContact O-OG1 3.35Å; Q260-T262 PolarHBondContact O-N 3.3Å; T262-M264 VanDerWaalsContact C-N 3.3Å; T262-M264 WeakPolarHBondContact O-CE 3.45Å; T262-M264 PolarHBondContact O-N 3.49Å; T262-M264 WeakPolarHBondContact OG1-CG 3.29Å
263	G	91.6	Very high	77.2	Confident	26 Å²	26	62.4 Å²	62.4	27%	0.268	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	16.1	178.7	0	0	0	0	0	114.9	L259 Q260 G268	L259-G263 PolarHBondContact O-N 2.89Å; Q260-G263 PolarHBondContact O-N 2.86Å; G263-G268 VanDerWaalsContact O-CA 3.24Å; G263-G268 WeakPolarHBondContact O-CA 3.35Å; G263-G268 PolarHBondContact O-N 3.06Å
264	M	92.6	Very high	74.6	Confident	21 Å²	21	61.6 Å²	61.6	10%	0.103	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-21.4	-175.1	-62.8	-67.3	142.2	0	0	113.4	L259 T262 A324 R327 F328 W331	L259-M264 HydrophobicContact CB-CB 4.27Å; L259-M264 HydrophobicContact CD2-CB 3.93Å; L259-M264 HydrophobicContact CD2-CG 4.35Å; L259-M264 PolarHBondContact O-N 2.94Å; T262-M264 VanDerWaalsContact C-N 3.3Å; T262-M264 WeakPolarHBondContact O-CE 3.45Å; T262-M264 PolarHBondContact O-N 3.49Å; T262-M264 WeakPolarHBondContact OG1-CG 3.29Å; M264-A324 HydrophobicContact CB-CB 4.22Å; M264-A324 WeakPolarHBondContact O-CB 3.37Å; M264-R327 PolarHBondContact O-NH1 3.29Å; M264-R327 HydrophobicContact SD-CB 3.82Å; M264-F328 HydrophobicContact CG-CB 4.14Å; M264-F328 HydrophobicContact CG-CD2 4.4Å; M264-F328 HydrophobicContact SD-CB 4.36Å; M264-W331 HydrophobicContact CE-CB 4.36Å; M264-W331 HydrophobicContact CE-CD2 3.93Å; M264-W331 HydrophobicContact CE-CE3 3.76Å; M264-W331 HydrophobicContact CE-CG 4.15Å; M264-W331 HydrophobicContact CE-CZ3 4.49Å
265	L	86.6	Confident	72.1	Confident	27 Å²	27	61.3 Å²	61.3	14%	0.141	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-41.7	175.9	-69.2	-179.3	0	0	0	112.4	R256 L259 Q260 G267 L321 A324	R256-L265 HydrophobicContact CG-CD1 3.99Å; L259-L265 HydrophobicContact CB-CD2 4.09Å; L259-L265 HydrophobicContact CB-CG 3.94Å; L259-L265 PolarHBondContact O-N 3.37Å; Q260-L265 HydrophobicContact CB-CD1 3.73Å; Q260-L265 HydrophobicContact CG-CD1 4.29Å; L265-G267 PolarHBondContact O-N 3.31Å; L265-L321 HydrophobicContact CD2-CD2 4Å; L265-A324 HydrophobicContact CD2-CB 3.79Å
266	D	73.5	Confident	69.9	Low	137 Å²	137	64.7 Å²	64.7	73%	0.733	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	16.8	-172.2	-57.6	-43.1	0	0	0	113.8	G268	D266-G268 VanDerWaalsContact C-N 3.32Å
267	G	59.8	Low	67.3	Low	47 Å²	47	68.4 Å²	68.4	49%	0.485	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	38.5	-172.9	0	0	0	0	0	112.1	L265	L265-G267 PolarHBondContact O-N 3.31Å
268	G	51.6	Low	64.4	Low	18 Å²	18	68 Å²	68	19%	0.186	39%	0.385	C	S	.	.			trans	-46.1	161.9	-177.8	0	0	0	0	0	114.3	G263 D266 K270	G263-G268 VanDerWaalsContact O-CA 3.24Å; G263-G268 WeakPolarHBondContact O-CA 3.35Å; G263-G268 PolarHBondContact O-N 3.06Å; D266-G268 VanDerWaalsContact C-N 3.32Å; G268-K270 PolarHBondContact O-N 3.44Å; G268-K270 VanDerWaalsContact O-N 3.14Å
269	P	46.8	Very low	61.6	Low	113 Å²	113	73.7 Å²	73.7	73%	0.734	42%	0.422	S	S	*	.			trans	-49.4	124.2	-165.3	20	-31.9	0	0	0	110.5	I271	P269-I271 PolarHBondContact O-N 3.08Å
270	K	44.6	Very low	58.6	Low	197 Å²	197	80 Å²	80	86%	0.857	46%	0.461	S	S	*	.			trans	-62.2	91.2	166	-79.4	-177.7	177.3	-178.8	0	106.7	G268 T272	G268-K270 PolarHBondContact O-N 3.44Å; G268-K270 VanDerWaalsContact O-N 3.14Å; K270-T272 PolarHBondContact O-N 3.07Å
271	I	44.3	Very low	55.7	Low	97 Å²	97	82.1 Å²	82.1	50%	0.497	48%	0.476	S	S	.	.			trans	-72.7	93.9	165.1	-60.4	166.7	0	0	0	104.1	P269 L273	P269-I271 PolarHBondContact O-N 3.08Å; I271-L273 PolarHBondContact O-N 3Å
272	T	36.8	Very low	52.8	Low	97 Å²	97	82.5 Å²	82.5	60%	0.595	49%	0.494	S	S	*	.			trans	-62.9	105.6	165.8	39.7	0	0	0	0	106.8	K270	K270-T272 PolarHBondContact O-N 3.07Å
273	L	44.7	Very low	49.9	Very low	64 Å²	64	88 Å²	88	34%	0.335	53%	0.526	S	S	.	.			trans	-66.3	145.6	164	-79.4	158.4	0	0	0	107.4	I271 G275 D276 A330	I271-L273 PolarHBondContact O-N 3Å; L273-G275 PolarHBondContact O-N 3.23Å; L273-D276 PolarHBondContact N-OD2 3.14Å; L273-D276 PolarHBondContact O-N 3.12Å; L273-D276 VanDerWaalsContact O-N 3.14Å; L273-A330 WeakPolarHBondContact CD1-O 3.46Å
274	P	38.2	Very low	47.2	Very low	47 Å²	47	92.6 Å²	92.6	31%	0.305	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	115.7	172.2	-23.2	32.3	0	0	0	110.2	V387 D397	P274-V387 HydrophobicContact CB-CG2 3.79Å; P274-V387 HydrophobicContact CG-CG2 4.02Å; P274-D397 VanDerWaalsContact C-CG 3.42Å; P274-D397 VanDerWaalsContact CA-CG 3.42Å; P274-D397 WeakPolarHBondContact CA-OD1 3.44Å; P274-D397 WeakPolarHBondContact CA-OD2 3.15Å; P274-D397 WeakPolarHBondContact CB-OD1 3.34Å; P274-D397 WeakPolarHBondContact CB-OD2 3.14Å
275	G	44.7	Very low	44.2	Very low	16 Å²	16	96.2 Å²	96.2	17%	0.165	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	104.9	10.4	-176.3	0	0	0	0	0	117.8	L273 T278 D397 R399	L273-G275 PolarHBondContact O-N 3.23Å; G275-T278 PolarHBondContact O-OG1 2.99Å; G275-D397 VanDerWaalsContact N-CG 3.29Å; G275-D397 PolarHBondContact N-OD1 2.84Å; G275-D397 PolarHBondContact N-OD2 3.05Å; G275-R399 PolarHBondContact O-NE 3.25Å; G275-R399 PolarHBondContact O-NH2 3.42Å
276	D	49	Very low	41.5	Very low	72 Å²	72	100.8 Å²	100.8	39%	0.385	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	-13.8	-178.8	-90.4	-18.1	0	0	0	115.5	L273 T278	L273-D276 PolarHBondContact N-OD2 3.14Å; L273-D276 PolarHBondContact O-N 3.12Å; L273-D276 VanDerWaalsContact O-N 3.14Å; D276-T278 PolarHBondContact O-N 3.13Å; D276-T278 VanDerWaalsContact O-N 3.13Å
277	D	42.9	Very low	39.5	Very low	159 Å²	159	97.9 Å²	97.9	85%	0.85	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	17.9	-175.8	-66.2	-33.4	0	0	0	115.2
278	T	33.4	Very low	38.1	Very low	76 Å²	76	100.3 Å²	100.3	47%	0.466	61%	0.614	S	S	.	*	S	Bend	trans	-106.9	132.3	178.6	44.9	0	0	0	0	112	G275 D276 T280 R399	G275-T278 PolarHBondContact O-OG1 2.99Å; D276-T278 PolarHBondContact O-N 3.13Å; D276-T278 VanDerWaalsContact O-N 3.13Å; T278-T280 PolarHBondContact O-N 2.91Å; T278-R399 PolarHBondContact OG1-NH2 3.47Å
279	P	36.9	Very low	37.1	Very low	118 Å²	118	104.1 Å²	104.1	77%	0.766	63%	0.633	S	S	*	*			trans	-52.2	133.9	179.9	-23.4	31.5	0	0	0	111.7	D281	P279-D281 VanDerWaalsContact C-N 3.27Å; P279-D281 PolarHBondContact O-N 2.89Å
280	T	33.9	Very low	36.2	Very low	134 Å²	134	104.9 Å²	104.9	82%	0.822	64%	0.636	S	S	*	*	S	Bend	trans	-66.1	78.9	179.3	48.3	0	0	0	0	111.4	T278	T278-T280 PolarHBondContact O-N 2.91Å
281	D	31.9	Very low	35.7	Very low	162 Å²	162	101.7 Å²	101.7	87%	0.866	63%	0.633	S	S	*	*			trans	-149.8	67.9	164.6	-87.1	-35.3	0	0	0	108.8	P279	P279-D281 VanDerWaalsContact C-N 3.27Å; P279-D281 PolarHBondContact O-N 2.89Å
282	A	33.1	Very low	35.1	Very low	75 Å²	75	105.7 Å²	105.7	62%	0.62	65%	0.649	S	S	*	*			trans	-147.2	109.9	167.5	0	0	0	0	0	110.2	V284	A282-V284 PolarHBondContact O-N 2.83Å; A282-V284 VanDerWaalsContact O-N 3.07Å
283	V	31.8	Very low	34.7	Very low	144 Å²	144	107.3 Å²	107.3	87%	0.873	66%	0.659	S	S	*	*			trans	-60.1	105.1	174	178.4	0	0	0	0	109.1	S285	V283-S285 PolarHBondContact O-N 3.5Å
284	V	33.5	Very low	34.1	Very low	123 Å²	123	108.4 Å²	108.4	75%	0.745	68%	0.677	S	S	*	*			trans	-77.6	112.1	166.1	-179.1	0	0	0	0	107.3	A282	A282-V284 PolarHBondContact O-N 2.83Å; A282-V284 VanDerWaalsContact O-N 3.07Å
285	S	30.8	Very low	33.6	Very low	97 Å²	97	115.3 Å²	115.3	68%	0.678	71%	0.706	S	S	*	*			trans	-51.6	126.5	175.7	-84.2	0	0	0	0	111.1	V283 S287	V283-S285 PolarHBondContact O-N 3.5Å; S285-S287 PolarHBondContact O-N 2.78Å
286	P	30.3	Very low	33	Very low	124 Å²	124	121.1 Å²	121.1	81%	0.805	74%	0.738	S	S	*	*			trans	-75.5	101	176.5	30.2	-29.5	0	0	0	108.2
287	S	30.6	Very low	32.4	Very low	75 Å²	75	127 Å²	127	52%	0.524	76%	0.76	S	S	.	*			trans	-126.7	52.8	159.1	-69.9	0	0	0	0	108.9	S285 V289	S285-S287 PolarHBondContact O-N 2.78Å; S287-V289 PolarHBondContact O-N 3.26Å
288	A	30.7	Very low	31.7	Very low	99 Å²	99	125.8 Å²	125.8	82%	0.818	76%	0.761	S	S	*	*			trans	-78	103	157.7	0	0	0	0	0	107.2
289	V	31.1	Very low	31.8	Very low	98 Å²	98	130.3 Å²	130.3	59%	0.594	78%	0.779	S	S	*	*			trans	-69.8	129.9	171.2	170	0	0	0	0	108.2	S287 V291 P405	S287-V289 PolarHBondContact O-N 3.26Å; V289-V291 PolarHBondContact O-N 3.06Å; V289-V291 VanDerWaalsContact O-N 3.16Å; V289-P405 HydrophobicContact CB-CG 4.4Å; V289-P405 HydrophobicContact CG2-CB 4.13Å; V289-P405 HydrophobicContact CG2-CG 3.91Å
290	T	26.6	Very low	31.7	Very low	128 Å²	128	131.6 Å²	131.6	79%	0.785	78%	0.78	S	S	*	*			trans	-51	112.2	164.1	-26.2	0	0	0	0	108.8	E292	T290-E292 PolarHBondContact O-N 2.93Å
291	V	34.5	Very low	31.7	Very low	130 Å²	130	135 Å²	135	79%	0.788	78%	0.783	S	S	*	*			trans	-70.8	116.7	169	175.8	0	0	0	0	106.8	V289 T293	V289-V291 PolarHBondContact O-N 3.06Å; V289-V291 VanDerWaalsContact O-N 3.16Å; V291-T293 PolarHBondContact O-N 2.93Å
292	E	31	Very low	31.9	Very low	182 Å²	182	136 Å²	136	85%	0.85	78%	0.783	S	S	*	*			trans	-56.5	116.8	170.4	-74.8	176.8	154.7	0	0	109.3	T290 A294	T290-E292 PolarHBondContact O-N 2.93Å; E292-A294 PolarHBondContact O-N 2.87Å; E292-A294 VanDerWaalsContact O-N 3.12Å
293	T	28.6	Very low	31.7	Very low	130 Å²	130	139 Å²	139	80%	0.798	79%	0.793	S	S	*	*			trans	-58.9	110	171.8	-40.6	0	0	0	0	108.6	V291 E295	V291-T293 PolarHBondContact O-N 2.93Å; T293-E295 PolarHBondContact O-N 2.9Å; T293-E295 VanDerWaalsContact O-N 3.13Å
294	A	33.5	Very low	31.9	Very low	87 Å²	87	138.3 Å²	138.3	72%	0.719	79%	0.789	S	S	*	*			trans	-63.6	113.6	164.2	0	0	0	0	0	108.1	E292 T296	E292-A294 PolarHBondContact O-N 2.87Å; E292-A294 VanDerWaalsContact O-N 3.12Å; A294-T296 PolarHBondContact O-N 2.78Å; A294-T296 VanDerWaalsContact O-N 3.09Å
295	E	28.1	Very low	31.9	Very low	192 Å²	192	137.7 Å²	137.7	90%	0.897	79%	0.791	S	S	*	*			trans	-49.1	111.8	174.5	-65.7	176.8	149.5	0	0	110.6	T293	T293-E295 PolarHBondContact O-N 2.9Å; T293-E295 VanDerWaalsContact O-N 3.13Å
296	T	32.1	Very low	32.1	Very low	139 Å²	139	145.2 Å²	145.2	85%	0.853	80%	0.804	S	S	*	*			trans	-105	117.9	163.3	10.6	0	0	0	0	108	A294	A294-T296 PolarHBondContact O-N 2.78Å; A294-T296 VanDerWaalsContact O-N 3.09Å
297	K	34.4	Very low	32.5	Very low	195 Å²	195	144.2 Å²	144.2	85%	0.848	80%	0.8	S	S	*	*			trans	-51.4	144.3	177	-75.7	176	173.9	178.3	0	111.3	M299	K297-M299 PolarHBondContact O-N 2.92Å
298	P	29.7	Very low	32.6	Very low	134 Å²	134	150.1 Å²	150.1	87%	0.87	82%	0.816	S	S	*	*			trans	-73.5	121.1	176.2	30.4	-30.3	0	0	0	109
299	M	35.7	Very low	33.1	Very low	171 Å²	171	151 Å²	151	84%	0.842	81%	0.814	S	S	*	*			trans	-114.8	112.8	170.4	-151.4	156.1	76	0	0	109.2	K297	K297-M299 PolarHBondContact O-N 2.92Å
300	D	35.1	Very low	33.8	Very low	145 Å²	145	150.5 Å²	150.5	78%	0.775	82%	0.82	S	S	*	*			trans	56.1	112.2	155.5	-57.9	-36	0	0	0	121.5	Q302	D300-Q302 PolarHBondContact O-N 3.38Å
301	K	32.5	Very low	35	Very low	206 Å²	206	149.9 Å²	149.9	90%	0.896	82%	0.818	S	S	*	*			trans	-59.8	113.6	163	-71.1	173	177.7	173.7	0	109.5
302	Q	36.4	Very low	36.2	Very low	183 Å²	183	147.3 Å²	147.3	86%	0.855	81%	0.811	S	S	*	*			trans	-116.2	109.3	159.6	-146.3	157.3	-4.6	0	0	110.2	D300 T304	D300-Q302 PolarHBondContact O-N 3.38Å; Q302-T304 PolarHBondContact O-N 3.31Å
303	T	28.4	Very low	38	Very low	137 Å²	137	143.5 Å²	143.5	84%	0.84	80%	0.799	S	S	*	*			trans	-59.9	111.6	-179.5	-42.4	0	0	0	0	110.6
304	T	35.9	Very low	40.6	Very low	129 Å²	129	145.2 Å²	145.2	79%	0.791	79%	0.791	S	S	*	*			trans	-133.3	114.5	163.8	50.3	0	0	0	0	110.6	Q302	Q302-T304 PolarHBondContact O-N 3.31Å
305	S	34.6	Very low	43.3	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	77%	0.769	S	S	*	*			trans	32.9	96.3	154.4	176.3	0	0	0	0	118.3	S307	S305-S307 PolarHBondContact O-N 3.38Å; S305-S307 VanDerWaalsContact O-N 3.09Å
306	R	33.5	Very low	46.4	Very low	254 Å²	254	134.9 Å²	134.9	96%	0.958	74%	0.738	S	S	*	*			trans	-64.9	102.3	161.2	-85	177.8	174.8	154.2	-1.9	110.3
307	S	39.5	Very low	49.4	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-72.6	134.6	153.1	48.4	0	0	0	0	109	S305	S305-S307 PolarHBondContact O-N 3.38Å; S305-S307 VanDerWaalsContact O-N 3.09Å
308	K	32.1	Very low	52.3	Low	198 Å²	198	121.7 Å²	121.7	86%	0.861	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.6	125.6	178.7	-171.4	177.4	-177.4	179.6	0	109.4	A310	K308-A310 PolarHBondContact O-N 2.91Å
309	P	41.9	Very low	55.4	Low	119 Å²	119	121.5 Å²	121.5	77%	0.773	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-67.7	131.1	179.7	26.3	-30.4	0	0	0	109.4
310	A	46.6	Very low	58.2	Low	87 Å²	87	118.5 Å²	118.5	72%	0.719	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-56.4	145.6	168.2	0	0	0	0	0	109.6	K308 A312	K308-A310 PolarHBondContact O-N 2.91Å; A310-A312 PolarHBondContact O-N 3.26Å
311	P	49.9	Very low	61.1	Low	115 Å²	115	111.6 Å²	111.6	75%	0.747	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-55.4	129.2	179.5	22	-31.3	0	0	0	109.9	V313	P311-V313 PolarHBondContact O-N 3.49Å
312	A	59.8	Low	64.2	Low	76 Å²	76	102.1 Å²	102.1	63%	0.628	57%	0.57	S	S	*	*			trans	-64.3	98.4	-180	0	0	0	0	0	109.8	A310 R314	A310-A312 PolarHBondContact O-N 3.26Å; A312-R314 PolarHBondContact O-N 3.02Å
313	V	69.4	Low	67	Low	101 Å²	101	97.4 Å²	97.4	61%	0.612	55%	0.548	S	S	*	.			trans	-76.5	108.9	175.6	-176.7	0	0	0	0	107.8	P311 A315	P311-V313 PolarHBondContact O-N 3.49Å; V313-A315 PolarHBondContact O-N 3.36Å
314	R	83.8	Confident	70.3	Confident	167 Å²	167	90.9 Å²	90.9	63%	0.63	51%	0.508	S	S	*	.			trans	-63	130.7	167.4	-78.8	-177.7	171.3	-172	-1.4	108.8	W248 N250 A312	W248-R314 HydrophobicContact CE3-CB 4.17Å; W248-R314 WeakPolarHBondContact CZ3-O 3.47Å; N250-R314 WeakPolarHBondContact OD1-CG 3.43Å; N250-R314 PolarHBondContact OD1-NE 2.81Å; A312-R314 PolarHBondContact O-N 3.02Å
315	A	90.2	Very high	73.2	Confident	30 Å²	30	84.7 Å²	84.7	25%	0.248	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	157.1	171.7	0	0	0	0	0	110.2	W248 S249 V252 V313	W248-A315 WeakPolarHBondContact CA-O 3.14Å; W248-A315 VanDerWaalsContact CE3-C 3.41Å; S249-A315 PolarHBondContact N-O 3.42Å; S249-A315 PolarHBondContact O-N 3.04Å; V252-A315 HydrophobicContact CB-CB 3.87Å; V252-A315 HydrophobicContact CG1-CB 3.58Å; V252-A315 WeakPolarHBondContact CG2-O 3.36Å; V313-A315 PolarHBondContact O-N 3.36Å
316	A	93.2	Very high	76.2	Confident	31 Å²	31	82.5 Å²	82.5	26%	0.256	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	138.6	175.9	0	0	0	0	0	110.4	W248 D318	W248-A316 HydrophobicContact CD2-CB 4.04Å; W248-A316 HydrophobicContact CE3-CB 4.47Å; W248-A316 HydrophobicContact CG-CB 4.48Å; W248-A316 HydrophobicContact CH2-CB 4.38Å; W248-A316 HydrophobicContact CZ2-CB 3.92Å; A316-D318 VanDerWaalsContact C-N 3.28Å; A316-D318 PolarHBondContact O-N 3.04Å
317	Y	95.6	Very high	79.2	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	42%	0.419	C	S	.	.			trans	-78.7	82.7	168.4	-177	-147.5	0	0	0	109.2	L243 R244 P245 G246 Q247 L255 L321 V322 V325 G338	L243-Y317 HydrophobicContact CD2-CD1 4.03Å; L243-Y317 HydrophobicContact CD2-CG 4.04Å; L243-Y317 HydrophobicContact CG-CD1 3.78Å; L243-Y317 HydrophobicContact CG-CE1 4.39Å; L243-Y317 HydrophobicContact CG-CG 4.23Å; R244-Y317 WeakPolarHBondContact O-CD1 3.03Å; P245-Y317 HydrophobicContact CG-CE1 4.43Å; G246-Y317 WeakPolarHBondContact CA-O 2.82Å; G246-Y317 PolarHBondContact N-O 3.32Å; Q247-Y317 WeakPolarHBondContact O-CB 3.44Å; Q247-Y317 PolarHBondContact O-N 3.09Å; L255-Y317 HydrophobicContact CD2-CD2 3.89Å; L255-Y317 HydrophobicContact CD2-CE2 3.76Å; Y317-L321 HydrophobicContact CD2-CB 3.59Å; Y317-L321 HydrophobicContact CD2-CD1 4.26Å; Y317-L321 HydrophobicContact CE2-CB 3.63Å; Y317-V322 HydrophobicContact CD1-CG2 4.02Å; Y317-V322 HydrophobicContact CD2-CG2 4.05Å; Y317-V322 HydrophobicContact CE1-CG2 3.68Å; Y317-V322 HydrophobicContact CE2-CB 4.38Å; Y317-V322 HydrophobicContact CE2-CG2 3.71Å; Y317-V322 HydrophobicContact CG-CG2 4.19Å; Y317-V322 VanDerWaalsContact CZ-CG2 3.49Å; Y317-V325 HydrophobicContact CE2-CG2 3.99Å; Y317-V325 WeakPolarHBondContact OH-CB 3.47Å; Y317-V325 WeakPolarHBondContact OH-CG1 3.43Å; Y317-V325 VanDerWaalsContact OH-CG2 3.25Å; Y317-V325 WeakPolarHBondContact OH-CG2 3.33Å; Y317-G338 VanDerWaalsContact CE1-O 3.22Å; Y317-G338 WeakPolarHBondContact CE1-O 3.36Å; Y317-G338 PolarHBondContact OH-O 2.98Å
318	D	94.8	Very high	81.9	Confident	57 Å²	57	70.2 Å²	70.2	31%	0.305	38%	0.384	S	S	.	.			trans	-71.5	170.8	-175.7	61.6	31.4	0	0	0	113.4	R256 A316 E320 L321 V322	R256-D318 IonicContact NH2-OD1 3.2Å; R256-D318 IonicContact NH2-OD2 3.26Å; R256-D318 PolarHBondContact NH2-OD2 3.37Å; A316-D318 VanDerWaalsContact C-N 3.28Å; A316-D318 PolarHBondContact O-N 3.04Å; D318-E320 VanDerWaalsContact C-N 3.29Å; D318-E320 PolarHBondContact O-N 3.29Å; D318-E320 PolarHBondContact OD1-N 2.89Å; D318-L321 PolarHBondContact O-N 3.45Å; D318-L321 WeakPolarHBondContact OD1-CB 3.41Å; D318-L321 VanDerWaalsContact OD1-CG 3.23Å; D318-L321 WeakPolarHBondContact OD1-CG 3.2Å; D318-L321 PolarHBondContact OD1-N 2.91Å; D318-V322 WeakPolarHBondContact O-CG2 3.46Å; D318-V322 PolarHBondContact O-N 3.36Å
319	N	94.4	Very high	85	Confident	130 Å²	130	60.9 Å²	60.9	70%	0.695	34%	0.344	S	S	*	.	H	α-helix	trans	-64.4	-31.4	-176.7	-69.9	-15.6	0	0	0	113.3	V322 E323	N319-V322 PolarHBondContact O-N 3.19Å; N319-E323 WeakPolarHBondContact O-CG 3.32Å; N319-E323 PolarHBondContact O-N 3.43Å
320	E	94.8	Very high	87.4	Confident	108 Å²	108	56.9 Å²	56.9	51%	0.505	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-49.3	177.2	179.8	-169.9	-148.8	0	0	110.5	R256 D318 V322 E323 A324	R256-E320 IonicContact NH1-OE2 3.75Å; R256-E320 PolarHBondContact NH1-OE2 3.35Å; D318-E320 VanDerWaalsContact C-N 3.29Å; D318-E320 PolarHBondContact O-N 3.29Å; D318-E320 PolarHBondContact OD1-N 2.89Å; E320-V322 VanDerWaalsContact C-N 3.31Å; E320-V322 PolarHBondContact O-N 3.39Å; E320-E323 PolarHBondContact O-N 2.95Å; E320-A324 PolarHBondContact O-N 3.46Å
321	L	95.7	Very high	89.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-39.1	175.7	-69.8	173.7	0	0	0	111.4	V252 R256 L259 L265 Y317 D318 E323 A324 V325	V252-L321 HydrophobicContact CG1-CD1 3.63Å; R256-L321 HydrophobicContact CB-CD2 3.92Å; R256-L321 HydrophobicContact CG-CD2 4.07Å; L259-L321 HydrophobicContact CD1-CD2 3.87Å; L265-L321 HydrophobicContact CD2-CD2 4Å; Y317-L321 HydrophobicContact CD2-CB 3.59Å; Y317-L321 HydrophobicContact CD2-CD1 4.26Å; Y317-L321 HydrophobicContact CE2-CB 3.63Å; D318-L321 PolarHBondContact O-N 3.45Å; D318-L321 WeakPolarHBondContact OD1-CB 3.41Å; D318-L321 VanDerWaalsContact OD1-CG 3.23Å; D318-L321 WeakPolarHBondContact OD1-CG 3.2Å; D318-L321 PolarHBondContact OD1-N 2.91Å; L321-E323 PolarHBondContact O-N 3.34Å; L321-A324 PolarHBondContact O-N 3.03Å; L321-V325 WeakPolarHBondContact O-CG2 3.29Å; L321-V325 PolarHBondContact O-N 3.35Å
322	V	97	Very high	91.7	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-46.3	177.2	171.5	0	0	0	0	111.2	P245 Y317 D318 N319 E320 V325 K326	P245-V322 HydrophobicContact CB-CG1 4.35Å; P245-V322 HydrophobicContact CB-CG2 3.68Å; P245-V322 HydrophobicContact CG-CG1 3.96Å; P245-V322 HydrophobicContact CG-CG2 3.89Å; Y317-V322 HydrophobicContact CD1-CG2 4.02Å; Y317-V322 HydrophobicContact CD2-CG2 4.05Å; Y317-V322 HydrophobicContact CE1-CG2 3.68Å; Y317-V322 HydrophobicContact CE2-CB 4.38Å; Y317-V322 HydrophobicContact CE2-CG2 3.71Å; Y317-V322 HydrophobicContact CG-CG2 4.19Å; Y317-V322 VanDerWaalsContact CZ-CG2 3.49Å; D318-V322 WeakPolarHBondContact O-CG2 3.46Å; D318-V322 PolarHBondContact O-N 3.36Å; N319-V322 PolarHBondContact O-N 3.19Å; E320-V322 VanDerWaalsContact C-N 3.31Å; E320-V322 PolarHBondContact O-N 3.39Å; V322-V325 PolarHBondContact O-N 3.23Å; V322-K326 WeakPolarHBondContact O-CG 3.33Å; V322-K326 PolarHBondContact O-N 2.99Å
323	E	96.2	Very high	93.1	Very high	84 Å²	84	52.6 Å²	52.6	39%	0.393	28%	0.275	S	S	.	.	H	α-helix	trans	-66.6	-37.2	177.8	-68.6	-55.4	123.5	0	0	112.2	N319 E320 L321 K326 R327	N319-E323 WeakPolarHBondContact O-CG 3.32Å; N319-E323 PolarHBondContact O-N 3.43Å; E320-E323 PolarHBondContact O-N 2.95Å; L321-E323 PolarHBondContact O-N 3.34Å; E323-K326 PolarHBondContact O-N 3.02Å; E323-K326 IonicContact OE1-NZ 4Å; E323-K326 PolarHBondContact OE1-NZ 3.29Å; E323-R327 WeakPolarHBondContact O-CG 3.32Å; E323-R327 PolarHBondContact O-N 2.84Å
324	A	96.7	Very high	94.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.7	-38.6	173.4	0	0	0	0	0	112.6	L259 M264 L265 E320 L321 R327 F328	L259-A324 HydrophobicContact CB-CB 4.4Å; L259-A324 HydrophobicContact CD1-CB 3.92Å; L259-A324 HydrophobicContact CD2-CB 4.32Å; L259-A324 HydrophobicContact CG-CB 4.44Å; M264-A324 HydrophobicContact CB-CB 4.22Å; M264-A324 WeakPolarHBondContact O-CB 3.37Å; L265-A324 HydrophobicContact CD2-CB 3.79Å; E320-A324 PolarHBondContact O-N 3.46Å; L321-A324 PolarHBondContact O-N 3.03Å; A324-R327 PolarHBondContact O-N 3.49Å; A324-F328 PolarHBondContact O-N 2.95Å
325	V	97.3	Very high	94.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.2	-38.9	173.5	170.2	0	0	0	0	111.4	L255 L259 Y317 L321 V322 R327 F328 Q329 I340 T344	L255-V325 HydrophobicContact CD1-CG2 3.97Å; L255-V325 HydrophobicContact CD2-CG2 4.23Å; L259-V325 HydrophobicContact CD1-CG2 3.73Å; L259-V325 HydrophobicContact CD2-CG2 4.19Å; Y317-V325 HydrophobicContact CE2-CG2 3.99Å; Y317-V325 WeakPolarHBondContact OH-CB 3.47Å; Y317-V325 WeakPolarHBondContact OH-CG1 3.43Å; Y317-V325 VanDerWaalsContact OH-CG2 3.25Å; Y317-V325 WeakPolarHBondContact OH-CG2 3.33Å; L321-V325 WeakPolarHBondContact O-CG2 3.29Å; L321-V325 PolarHBondContact O-N 3.35Å; V322-V325 PolarHBondContact O-N 3.23Å; V325-R327 VanDerWaalsContact C-N 3.33Å; V325-R327 PolarHBondContact O-N 3.06Å; V325-F328 CarbonylContact O-C 3.52Å; V325-F328 WeakPolarHBondContact O-CB 3.3Å; V325-F328 PolarHBondContact O-N 2.96Å; V325-Q329 HydrophobicContact CG1-CG 4.12Å; V325-Q329 WeakPolarHBondContact O-CB 3.23Å; V325-Q329 WeakPolarHBondContact O-CG 3.35Å; V325-Q329 PolarHBondContact O-N 2.97Å; V325-I340 HydrophobicContact CG1-CG1 4.04Å; V325-I340 HydrophobicContact CG2-CD1 4.1Å; V325-I340 HydrophobicContact CG2-CG1 4.44Å; V325-T344 HydrophobicContact CG1-CG2 4.32Å
326	K	97.3	Very high	94.8	Very high	65 Å²	65	45.5 Å²	45.5	28%	0.283	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-42.3	174.2	-73.1	-179.8	-175.6	166	0	111.9	V322 E323 Q329 A330 A336	V322-K326 WeakPolarHBondContact O-CG 3.33Å; V322-K326 PolarHBondContact O-N 2.99Å; E323-K326 PolarHBondContact O-N 3.02Å; E323-K326 IonicContact OE1-NZ 4Å; E323-K326 PolarHBondContact OE1-NZ 3.29Å; K326-Q329 PolarHBondContact O-N 2.98Å; K326-A330 WeakPolarHBondContact O-CB 3.31Å; K326-A330 PolarHBondContact O-N 2.76Å; K326-A336 HydrophobicContact CB-CB 4.23Å; K326-A336 WeakPolarHBondContact CG-O 3.33Å
327	R	96.3	Very high	94.9	Very high	99 Å²	99	48.9 Å²	48.9	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-44.6	172.5	-67	177.6	-159.4	119.4	7.2	111.5	M264 E323 A324 V325 A330 W331	M264-R327 PolarHBondContact O-NH1 3.29Å; M264-R327 HydrophobicContact SD-CB 3.82Å; E323-R327 WeakPolarHBondContact O-CG 3.32Å; E323-R327 PolarHBondContact O-N 2.84Å; A324-R327 PolarHBondContact O-N 3.49Å; V325-R327 VanDerWaalsContact C-N 3.33Å; V325-R327 PolarHBondContact O-N 3.06Å; R327-A330 PolarHBondContact O-N 3.34Å; R327-W331 VanDerWaalsContact O-CB 3.29Å; R327-W331 WeakPolarHBondContact O-CB 3.41Å; R327-W331 PolarHBondContact O-N 2.93Å
328	F	96.6	Very high	94.9	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-44.9	176.2	-180	-89.2	0	0	0	112	L259 M264 A324 V325 W331 Q332 T344 W347 L348	L259-F328 HydrophobicContact CD2-CB 4.06Å; M264-F328 HydrophobicContact CG-CB 4.14Å; M264-F328 HydrophobicContact CG-CD2 4.4Å; M264-F328 HydrophobicContact SD-CB 4.36Å; A324-F328 PolarHBondContact O-N 2.95Å; V325-F328 CarbonylContact O-C 3.52Å; V325-F328 WeakPolarHBondContact O-CB 3.3Å; V325-F328 PolarHBondContact O-N 2.96Å; F328-W331 AromaticContact CD2-CE3 3.9Å; F328-W331 HydrophobicContact CD2-CE3 3.9Å; F328-W331 HydrophobicContact CD2-CZ3 4.14Å; F328-W331 HydrophobicContact CE2-CE3 4.03Å; F328-W331 AromaticContact CE2-CZ3 3.88Å; F328-W331 HydrophobicContact CE2-CZ3 3.88Å; F328-W331 PolarHBondContact O-N 3.36Å; F328-Q332 HydrophobicContact CD1-CG 4.08Å; F328-Q332 HydrophobicContact CE1-CG 3.58Å; F328-Q332 HydrophobicContact CE2-CG 4.22Å; F328-Q332 HydrophobicContact CZ-CG 3.66Å; F328-Q332 WeakPolarHBondContact O-CG 3.43Å; F328-Q332 PolarHBondContact O-N 3.19Å; F328-T344 HydrophobicContact CD1-CG2 4.46Å; F328-W347 HydrophobicContact CE1-CB 3.94Å; F328-W347 HydrophobicContact CZ-CB 4.02Å; F328-L348 HydrophobicContact CD1-CD2 3.74Å; F328-L348 HydrophobicContact CD1-CG 4.09Å; F328-L348 HydrophobicContact CD2-CD2 4.04Å; F328-L348 HydrophobicContact CE1-CD2 3.6Å; F328-L348 HydrophobicContact CE1-CG 3.65Å; F328-L348 HydrophobicContact CE2-CD2 3.91Å; F328-L348 HydrophobicContact CG-CD2 3.96Å; F328-L348 HydrophobicContact CZ-CD2 3.69Å; F328-L348 HydrophobicContact CZ-CG 3.99Å
329	Q	96.8	Very high	95	Very high	1 Å²	1	47 Å²	47	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-49.7	177.5	-77.4	172.9	-37.1	0	0	110.6	V325 K326 W331 Q332 G333 L334 G335 A336 D337 A339 T344	V325-Q329 HydrophobicContact CG1-CG 4.12Å; V325-Q329 WeakPolarHBondContact O-CB 3.23Å; V325-Q329 WeakPolarHBondContact O-CG 3.35Å; V325-Q329 PolarHBondContact O-N 2.97Å; K326-Q329 PolarHBondContact O-N 2.98Å; Q329-W331 VanDerWaalsContact C-N 3.33Å; Q329-W331 PolarHBondContact O-N 2.88Å; Q329-Q332 CarbonylContact O-C 3.37Å; Q329-Q332 PolarHBondContact O-N 3.47Å; Q329-Q332 VanDerWaalsContact O-N 3.16Å; Q329-G333 PolarHBondContact O-N 2.75Å; Q329-G333 VanDerWaalsContact O-N 3.13Å; Q329-L334 CarbonylContact C-O 3.53Å; Q329-L334 HydrophobicContact CB-CB 4.03Å; Q329-L334 HydrophobicContact CG-CB 4.3Å; Q329-L334 WeakPolarHBondContact O-CA 3.45Å; Q329-L334 WeakPolarHBondContact O-CB 3.34Å; Q329-L334 PolarHBondContact O-N 3.26Å; Q329-G335 VanDerWaalsContact CD-O 3.25Å; Q329-G335 PolarHBondContact NE2-O 3.35Å; Q329-G335 PolarHBondContact OE1-O 3.44Å; Q329-A336 HydrophobicContact CB-CB 4.36Å; Q329-D337 PolarHBondContact NE2-OD1 3Å; Q329-D337 VanDerWaalsContact OE1-N 3.16Å; Q329-A339 PolarHBondContact NE2-O 3.27Å; Q329-T344 HydrophobicContact CG-CG2 3.77Å; Q329-T344 PolarHBondContact NE2-OG1 3.18Å
330	A	93.7	Very high	95.2	Very high	36 Å²	36	41 Å²	41	30%	0.298	24%	0.237	S	C	.	.	H	α-helix	trans	-57.8	-45.1	174.8	0	0	0	0	0	111.7	L273 K326 R327 Q332 G333 A336	L273-A330 WeakPolarHBondContact CD1-O 3.46Å; K326-A330 WeakPolarHBondContact O-CB 3.31Å; K326-A330 PolarHBondContact O-N 2.76Å; R327-A330 PolarHBondContact O-N 3.34Å; A330-Q332 VanDerWaalsContact C-N 3.28Å; A330-Q332 PolarHBondContact O-N 2.93Å; A330-G333 PolarHBondContact O-N 2.94Å; A330-A336 HydrophobicContact CB-CB 4.42Å
331	W	92.6	Very high	95.3	Very high	94 Å²	94	36.5 Å²	36.5	36%	0.356	22%	0.22	S	C	.	.	H	α-helix	trans	-60.9	-32.8	177.4	179.1	52.9	0	0	0	113.4	M264 R327 F328 Q329	M264-W331 HydrophobicContact CE-CB 4.36Å; M264-W331 HydrophobicContact CE-CD2 3.93Å; M264-W331 HydrophobicContact CE-CE3 3.76Å; M264-W331 HydrophobicContact CE-CG 4.15Å; M264-W331 HydrophobicContact CE-CZ3 4.49Å; R327-W331 VanDerWaalsContact O-CB 3.29Å; R327-W331 WeakPolarHBondContact O-CB 3.41Å; R327-W331 PolarHBondContact O-N 2.93Å; F328-W331 AromaticContact CD2-CE3 3.9Å; F328-W331 HydrophobicContact CD2-CE3 3.9Å; F328-W331 HydrophobicContact CD2-CZ3 4.14Å; F328-W331 HydrophobicContact CE2-CE3 4.03Å; F328-W331 AromaticContact CE2-CZ3 3.88Å; F328-W331 HydrophobicContact CE2-CZ3 3.88Å; F328-W331 PolarHBondContact O-N 3.36Å; Q329-W331 VanDerWaalsContact C-N 3.33Å; Q329-W331 PolarHBondContact O-N 2.88Å
332	Q	93.1	Very high	95.3	Very high	33 Å²	33	40.4 Å²	40.4	15%	0.154	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.7	174.8	-62.3	-53.7	-58.6	0	0	113.9	F328 Q329 A330 L334 W347 R355	F328-Q332 HydrophobicContact CD1-CG 4.08Å; F328-Q332 HydrophobicContact CE1-CG 3.58Å; F328-Q332 HydrophobicContact CE2-CG 4.22Å; F328-Q332 HydrophobicContact CZ-CG 3.66Å; F328-Q332 WeakPolarHBondContact O-CG 3.43Å; F328-Q332 PolarHBondContact O-N 3.19Å; Q329-Q332 CarbonylContact O-C 3.37Å; Q329-Q332 PolarHBondContact O-N 3.47Å; Q329-Q332 VanDerWaalsContact O-N 3.16Å; A330-Q332 VanDerWaalsContact C-N 3.28Å; A330-Q332 PolarHBondContact O-N 2.93Å; Q332-L334 VanDerWaalsContact C-N 3.3Å; Q332-L334 HydrophobicContact CB-CD1 4.11Å; Q332-L334 HydrophobicContact CB-CG 3.97Å; Q332-L334 PolarHBondContact O-N 3.36Å; Q332-W347 HydrophobicContact CG-CB 4.24Å; Q332-W347 HydrophobicContact CG-CD2 4.47Å; Q332-W347 HydrophobicContact CG-CG 4.3Å; Q332-R355 VanDerWaalsContact NE2-NH1 3.18Å
333	G	90.7	Very high	95.2	Very high	60 Å²	60	42.6 Å²	42.6	62%	0.619	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	23.8	-174.3	0	0	0	0	0	114.1	Q329 A330	Q329-G333 PolarHBondContact O-N 2.75Å; Q329-G333 VanDerWaalsContact O-N 3.13Å; A330-G333 PolarHBondContact O-N 2.94Å
334	L	92.9	Very high	95.3	Very high	41 Å²	41	39 Å²	39	22%	0.215	25%	0.248	C	C	.	.	S	Bend	trans	-92.7	158	173.8	-55.6	175.6	0	0	0	110.3	Q329 Q332 A336 A343 T344	Q329-L334 CarbonylContact C-O 3.53Å; Q329-L334 HydrophobicContact CB-CB 4.03Å; Q329-L334 HydrophobicContact CG-CB 4.3Å; Q329-L334 WeakPolarHBondContact O-CA 3.45Å; Q329-L334 WeakPolarHBondContact O-CB 3.34Å; Q329-L334 PolarHBondContact O-N 3.26Å; Q332-L334 VanDerWaalsContact C-N 3.3Å; Q332-L334 HydrophobicContact CB-CD1 4.11Å; Q332-L334 HydrophobicContact CB-CG 3.97Å; Q332-L334 PolarHBondContact O-N 3.36Å; L334-A336 PolarHBondContact O-N 3.27Å; L334-A343 HydrophobicContact CD2-CB 4.45Å; L334-T344 HydrophobicContact CD1-CG2 4.44Å
335	G	90.6	Very high	95.3	Very high	59 Å²	59	40 Å²	40	61%	0.608	25%	0.252	S	S	*	.			trans	-60.8	121.8	170.9	0	0	0	0	0	111.1	Q329 D337	Q329-G335 VanDerWaalsContact CD-O 3.25Å; Q329-G335 PolarHBondContact NE2-O 3.35Å; Q329-G335 PolarHBondContact OE1-O 3.44Å; G335-D337 PolarHBondContact O-N 3.44Å
336	A	94.1	Very high	95.3	Very high	50 Å²	50	45 Å²	45	41%	0.413	28%	0.278	S	S	.	.			trans	-80.6	56.6	-175.5	0	0	0	0	0	113	K326 Q329 A330 L334	K326-A336 HydrophobicContact CB-CB 4.23Å; K326-A336 WeakPolarHBondContact CG-O 3.33Å; Q329-A336 HydrophobicContact CB-CB 4.36Å; A330-A336 HydrophobicContact CB-CB 4.42Å; L334-A336 PolarHBondContact O-N 3.27Å
337	D	95.5	Very high	95.3	Very high	102 Å²	102	46.3 Å²	46.3	55%	0.545	28%	0.281	S	S	.	.	S	Bend	trans	-86.8	-10	-179	68.3	-2.3	0	0	0	113.8	Q329 G335 A339	Q329-D337 PolarHBondContact NE2-OD1 3Å; Q329-D337 VanDerWaalsContact OE1-N 3.16Å; G335-D337 PolarHBondContact O-N 3.44Å; D337-A339 PolarHBondContact O-N 3.13Å; D337-A339 PolarHBondContact OD1-N 3.5Å
338	G	96.3	Very high	95.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	73.5	2	-175	0	0	0	0	0	114.3	Y317	Y317-G338 VanDerWaalsContact CE1-O 3.22Å; Y317-G338 WeakPolarHBondContact CE1-O 3.36Å; Y317-G338 PolarHBondContact OH-O 2.98Å
339	A	97.4	Very high	95.3	Very high	18 Å²	18	42.9 Å²	42.9	15%	0.149	27%	0.271	C	S	.	.			trans	-90	124.8	176.8	0	0	0	0	0	110.9	T242 Q329 D337 G341	T242-A339 HydrophobicContact CG2-CB 4.24Å; Q329-A339 PolarHBondContact NE2-O 3.27Å; D337-A339 PolarHBondContact O-N 3.13Å; D337-A339 PolarHBondContact OD1-N 3.5Å; A339-G341 VanDerWaalsContact C-N 3.33Å; A339-G341 PolarHBondContact O-N 3.42Å
340	I	97.7	Very high	95.3	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-86.9	80.2	178.2	-49.1	-179.7	0	0	0	109.1	L237 T242 L243 L255 V325 T344 R345 L348	L237-I340 HydrophobicContact CD1-CG2 4.29Å; T242-I340 WeakPolarHBondContact CA-O 3.39Å; L243-I340 HydrophobicContact CB-CB 4.17Å; L243-I340 HydrophobicContact CD2-CD1 4.17Å; L243-I340 PolarHBondContact N-O 3.29Å; L243-I340 VanDerWaalsContact N-O 3.16Å; L243-I340 PolarHBondContact O-N 3.35Å; L255-I340 HydrophobicContact CD1-CD1 3.66Å; L255-I340 HydrophobicContact CD2-CD1 3.53Å; L255-I340 HydrophobicContact CG-CD1 4.22Å; V325-I340 HydrophobicContact CG1-CG1 4.04Å; V325-I340 HydrophobicContact CG2-CD1 4.1Å; V325-I340 HydrophobicContact CG2-CG1 4.44Å; I340-T344 HydrophobicContact CG2-CG2 4.26Å; I340-R345 HydrophobicContact CG2-CB 4.01Å; I340-R345 PolarHBondContact O-NH2 3.16Å; I340-R345 VanDerWaalsContact O-NH2 3.16Å; I340-L348 HydrophobicContact CD1-CD1 4.09Å; I340-L348 HydrophobicContact CG1-CD1 4.49Å; I340-L348 HydrophobicContact CG2-CD1 3.94Å
341	G	96.9	Very high	95.5	Very high	15 Å²	15	44.1 Å²	44.1	16%	0.155	28%	0.275	C	S	.	.			trans	-76.5	-176.5	167.4	0	0	0	0	0	112.6	A339 A343 T344 R345	A339-G341 VanDerWaalsContact C-N 3.33Å; A339-G341 PolarHBondContact O-N 3.42Å; G341-A343 PolarHBondContact O-N 2.8Å; G341-T344 PolarHBondContact O-N 3.37Å; G341-R345 WeakPolarHBondContact O-CB 3.49Å; G341-R345 PolarHBondContact O-N 2.92Å
342	P	96.3	Very high	95.6	Very high	82 Å²	82	40.2 Å²	40.2	53%	0.532	26%	0.261	S	S	.	.	H	α-helix	trans	-54	-48.3	-179.7	-27.2	35.5	0	0	0	113.6	T344 R345 D346	P342-T344 PolarHBondContact O-N 3.17Å; P342-R345 WeakPolarHBondContact O-CB 3.43Å; P342-R345 PolarHBondContact O-N 3.17Å; P342-D346 PolarHBondContact O-N 3.5Å
343	A	95.2	Very high	95.7	Very high	52 Å²	52	42.1 Å²	42.1	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-46.1	-177.4	0	0	0	0	0	113.2	L334 G341 R345 D346 W347	L334-A343 HydrophobicContact CD2-CB 4.45Å; G341-A343 PolarHBondContact O-N 2.8Å; A343-R345 VanDerWaalsContact C-N 3.32Å; A343-R345 PolarHBondContact O-N 3.41Å; A343-D346 PolarHBondContact O-N 3.06Å; A343-W347 VanDerWaalsContact O-CD1 3.31Å; A343-W347 PolarHBondContact O-N 3.3Å
344	T	97.1	Very high	95.9	Very high	10 Å²	10	44.6 Å²	44.6	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-40	176.1	-53.3	0	0	0	0	111.1	V325 F328 Q329 L334 I340 G341 P342 W347 L348	V325-T344 HydrophobicContact CG1-CG2 4.32Å; F328-T344 HydrophobicContact CD1-CG2 4.46Å; Q329-T344 HydrophobicContact CG-CG2 3.77Å; Q329-T344 PolarHBondContact NE2-OG1 3.18Å; L334-T344 HydrophobicContact CD1-CG2 4.44Å; I340-T344 HydrophobicContact CG2-CG2 4.26Å; G341-T344 PolarHBondContact O-N 3.37Å; P342-T344 PolarHBondContact O-N 3.17Å; T344-W347 PolarHBondContact O-N 3.03Å; T344-L348 HydrophobicContact CG2-CD1 3.92Å; T344-L348 HydrophobicContact CG2-CG 4.43Å; T344-L348 VanDerWaalsContact O-CG 3.31Å; T344-L348 WeakPolarHBondContact O-CG 3.49Å; T344-L348 PolarHBondContact O-N 3.38Å
345	R	97.6	Very high	96.1	Very high	21 Å²	21	44.3 Å²	44.3	8%	0.079	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-45.5	177.3	-172.6	177.1	-56.2	131.9	6.2	112.3	L237 G239 K240 A241 I340 G341 P342 A343 W347 L348 N349	L237-R345 HydrophobicContact CB-CG 4Å; L237-R345 HydrophobicContact CD1-CG 4.3Å; G239-R345 VanDerWaalsContact O-CD 3.23Å; G239-R345 WeakPolarHBondContact O-CD 3.43Å; G239-R345 PolarHBondContact O-NE 3.18Å; G239-R345 PolarHBondContact O-NH1 3.13Å; K240-R345 VanDerWaalsContact CA-NH1 3.27Å; K240-R345 PolarHBondContact O-NH1 3.16Å; A241-R345 PolarHBondContact O-NH2 2.98Å; I340-R345 HydrophobicContact CG2-CB 4.01Å; I340-R345 PolarHBondContact O-NH2 3.16Å; I340-R345 VanDerWaalsContact O-NH2 3.16Å; G341-R345 WeakPolarHBondContact O-CB 3.49Å; G341-R345 PolarHBondContact O-N 2.92Å; P342-R345 WeakPolarHBondContact O-CB 3.43Å; P342-R345 PolarHBondContact O-N 3.17Å; A343-R345 VanDerWaalsContact C-N 3.32Å; A343-R345 PolarHBondContact O-N 3.41Å; R345-W347 VanDerWaalsContact C-N 3.26Å; R345-W347 PolarHBondContact O-N 2.85Å; R345-L348 PolarHBondContact O-N 3.23Å; R345-N349 WeakPolarHBondContact O-CB 3.48Å; R345-N349 PolarHBondContact O-N 3.03Å
346	D	96.6	Very high	96.4	Very high	103 Å²	103	41.5 Å²	41.5	55%	0.551	25%	0.245	S	C	*	.	H	α-helix	trans	-57.2	-45.2	179.7	-67	-18.3	0	0	0	110	P342 A343 N349 V350	P342-D346 PolarHBondContact O-N 3.5Å; A343-D346 PolarHBondContact O-N 3.06Å; D346-N349 PolarHBondContact O-N 3.4Å; D346-V350 WeakPolarHBondContact O-CG2 3.49Å; D346-V350 PolarHBondContact O-N 3.4Å
347	W	96.4	Very high	96.5	Very high	93 Å²	93	40 Å²	40	35%	0.352	24%	0.235	S	C	.	.	H	α-helix	trans	-68.1	-35.8	176.9	-81.5	109.5	0	0	0	114.8	F328 Q332 A343 T344 R345 N349 V350 R355	F328-W347 HydrophobicContact CE1-CB 3.94Å; F328-W347 HydrophobicContact CZ-CB 4.02Å; Q332-W347 HydrophobicContact CG-CB 4.24Å; Q332-W347 HydrophobicContact CG-CD2 4.47Å; Q332-W347 HydrophobicContact CG-CG 4.3Å; A343-W347 VanDerWaalsContact O-CD1 3.31Å; A343-W347 PolarHBondContact O-N 3.3Å; T344-W347 PolarHBondContact O-N 3.03Å; R345-W347 VanDerWaalsContact C-N 3.26Å; R345-W347 PolarHBondContact O-N 2.85Å; W347-N349 VanDerWaalsContact C-N 3.25Å; W347-N349 PolarHBondContact O-N 2.9Å; W347-V350 HydrophobicContact CE3-CG2 3.98Å; W347-V350 HydrophobicContact CZ3-CG2 4.5Å; W347-V350 WeakPolarHBondContact O-CB 3.48Å; W347-V350 PolarHBondContact O-N 3.45Å; W347-R355 PolarHBondContact O-NH2 3.49Å
348	L	97	Very high	96.5	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-32.5	174.3	-74	166.2	0	0	0	111.4	W234 L237 L255 I258 L259 F328 I340 T344 R345 V350	W234-L348 PolarHBondContact NE1-O 3.42Å; L237-L348 HydrophobicContact CD1-CB 3.9Å; L237-L348 HydrophobicContact CD1-CD1 3.62Å; L237-L348 HydrophobicContact CD1-CG 4.39Å; L255-L348 HydrophobicContact CD1-CD1 3.84Å; L255-L348 HydrophobicContact CD1-CD2 4.3Å; I258-L348 HydrophobicContact CD1-CB 4.27Å; I258-L348 HydrophobicContact CG2-CB 4.4Å; I258-L348 HydrophobicContact CG2-CD2 3.52Å; L259-L348 HydrophobicContact CD2-CD2 4.38Å; F328-L348 HydrophobicContact CD1-CD2 3.74Å; F328-L348 HydrophobicContact CD1-CG 4.09Å; F328-L348 HydrophobicContact CD2-CD2 4.04Å; F328-L348 HydrophobicContact CE1-CD2 3.6Å; F328-L348 HydrophobicContact CE1-CG 3.65Å; F328-L348 HydrophobicContact CE2-CD2 3.91Å; F328-L348 HydrophobicContact CG-CD2 3.96Å; F328-L348 HydrophobicContact CZ-CD2 3.69Å; F328-L348 HydrophobicContact CZ-CG 3.99Å; I340-L348 HydrophobicContact CD1-CD1 4.09Å; I340-L348 HydrophobicContact CG1-CD1 4.49Å; I340-L348 HydrophobicContact CG2-CD1 3.94Å; T344-L348 HydrophobicContact CG2-CD1 3.92Å; T344-L348 HydrophobicContact CG2-CG 4.43Å; T344-L348 VanDerWaalsContact O-CG 3.31Å; T344-L348 WeakPolarHBondContact O-CG 3.49Å; T344-L348 PolarHBondContact O-N 3.38Å; R345-L348 PolarHBondContact O-N 3.23Å; L348-V350 VanDerWaalsContact C-N 3.35Å
349	N	97.5	Very high	96.6	Very high	28 Å²	28	40.2 Å²	40.2	15%	0.15	24%	0.239	C	C	.	.	H	α-helix	trans	-80.4	-11	178.6	-76.6	-9.2	0	0	0	113.9	Q236 L237 R345 D346 W347 T351	Q236-N349 PolarHBondContact NE2-O 3.23Å; Q236-N349 PolarHBondContact OE1-OD1 3.25Å; L237-N349 PolarHBondContact N-OD1 3.12Å; L237-N349 PolarHBondContact O-ND2 3.05Å; R345-N349 WeakPolarHBondContact O-CB 3.48Å; R345-N349 PolarHBondContact O-N 3.03Å; D346-N349 PolarHBondContact O-N 3.4Å; W347-N349 VanDerWaalsContact C-N 3.25Å; W347-N349 PolarHBondContact O-N 2.9Å; N349-T351 PolarHBondContact O-N 3.04Å
350	V	96.6	Very high	96.6	Very high	28 Å²	28	39.4 Å²	39.4	17%	0.17	23%	0.231	C	C	.	.			trans	-64.8	115.6	174.6	177	0	0	0	0	109.9	D346 W347 L348 Q354 R355	D346-V350 WeakPolarHBondContact O-CG2 3.49Å; D346-V350 PolarHBondContact O-N 3.4Å; W347-V350 HydrophobicContact CE3-CG2 3.98Å; W347-V350 HydrophobicContact CZ3-CG2 4.5Å; W347-V350 WeakPolarHBondContact O-CB 3.48Å; W347-V350 PolarHBondContact O-N 3.45Å; L348-V350 VanDerWaalsContact C-N 3.35Å; V350-Q354 HydrophobicContact CG1-CB 3.82Å; V350-R355 HydrophobicContact CG1-CB 4.08Å
351	T	96.5	Very high	96.6	Very high	35 Å²	35	40.9 Å²	40.9	22%	0.215	24%	0.239	C	C	.	.			trans	-69.7	158.7	178.3	65.2	0	0	0	0	112.2	W234 N349 A353 Q354 R355	W234-T351 HydrophobicContact CB-CG2 3.84Å; W234-T351 HydrophobicContact CG-CG2 4.29Å; N349-T351 PolarHBondContact O-N 3.04Å; T351-A353 VanDerWaalsContact C-N 3.25Å; T351-A353 PolarHBondContact O-N 3.32Å; T351-Q354 PolarHBondContact O-N 3.48Å; T351-Q354 VanDerWaalsContact O-N 3.15Å; T351-Q354 WeakPolarHBondContact OG1-CG 3.36Å; T351-Q354 PolarHBondContact OG1-N 3.17Å; T351-Q354 PolarHBondContact OG1-OE1 2.8Å; T351-R355 PolarHBondContact O-N 2.87Å
352	P	95.8	Very high	96.6	Very high	12 Å²	12	42.8 Å²	42.8	8%	0.078	25%	0.246	C	C	.	.	H	α-helix	trans	-54.2	-40.1	174.7	-28.3	35.8	0	0	0	113.3	L227 D230 W234 R355 A356	L227-P352 HydrophobicContact CB-CB 4.49Å; L227-P352 HydrophobicContact CD2-CB 4.05Å; D230-P352 HydrophobicContact CB-CB 4.2Å; D230-P352 HydrophobicContact CB-CG 4.2Å; W234-P352 HydrophobicContact CD2-CG 4.26Å; W234-P352 HydrophobicContact CE3-CG 3.5Å; W234-P352 HydrophobicContact CH2-CG 4.49Å; W234-P352 HydrophobicContact CZ3-CG 3.65Å; P352-R355 PolarHBondContact O-N 3.29Å; P352-A356 WeakPolarHBondContact O-CB 3.45Å; P352-A356 PolarHBondContact O-N 3.01Å
353	A	94.4	Very high	96.7	Very high	73 Å²	73	38.9 Å²	38.9	60%	0.603	22%	0.221	S	C	*	.	H	α-helix	trans	-64.6	-42.2	177.4	0	0	0	0	0	113	T351 A356 G357	T351-A353 VanDerWaalsContact C-N 3.25Å; T351-A353 PolarHBondContact O-N 3.32Å; A353-A356 WeakPolarHBondContact O-CB 3.49Å; A353-A356 PolarHBondContact O-N 3.29Å; A353-G357 PolarHBondContact O-N 3.2Å
354	Q	95.4	Very high	96.9	Very high	111 Å²	111	36.5 Å²	36.5	52%	0.519	20%	0.2	S	C	.	.	H	α-helix	trans	-65.6	-41	174.4	-73.3	165.5	-38.7	0	0	111.4	V350 T351 A356 G357 V358	V350-Q354 HydrophobicContact CG1-CB 3.82Å; T351-Q354 PolarHBondContact O-N 3.48Å; T351-Q354 VanDerWaalsContact O-N 3.15Å; T351-Q354 WeakPolarHBondContact OG1-CG 3.36Å; T351-Q354 PolarHBondContact OG1-N 3.17Å; T351-Q354 PolarHBondContact OG1-OE1 2.8Å; Q354-A356 VanDerWaalsContact C-N 3.32Å; Q354-A356 PolarHBondContact O-N 3.2Å; Q354-G357 PolarHBondContact O-N 2.97Å; Q354-V358 PolarHBondContact O-N 2.87Å
355	R	96.2	Very high	96.9	Very high	35 Å²	35	38.5 Å²	38.5	13%	0.132	21%	0.207	C	C	.	.	H	α-helix	trans	-64.4	-37.4	176	-167.1	176	-64	-83.5	-0.2	111.7	L227 Q332 W347 V350 T351 P352 G357 V358 L359	L227-R355 HydrophobicContact CD1-CB 4.1Å; L227-R355 HydrophobicContact CD1-CG 3.88Å; L227-R355 HydrophobicContact CD2-CB 4.37Å; L227-R355 HydrophobicContact CD2-CG 4.43Å; Q332-R355 VanDerWaalsContact NE2-NH1 3.18Å; W347-R355 PolarHBondContact O-NH2 3.49Å; V350-R355 HydrophobicContact CG1-CB 4.08Å; T351-R355 PolarHBondContact O-N 2.87Å; P352-R355 PolarHBondContact O-N 3.29Å; R355-G357 VanDerWaalsContact C-N 3.33Å; R355-G357 PolarHBondContact O-N 3.37Å; R355-V358 PolarHBondContact O-N 2.63Å; R355-L359 WeakPolarHBondContact O-CB 3.12Å; R355-L359 PolarHBondContact O-N 2.98Å
356	A	97	Very high	96.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-42.4	175	0	0	0	0	0	111.6	I125 L224 L227 L228 P352 A353 Q354 V358 L359 A360	I125-A356 HydrophobicContact CG2-CB 4.39Å; L224-A356 HydrophobicContact CD1-CB 3.6Å; L224-A356 WeakPolarHBondContact CD1-O 3.43Å; L227-A356 HydrophobicContact CB-CB 4.13Å; L227-A356 HydrophobicContact CD1-CB 4.47Å; L228-A356 HydrophobicContact CD2-CB 3.85Å; L228-A356 HydrophobicContact CG-CB 4.32Å; P352-A356 WeakPolarHBondContact O-CB 3.45Å; P352-A356 PolarHBondContact O-N 3.01Å; A353-A356 WeakPolarHBondContact O-CB 3.49Å; A353-A356 PolarHBondContact O-N 3.29Å; Q354-A356 VanDerWaalsContact C-N 3.32Å; Q354-A356 PolarHBondContact O-N 3.2Å; A356-V358 PolarHBondContact O-N 2.99Å; A356-L359 PolarHBondContact O-N 3.36Å; A356-A360 WeakPolarHBondContact O-CB 3.48Å; A356-A360 PolarHBondContact O-N 3.3Å
357	G	96.6	Very high	96.9	Very high	19 Å²	19	35.2 Å²	35.2	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-58.2	-48.1	174.2	0	0	0	0	0	113.2	I125 A353 Q354 R355 L361	I125-G357 WeakPolarHBondContact O-CA 3.46Å; A353-G357 PolarHBondContact O-N 3.2Å; Q354-G357 PolarHBondContact O-N 2.97Å; R355-G357 VanDerWaalsContact C-N 3.33Å; R355-G357 PolarHBondContact O-N 3.37Å; G357-L361 PolarHBondContact O-N 3.5Å; G357-L361 VanDerWaalsContact O-N 3.07Å
358	V	95.9	Very high	96.8	Very high	75 Å²	75	33.3 Å²	33.3	46%	0.455	18%	0.184	S	C	.	.	H	α-helix	trans	-65.6	-41.9	177.9	178.1	0	0	0	0	111.6	Q354 R355 A356 L361 N362	Q354-V358 PolarHBondContact O-N 2.87Å; R355-V358 PolarHBondContact O-N 2.63Å; A356-V358 PolarHBondContact O-N 2.99Å; V358-L361 PolarHBondContact O-N 3.34Å; V358-N362 PolarHBondContact O-N 2.95Å; V358-N362 VanDerWaalsContact O-N 3.08Å; V358-N362 PolarHBondContact O-ND2 3.33Å
359	L	97.6	Very high	96.7	Very high	32 Å²	32	36.5 Å²	36.5	17%	0.168	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-46.9	178.7	-180	59.1	0	0	0	111.3	M220 L224 L227 R355 A356 L361 N362 I363	M220-L359 HydrophobicContact CB-CD1 4.23Å; M220-L359 HydrophobicContact CE-CD1 3.59Å; M220-L359 HydrophobicContact CG-CD1 4.34Å; L224-L359 HydrophobicContact CB-CD2 3.9Å; L224-L359 HydrophobicContact CB-CG 4.43Å; L227-L359 HydrophobicContact CD1-CD2 3.82Å; R355-L359 WeakPolarHBondContact O-CB 3.12Å; R355-L359 PolarHBondContact O-N 2.98Å; A356-L359 PolarHBondContact O-N 3.36Å; L359-L361 VanDerWaalsContact C-N 3.29Å; L359-L361 PolarHBondContact O-N 2.9Å; L359-N362 CarbonylContact O-C 3.58Å; L359-N362 WeakPolarHBondContact O-CA 3.34Å; L359-N362 PolarHBondContact O-N 3.46Å; L359-I363 HydrophobicContact CG-CD1 4.43Å; L359-I363 WeakPolarHBondContact O-CG1 3.48Å; L359-I363 PolarHBondContact O-N 3.06Å
360	A	98.2	Very high	96.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-39.1	177.1	0	0	0	0	0	112.1	E122 I125 A126 L224 A356 I363 Q364	E122-A360 WeakPolarHBondContact O-CB 3.49Å; I125-A360 HydrophobicContact CB-CB 4.01Å; I125-A360 HydrophobicContact CG2-CB 3.67Å; A126-A360 HydrophobicContact CB-CB 4.12Å; L224-A360 HydrophobicContact CD1-CB 4.24Å; L224-A360 HydrophobicContact CD2-CB 4.06Å; A356-A360 WeakPolarHBondContact O-CB 3.48Å; A356-A360 PolarHBondContact O-N 3.3Å; A360-I363 WeakPolarHBondContact O-CB 3.22Å; A360-I363 PolarHBondContact O-N 3.46Å; A360-Q364 WeakPolarHBondContact O-CG 3.17Å; A360-Q364 PolarHBondContact O-N 2.82Å; A360-Q364 VanDerWaalsContact O-N 3.12Å
361	L	98	Very high	96	Very high	34 Å²	34	40.2 Å²	40.2	18%	0.178	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-43	172.6	-179.6	60.9	0	0	0	112	A126 F128 L175 G357 V358 L359 Q364 R365	A126-L361 HydrophobicContact CB-CB 4.15Å; A126-L361 HydrophobicContact CB-CD1 4.45Å; F128-L361 HydrophobicContact CD1-CD1 4Å; L175-L361 HydrophobicContact CD2-CD1 4.36Å; G357-L361 PolarHBondContact O-N 3.5Å; G357-L361 VanDerWaalsContact O-N 3.07Å; V358-L361 PolarHBondContact O-N 3.34Å; L359-L361 VanDerWaalsContact C-N 3.29Å; L359-L361 PolarHBondContact O-N 2.9Å; L361-Q364 PolarHBondContact O-N 2.91Å; L361-R365 WeakPolarHBondContact O-CG 3.49Å; L361-R365 PolarHBondContact O-N 3.4Å
362	N	97.6	Very high	95.5	Very high	55 Å²	55	47 Å²	47	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-68.8	-32.7	176.3	-71.4	-50.8	0	0	0	112.8	M220 V358 L359 Q364 R365 L366	M220-N362 HydrophobicContact CE-CB 3.84Å; V358-N362 PolarHBondContact O-N 2.95Å; V358-N362 VanDerWaalsContact O-N 3.08Å; V358-N362 PolarHBondContact O-ND2 3.33Å; L359-N362 CarbonylContact O-C 3.58Å; L359-N362 WeakPolarHBondContact O-CA 3.34Å; L359-N362 PolarHBondContact O-N 3.46Å; N362-Q364 VanDerWaalsContact C-N 3.28Å; N362-Q364 PolarHBondContact O-N 3.28Å; N362-R365 WeakPolarHBondContact O-CB 3.2Å; N362-R365 PolarHBondContact O-N 3.45Å; N362-R365 VanDerWaalsContact O-N 3.11Å; N362-R365 WeakPolarHBondContact OD1-CD 3.38Å; N362-R365 PolarHBondContact OD1-NH1 3.24Å; N362-L366 PolarHBondContact O-N 2.87Å; N362-L366 VanDerWaalsContact O-N 3.13Å
363	I	98.1	Very high	95	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-56.6	-44.6	169.4	-72.4	175	0	0	0	110.2	P212 Y217 M220 L224 L359 A360 R365 L366	P212-I363 HydrophobicContact CG-CG2 3.95Å; Y217-I363 HydrophobicContact CD2-CG2 3.77Å; Y217-I363 HydrophobicContact CE2-CG2 3.76Å; M220-I363 HydrophobicContact CB-CD1 4.05Å; M220-I363 HydrophobicContact CB-CG1 3.7Å; M220-I363 HydrophobicContact CE-CG1 3.9Å; L224-I363 HydrophobicContact CB-CD1 4.14Å; L224-I363 HydrophobicContact CD2-CD1 3.91Å; L359-I363 HydrophobicContact CG-CD1 4.43Å; L359-I363 WeakPolarHBondContact O-CG1 3.48Å; L359-I363 PolarHBondContact O-N 3.06Å; A360-I363 WeakPolarHBondContact O-CB 3.22Å; A360-I363 PolarHBondContact O-N 3.46Å; I363-R365 VanDerWaalsContact C-N 3.33Å; I363-R365 PolarHBondContact O-N 3.43Å; I363-L366 VanDerWaalsContact O-CB 3.27Å; I363-L366 WeakPolarHBondContact O-CB 3.25Å; I363-L366 WeakPolarHBondContact O-CG 3.42Å; I363-L366 PolarHBondContact O-N 3.23Å
364	Q	98	Very high	94.8	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-31.4	177	-57.9	-44.4	-46.9	0	0	112.8	V123 A126 F128 F163 L175 A360 L361 N362 L366 R367	V123-Q364 VanDerWaalsContact CG2-CD 3.45Å; V123-Q364 HydrophobicContact CG2-CG 4.02Å; A126-Q364 HydrophobicContact CB-CG 4.33Å; F128-Q364 HydrophobicContact CE1-CB 4.46Å; F128-Q364 HydrophobicContact CE1-CG 4.05Å; F163-Q364 HydrophobicContact CZ-CB 4.45Å; L175-Q364 HydrophobicContact CD1-CB 4.42Å; L175-Q364 HydrophobicContact CD2-CB 4.01Å; A360-Q364 WeakPolarHBondContact O-CG 3.17Å; A360-Q364 PolarHBondContact O-N 2.82Å; A360-Q364 VanDerWaalsContact O-N 3.12Å; L361-Q364 PolarHBondContact O-N 2.91Å; N362-Q364 VanDerWaalsContact C-N 3.28Å; N362-Q364 PolarHBondContact O-N 3.28Å; Q364-L366 PolarHBondContact O-N 2.84Å; Q364-R367 WeakPolarHBondContact O-CB 3.42Å; Q364-R367 WeakPolarHBondContact O-CG 3.47Å; Q364-R367 PolarHBondContact O-N 3.42Å
365	R	97.8	Very high	94.8	Very high	52 Å²	52	47.1 Å²	47.1	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-21.7	174.4	-70.8	168.7	177.7	163.1	-3.3	113.3	L175 Y176 L361 N362 I363 R367 L368	L175-R365 HydrophobicContact CB-CG 3.94Å; L175-R365 HydrophobicContact CD1-CG 4.03Å; L175-R365 PolarHBondContact O-NE 3.26Å; L175-R365 PolarHBondContact O-NH2 3.06Å; Y176-R365 HydrophobicContact CE2-CG 4.17Å; L361-R365 WeakPolarHBondContact O-CG 3.49Å; L361-R365 PolarHBondContact O-N 3.4Å; N362-R365 WeakPolarHBondContact O-CB 3.2Å; N362-R365 PolarHBondContact O-N 3.45Å; N362-R365 VanDerWaalsContact O-N 3.11Å; N362-R365 WeakPolarHBondContact OD1-CD 3.38Å; N362-R365 PolarHBondContact OD1-NH1 3.24Å; I363-R365 VanDerWaalsContact C-N 3.33Å; I363-R365 PolarHBondContact O-N 3.43Å; R365-R367 PolarHBondContact O-N 2.82Å; R365-R367 VanDerWaalsContact O-N 3.1Å; R365-L368 WeakPolarHBondContact O-CB 3.39Å; R365-L368 PolarHBondContact O-N 3.37Å
366	L	96.9	Very high	94.8	Very high	9 Å²	9	46.3 Å²	46.3	5%	0.047	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-56.7	-25.8	172.4	-64.2	-177.6	0	0	0	112.6	P212 H214 Q216 M220 N362 I363 Q364 L368 L369	P212-L366 HydrophobicContact CB-CB 4.3Å; H214-L366 HydrophobicContact CB-CB 3.8Å; H214-L366 HydrophobicContact CB-CD1 4.19Å; H214-L366 HydrophobicContact CB-CG 4.4Å; Q216-L366 HydrophobicContact CB-CD1 4.32Å; Q216-L366 HydrophobicContact CB-CD2 4.44Å; M220-L366 HydrophobicContact SD-CD1 3.73Å; M220-L366 HydrophobicContact SD-CD2 4.03Å; M220-L366 HydrophobicContact SD-CG 4.14Å; N362-L366 PolarHBondContact O-N 2.87Å; N362-L366 VanDerWaalsContact O-N 3.13Å; I363-L366 VanDerWaalsContact O-CB 3.27Å; I363-L366 WeakPolarHBondContact O-CB 3.25Å; I363-L366 WeakPolarHBondContact O-CG 3.42Å; I363-L366 PolarHBondContact O-N 3.23Å; Q364-L366 PolarHBondContact O-N 2.84Å; L366-L368 PolarHBondContact O-N 3.05Å; L366-L369 HydrophobicContact CD2-CD1 4.02Å; L366-L369 WeakPolarHBondContact O-CB 3.31Å; L366-L369 PolarHBondContact O-N 3.11Å; L366-L369 VanDerWaalsContact O-N 3.09Å
367	R	96.6	Very high	94.7	Very high	46 Å²	46	50 Å²	50	17%	0.174	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-67.1	-17.3	176.7	-58.1	175.1	175.6	-78.3	4.4	114	Y160 I167 L210 A211 P212 Q364 R365	Y160-R367 PolarHBondContact OH-NH2 3.44Å; I167-R367 HydrophobicContact CG2-CB 3.81Å; L210-R367 PolarHBondContact O-NH1 2.86Å; L210-R367 PolarHBondContact O-NH2 3.35Å; A211-R367 PolarHBondContact O-NH1 3.24Å; P212-R367 HydrophobicContact CB-CG 4.07Å; P212-R367 HydrophobicContact CG-CG 4.15Å; Q364-R367 WeakPolarHBondContact O-CB 3.42Å; Q364-R367 WeakPolarHBondContact O-CG 3.47Å; Q364-R367 PolarHBondContact O-N 3.42Å; R365-R367 PolarHBondContact O-N 2.82Å; R365-R367 VanDerWaalsContact O-N 3.1Å
368	L	95.4	Very high	94.7	Very high	53 Å²	53	51.9 Å²	51.9	28%	0.277	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-86.6	-11.1	174.8	-66.6	172.6	0	0	0	112.7	I167 L175 Y176 R365 L366	I167-L368 HydrophobicContact CG2-CD2 4.02Å; L175-L368 HydrophobicContact CD1-CD1 4.05Å; L175-L368 HydrophobicContact CD1-CG 4.34Å; Y176-L368 HydrophobicContact CE2-CD1 3.77Å; R365-L368 WeakPolarHBondContact O-CB 3.39Å; R365-L368 PolarHBondContact O-N 3.37Å; L366-L368 PolarHBondContact O-N 3.05Å
369	L	94.7	Very high	94.8	Very high	68 Å²	68	51.7 Å²	51.7	36%	0.356	28%	0.281	S	S	.	.	S	Bend	trans	-93.4	150.9	-179	-54.4	-177.1	0	0	0	110.1	L366 T371 M378	L366-L369 HydrophobicContact CD2-CD1 4.02Å; L366-L369 WeakPolarHBondContact O-CB 3.31Å; L366-L369 PolarHBondContact O-N 3.11Å; L366-L369 VanDerWaalsContact O-N 3.09Å; L369-T371 PolarHBondContact O-N 3.05Å; L369-M378 HydrophobicContact CD2-CE 3.85Å
370	P	91.8	Very high	94.7	Very high	58 Å²	58	54.1 Å²	54.1	38%	0.377	30%	0.295	S	S	.	.			trans	-55.3	135.9	170	-21.9	32.4	0	0	0	110.8	H214 L373	H214-P370 PolarHBondContact CD2-O 3.2Å; P370-L373 HydrophobicContact CG-CD1 4.43Å
371	T	88	Confident	94.6	Very high	76 Å²	76	56.2 Å²	56.2	47%	0.466	31%	0.305	S	S	.	.	S	Bend	trans	-66.8	-41.5	175.9	-61.8	0	0	0	0	111.2	Q213 P215 L369	Q213-T371 HydrophobicContact CB-CG2 3.98Å; Q213-T371 WeakPolarHBondContact O-CG2 3.3Å; P215-T371 VanDerWaalsContact CD-O 3.27Å; P215-T371 WeakPolarHBondContact CD-O 3.5Å; L369-T371 PolarHBondContact O-N 3.05Å
372	E	85.1	Confident	94.3	Very high	177 Å²	177	59.6 Å²	59.6	83%	0.827	33%	0.329	S	S	*	.			trans	-129.4	130.9	171.5	-66	-173.1	168.4	0	0	109.1
373	L	85.9	Confident	94.1	Very high	50 Å²	50	58.9 Å²	58.9	26%	0.262	33%	0.331	S	S	.	.			trans	-116.4	93.2	175.3	-174	68.1	0	0	0	109.3	P370 M378 Y389	P370-L373 HydrophobicContact CG-CD1 4.43Å; L373-M378 HydrophobicContact CD2-CG 3.31Å; L373-M378 HydrophobicContact CD2-SD 3.83Å; L373-Y389 HydrophobicContact CD2-CD2 3.64Å; L373-Y389 HydrophobicContact CD2-CE2 4.27Å; L373-Y389 HydrophobicContact CD2-CG 4.14Å
374	S	90.5	Very high	93.9	Very high	71 Å²	71	65.2 Å²	65.2	50%	0.497	36%	0.356	S	S	.	.	S	Bend	trans	-70.4	-56.2	176	179	0	0	0	0	111	Q390 N391 G392	S374-Q390 CarbonylContact O-C 3.57Å; S374-N391 PolarHBondContact O-N 3.09Å; S374-G392 PolarHBondContact O-N 3.17Å
375	T	94.9	Very high	93.8	Very high	78 Å²	78	65.6 Å²	65.6	48%	0.479	36%	0.359	S	S	.	.	S	Bend	trans	-135.4	121.8	178	-60.9	0	0	0	0	109.6	Y388 Y389 N391	T375-Y388 HydrophobicContact CG2-CE2 4.4Å; T375-Y389 VanDerWaalsContact CA-O 3.3Å; T375-Y389 WeakPolarHBondContact CA-O 3.39Å; T375-N391 PolarHBondContact OG1-N 3.16Å; T375-N391 VanDerWaalsContact OG1-N 3.13Å
376	G	95.7	Very high	93.7	Very high	19 Å²	19	64.9 Å²	64.9	20%	0.196	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.6	171.9	179.1	0	0	0	0	0	113.8	Y388 Y389	G376-Y388 WeakPolarHBondContact O-CD2 3.42Å; G376-Y389 PolarHBondContact N-O 2.79Å; G376-Y389 PolarHBondContact O-N 3.16Å
377	I	96.4	Very high	93.7	Very high	76 Å²	76	65 Å²	65	39%	0.39	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.7	-178.7	-62.9	174.3	0	0	0	108.7	V379 L386 V387 Y388 L416	I377-V379 HydrophobicContact CG2-CG2 4.15Å; I377-L386 HydrophobicContact CG2-CD1 3.74Å; I377-L386 HydrophobicContact CG2-CD2 3.94Å; I377-L386 HydrophobicContact CG2-CG 3.64Å; I377-V387 WeakPolarHBondContact CA-O 3.34Å; I377-Y388 HydrophobicContact CG1-CD2 3.71Å; I377-Y388 HydrophobicContact CG1-CG 4.23Å; I377-L416 HydrophobicContact CD1-CD1 3.54Å
378	M	96.3	Very high	93.7	Very high	60 Å²	60	66 Å²	66	30%	0.296	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.3	173.5	-65.2	-59.2	-69	0	0	109.6	L369 L373 L386 V387	L369-M378 HydrophobicContact CD2-CE 3.85Å; L373-M378 HydrophobicContact CD2-CG 3.31Å; L373-M378 HydrophobicContact CD2-SD 3.83Å; M378-L386 CarbonylContact O-C 3.57Å; M378-L386 VanDerWaalsContact O-CA 3.32Å; M378-L386 WeakPolarHBondContact O-CA 3.4Å; M378-V387 PolarHBondContact N-O 3.16Å; M378-V387 PolarHBondContact O-N 3.01Å
379	V	97	Very high	93.7	Very high	70 Å²	70	66.8 Å²	66.8	42%	0.424	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	113	174.5	-176	0	0	0	0	108.9	I377 I381 S385 L386 V400	I377-V379 HydrophobicContact CG2-CG2 4.15Å; V379-I381 PolarHBondContact O-N 3.41Å; V379-S385 WeakPolarHBondContact CA-O 2.91Å; V379-L386 HydrophobicContact CG2-CB 4.28Å; V379-L386 HydrophobicContact CG2-CD1 3.9Å; V379-L386 HydrophobicContact CG2-CG 4.03Å; V379-V400 HydrophobicContact CG1-CG2 4.09Å
380	N	96	Very high	93.8	Very high	84 Å²	84	67.8 Å²	67.8	45%	0.449	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	94.1	174.6	-173.7	-9.7	0	0	0	109.1	P382 A383 Y384 S385	N380-P382 WeakPolarHBondContact OD1-CD 3.29Å; N380-P382 WeakPolarHBondContact OD1-CG 3.36Å; N380-A383 HydrophobicContact CB-CB 3.87Å; N380-A383 VanDerWaalsContact CG-CB 3.41Å; N380-A383 WeakPolarHBondContact ND2-CB 3.42Å; N380-A383 CarbonylContact O-C 2.95Å; N380-A383 PolarHBondContact O-N 3.39Å; N380-Y384 PolarHBondContact O-N 2.81Å; N380-S385 PolarHBondContact N-O 3.35Å; N380-S385 PolarHBondContact O-N 3.05Å
381	I	95.7	Very high	94	Very high	43 Å²	43	70.7 Å²	70.7	22%	0.221	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-50.7	-54.4	-173.9	-59.5	173.4	0	0	0	112.9	V379 A383 Y384 V402 T409 M411	V379-I381 PolarHBondContact O-N 3.41Å; I381-A383 VanDerWaalsContact C-N 3.27Å; I381-A383 PolarHBondContact O-N 3.11Å; I381-Y384 PolarHBondContact O-N 2.96Å; I381-V402 HydrophobicContact CG2-CB 4.14Å; I381-V402 HydrophobicContact CG2-CG1 4.13Å; I381-V402 HydrophobicContact CG2-CG2 4.07Å; I381-T409 HydrophobicContact CD1-CG2 4.03Å; I381-T409 HydrophobicContact CG1-CG2 4.44Å; I381-M411 HydrophobicContact CD1-CG 4.28Å
382	P	92.5	Very high	94.1	Very high	105 Å²	105	69.2 Å²	69.2	68%	0.682	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-71.6	-17.9	179.9	28.8	-37	0	0	0	114.1	N380	N380-P382 WeakPolarHBondContact OD1-CD 3.29Å; N380-P382 WeakPolarHBondContact OD1-CG 3.36Å
383	A	92.7	Very high	94.5	Very high	41 Å²	41	65.9 Å²	65.9	34%	0.339	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-90.3	-3.6	175.7	0	0	0	0	0	113.3	N380 I381 S385	N380-A383 HydrophobicContact CB-CB 3.87Å; N380-A383 VanDerWaalsContact CG-CB 3.41Å; N380-A383 WeakPolarHBondContact ND2-CB 3.42Å; N380-A383 CarbonylContact O-C 2.95Å; N380-A383 PolarHBondContact O-N 3.39Å; I381-A383 VanDerWaalsContact C-N 3.27Å; I381-A383 PolarHBondContact O-N 3.11Å; A383-S385 PolarHBondContact O-N 2.82Å; A383-S385 VanDerWaalsContact O-N 3.16Å
384	Y	94.1	Very high	94.9	Very high	133 Å²	133	68.2 Å²	68.2	52%	0.522	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	32.4	-178	-52.4	-78.1	0	0	0	113.5	N380 I381 R399 V400 V402	N380-Y384 PolarHBondContact O-N 2.81Å; I381-Y384 PolarHBondContact O-N 2.96Å; Y384-R399 CarbonylContact O-C 3.36Å; Y384-R399 WeakPolarHBondContact O-CA 3.39Å; Y384-V400 VanDerWaalsContact C-CG2 3.49Å; Y384-V400 PolarHBondContact O-N 2.97Å; Y384-V402 HydrophobicContact CD1-CG2 3.78Å; Y384-V402 HydrophobicContact CE1-CG2 3.58Å
385	S	95.1	Very high	95.2	Very high	9 Å²	9	68.2 Å²	68.2	6%	0.063	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.3	-176.3	67.9	0	0	0	0	113	V379 N380 A383	V379-S385 WeakPolarHBondContact CA-O 2.91Å; N380-S385 PolarHBondContact N-O 3.35Å; N380-S385 PolarHBondContact O-N 3.05Å; A383-S385 PolarHBondContact O-N 2.82Å; A383-S385 VanDerWaalsContact O-N 3.16Å
386	L	96.8	Very high	95.3	Very high	36 Å²	36	68.6 Å²	68.6	19%	0.188	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.1	173.2	176.8	158.5	0	0	0	108.5	I377 M378 V379 L396 D397 S398 V400	I377-L386 HydrophobicContact CG2-CD1 3.74Å; I377-L386 HydrophobicContact CG2-CD2 3.94Å; I377-L386 HydrophobicContact CG2-CG 3.64Å; M378-L386 CarbonylContact O-C 3.57Å; M378-L386 VanDerWaalsContact O-CA 3.32Å; M378-L386 WeakPolarHBondContact O-CA 3.4Å; V379-L386 HydrophobicContact CG2-CB 4.28Å; V379-L386 HydrophobicContact CG2-CD1 3.9Å; V379-L386 HydrophobicContact CG2-CG 4.03Å; L386-L396 HydrophobicContact CD2-CD2 3.75Å; L386-D397 WeakPolarHBondContact O-CA 3.39Å; L386-S398 PolarHBondContact N-O 2.88Å; L386-S398 PolarHBondContact O-N 2.72Å; L386-V400 HydrophobicContact CB-CG1 3.49Å; L386-V400 VanDerWaalsContact CB-CG1 3.49Å; L386-V400 HydrophobicContact CD1-CG1 4.07Å; L386-V400 HydrophobicContact CG-CG1 4.45Å
387	V	96.1	Very high	95.2	Very high	12 Å²	12	70.4 Å²	70.4	7%	0.073	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.7	174	-171.9	0	0	0	0	109	P274 I377 M378 Y389 Q394 L396	P274-V387 HydrophobicContact CB-CG2 3.79Å; P274-V387 HydrophobicContact CG-CG2 4.02Å; I377-V387 WeakPolarHBondContact CA-O 3.34Å; M378-V387 PolarHBondContact N-O 3.16Å; M378-V387 PolarHBondContact O-N 3.01Å; V387-Y389 HydrophobicContact CB-CD2 4.49Å; V387-Y389 HydrophobicContact CB-CE2 3.86Å; V387-Y389 HydrophobicContact CG1-CD2 3.93Å; V387-Y389 HydrophobicContact CG1-CE2 3.33Å; V387-Q394 HydrophobicContact CG1-CB 4.27Å; V387-Q394 HydrophobicContact CG1-CG 3.58Å; V387-L396 WeakPolarHBondContact CA-O 3.23Å
388	Y	96.8	Very high	95.3	Very high	68 Å²	68	69.4 Å²	69.4	27%	0.267	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.4	173.9	171.2	-135.5	0	0	0	109.8	T375 G376 I377 Q390 V395 L396	T375-Y388 HydrophobicContact CG2-CE2 4.4Å; G376-Y388 WeakPolarHBondContact O-CD2 3.42Å; I377-Y388 HydrophobicContact CG1-CD2 3.71Å; I377-Y388 HydrophobicContact CG1-CG 4.23Å; Y388-Q390 PolarHBondContact OH-NE2 3.38Å; Y388-V395 HydrophobicContact CD1-CG2 3.24Å; Y388-V395 HydrophobicContact CE1-CG2 3.35Å; Y388-V395 HydrophobicContact CG-CG2 3.88Å; Y388-V395 WeakPolarHBondContact O-CG2 3.19Å; Y388-V395 PolarHBondContact O-N 3.27Å; Y388-L396 HydrophobicContact CD1-CB 4.31Å; Y388-L396 PolarHBondContact N-O 3.08Å; Y388-L396 PolarHBondContact O-N 3.4Å
389	Y	96	Very high	95.2	Very high	68 Å²	68	72.6 Å²	72.6	27%	0.267	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	140.6	175.8	-68.6	-97.3	0	0	0	110.6	L373 T375 G376 V387 N393 Q394	L373-Y389 HydrophobicContact CD2-CD2 3.64Å; L373-Y389 HydrophobicContact CD2-CE2 4.27Å; L373-Y389 HydrophobicContact CD2-CG 4.14Å; T375-Y389 VanDerWaalsContact CA-O 3.3Å; T375-Y389 WeakPolarHBondContact CA-O 3.39Å; G376-Y389 PolarHBondContact N-O 2.79Å; G376-Y389 PolarHBondContact O-N 3.16Å; V387-Y389 HydrophobicContact CB-CD2 4.49Å; V387-Y389 HydrophobicContact CB-CE2 3.86Å; V387-Y389 HydrophobicContact CG1-CD2 3.93Å; V387-Y389 HydrophobicContact CG1-CE2 3.33Å; Y389-N393 CarbonylContact C-O 3.45Å; Y389-N393 VanDerWaalsContact CA-O 3.25Å; Y389-N393 WeakPolarHBondContact CA-O 3.28Å; Y389-Q394 HydrophobicContact CD1-CB 4.28Å; Y389-Q394 HydrophobicContact CE1-CB 4Å
390	Q	96.3	Very high	95.2	Very high	89 Å²	89	71 Å²	71	42%	0.416	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	123.8	172.2	-173.8	176	55.1	0	0	109.5	S374 Y388 G392 N393 V395	S374-Q390 CarbonylContact O-C 3.57Å; Y388-Q390 PolarHBondContact OH-NE2 3.38Å; Q390-G392 VanDerWaalsContact C-N 3.25Å; Q390-G392 PolarHBondContact O-N 3.12Å; Q390-N393 PolarHBondContact N-O 3.03Å; Q390-N393 PolarHBondContact O-N 3.13Å; Q390-V395 HydrophobicContact CB-CG1 3.93Å; Q390-V395 HydrophobicContact CB-CG2 3.87Å
391	N	95.1	Very high	95.2	Very high	119 Å²	119	75.2 Å²	75.2	64%	0.636	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	41	-177.5	-55.2	-37	0	0	0	113.6	S374 T375 N393	S374-N391 PolarHBondContact O-N 3.09Å; T375-N391 PolarHBondContact OG1-N 3.16Å; T375-N391 VanDerWaalsContact OG1-N 3.13Å; N391-N393 VanDerWaalsContact C-N 3.25Å; N391-N393 PolarHBondContact O-N 3.07Å; N391-N393 PolarHBondContact O-ND2 3.38Å
392	G	91.3	Very high	95.2	Very high	46 Å²	46	74.4 Å²	74.4	47%	0.474	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-6.1	-178.9	0	0	0	0	0	114.8	S374 Q390	S374-G392 PolarHBondContact O-N 3.17Å; Q390-G392 VanDerWaalsContact C-N 3.25Å; Q390-G392 PolarHBondContact O-N 3.12Å
393	N	93.7	Very high	95.3	Very high	106 Å²	106	71 Å²	71	57%	0.567	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.4	-178.5	-58.8	-63.6	0	0	0	110.9	Y389 Q390 N391 V395	Y389-N393 CarbonylContact C-O 3.45Å; Y389-N393 VanDerWaalsContact CA-O 3.25Å; Y389-N393 WeakPolarHBondContact CA-O 3.28Å; Q390-N393 PolarHBondContact N-O 3.03Å; Q390-N393 PolarHBondContact O-N 3.13Å; N391-N393 VanDerWaalsContact C-N 3.25Å; N391-N393 PolarHBondContact O-N 3.07Å; N391-N393 PolarHBondContact O-ND2 3.38Å; N393-V395 PolarHBondContact O-N 3.38Å
394	Q	94.3	Very high	95.3	Very high	99 Å²	99	75 Å²	75	46%	0.463	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	119	166	171.7	173.4	-27.2	0	0	109.1	V387 Y389	V387-Q394 HydrophobicContact CG1-CB 4.27Å; V387-Q394 HydrophobicContact CG1-CG 3.58Å; Y389-Q394 HydrophobicContact CD1-CB 4.28Å; Y389-Q394 HydrophobicContact CE1-CB 4Å
395	V	96.3	Very high	95.2	Very high	72 Å²	72	71.4 Å²	71.4	44%	0.436	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-18.9	-177.4	-66.4	0	0	0	0	113.4	Y388 Q390 N393	Y388-V395 HydrophobicContact CD1-CG2 3.24Å; Y388-V395 HydrophobicContact CE1-CG2 3.35Å; Y388-V395 HydrophobicContact CG-CG2 3.88Å; Y388-V395 WeakPolarHBondContact O-CG2 3.19Å; Y388-V395 PolarHBondContact O-N 3.27Å; Q390-V395 HydrophobicContact CB-CG1 3.93Å; Q390-V395 HydrophobicContact CB-CG2 3.87Å; N393-V395 PolarHBondContact O-N 3.38Å
396	L	96.6	Very high	95.1	Very high	86 Å²	86	76 Å²	76	45%	0.45	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	145.6	172.8	174.5	153.6	0	0	0	110.6	L386 V387 Y388	L386-L396 HydrophobicContact CD2-CD2 3.75Å; V387-L396 WeakPolarHBondContact CA-O 3.23Å; Y388-L396 HydrophobicContact CD1-CB 4.31Å; Y388-L396 PolarHBondContact N-O 3.08Å; Y388-L396 PolarHBondContact O-N 3.4Å
397	D	95.1	Very high	94.8	Very high	57 Å²	57	78.6 Å²	78.6	31%	0.305	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	128.9	176.4	177.7	6.9	0	0	0	108.6	P274 G275 L386	P274-D397 VanDerWaalsContact C-CG 3.42Å; P274-D397 VanDerWaalsContact CA-CG 3.42Å; P274-D397 WeakPolarHBondContact CA-OD1 3.44Å; P274-D397 WeakPolarHBondContact CA-OD2 3.15Å; P274-D397 WeakPolarHBondContact CB-OD1 3.34Å; P274-D397 WeakPolarHBondContact CB-OD2 3.14Å; G275-D397 VanDerWaalsContact N-CG 3.29Å; G275-D397 PolarHBondContact N-OD1 2.84Å; G275-D397 PolarHBondContact N-OD2 3.05Å; L386-D397 WeakPolarHBondContact O-CA 3.39Å
398	S	96.7	Very high	94.7	Very high	54 Å²	54	85.5 Å²	85.5	38%	0.378	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	141.9	-175	-176.7	0	0	0	0	111.3	L386	L386-S398 PolarHBondContact N-O 2.88Å; L386-S398 PolarHBondContact O-N 2.72Å
399	R	95.3	Very high	94.7	Very high	127 Å²	127	84.9 Å²	84.9	48%	0.479	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	149.2	162.6	-62.9	-177.5	-174.1	176.5	2.4	109.9	G275 T278 Y384	G275-R399 PolarHBondContact O-NE 3.25Å; G275-R399 PolarHBondContact O-NH2 3.42Å; T278-R399 PolarHBondContact OG1-NH2 3.47Å; Y384-R399 CarbonylContact O-C 3.36Å; Y384-R399 WeakPolarHBondContact O-CA 3.39Å
400	V	96.5	Very high	94.6	Very high	37 Å²	37	85.8 Å²	85.8	22%	0.224	45%	0.454	C	S	.	.			trans	-132.3	154.9	176	-65.9	0	0	0	0	111.6	V379 Y384 L386 V402	V379-V400 HydrophobicContact CG1-CG2 4.09Å; Y384-V400 VanDerWaalsContact C-CG2 3.49Å; Y384-V400 PolarHBondContact O-N 2.97Å; L386-V400 HydrophobicContact CB-CG1 3.49Å; L386-V400 VanDerWaalsContact CB-CG1 3.49Å; L386-V400 HydrophobicContact CD1-CG1 4.07Å; L386-V400 HydrophobicContact CG-CG1 4.45Å; V400-V402 HydrophobicContact CG2-CG1 4.16Å
401	I	95.7	Very high	94.6	Very high	172 Å²	172	85.7 Å²	85.7	88%	0.882	46%	0.455	S	S	*	.			trans	-102.4	130	169.2	-62.2	172.9	0	0	0	107.6
402	V	95.6	Very high	94.5	Very high	27 Å²	27	86.8 Å²	86.8	16%	0.164	46%	0.458	C	S	.	.			trans	-113.6	166.2	179.9	-59.4	0	0	0	0	111	I381 Y384 V400	I381-V402 HydrophobicContact CG2-CB 4.14Å; I381-V402 HydrophobicContact CG2-CG1 4.13Å; I381-V402 HydrophobicContact CG2-CG2 4.07Å; Y384-V402 HydrophobicContact CD1-CG2 3.78Å; Y384-V402 HydrophobicContact CE1-CG2 3.58Å; V400-V402 HydrophobicContact CG2-CG1 4.16Å
403	G	94.5	Very high	94.6	Very high	32 Å²	32	90.5 Å²	90.5	33%	0.33	48%	0.477	S	S	.	.			trans	-58.8	144.8	177.3	0	0	0	0	0	112.7	R407 T409	G403-R407 CarbonylContact C-O 3.55Å; G403-R407 WeakPolarHBondContact CA-O 3.44Å; G403-T409 PolarHBondContact N-OG1 3.3Å
404	R	94	Very high	94.6	Very high	127 Å²	127	89.9 Å²	89.9	48%	0.479	48%	0.481	S	S	.	.			trans	-63.9	161.5	176.4	-63.4	-176.5	-50.1	164.5	11.8	111.2	D406 R407 K408	R404-D406 WeakPolarHBondContact CB-OD1 3.38Å; R404-D406 IonicContact CZ-OD1 3.05Å; R404-D406 IonicContact CZ-OD2 2.98Å; R404-D406 IonicContact NE-OD1 3.32Å; R404-D406 PolarHBondContact NE-OD1 2.73Å; R404-D406 IonicContact NH2-OD1 3.58Å; R404-D406 PolarHBondContact NH2-OD1 3.19Å; R404-D406 IonicContact NH2-OD2 3.87Å; R404-D406 PolarHBondContact NH2-OD2 3.23Å; R404-D406 PolarHBondContact O-N 3.2Å; R404-R407 PolarHBondContact N-O 2.69Å; R404-R407 CarbonylContact O-C 3.52Å; R404-R407 WeakPolarHBondContact O-CA 3.25Å; R404-R407 PolarHBondContact O-N 2.97Å; R404-K408 WeakPolarHBondContact O-CA 3.21Å; R404-K408 PolarHBondContact O-N 2.97Å; R404-K408 VanDerWaalsContact O-N 3.08Å
405	P	91.8	Very high	94.7	Very high	57 Å²	57	89 Å²	89	37%	0.37	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.8	178.7	-29.1	37	0	0	0	115.3	V289 K408	V289-P405 HydrophobicContact CB-CG 4.4Å; V289-P405 HydrophobicContact CG2-CB 4.13Å; V289-P405 HydrophobicContact CG2-CG 3.91Å; P405-K408 WeakPolarHBondContact O-CE 3.32Å; P405-K408 VanDerWaalsContact O-CG 3.29Å; P405-K408 WeakPolarHBondContact O-CG 3.13Å; P405-K408 PolarHBondContact O-NZ 3.26Å
406	D	92.3	Very high	94.7	Very high	105 Å²	105	92.6 Å²	92.6	56%	0.561	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-12.8	175.9	72.1	-47	0	0	0	113.8	R404	R404-D406 WeakPolarHBondContact CB-OD1 3.38Å; R404-D406 IonicContact CZ-OD1 3.05Å; R404-D406 IonicContact CZ-OD2 2.98Å; R404-D406 IonicContact NE-OD1 3.32Å; R404-D406 PolarHBondContact NE-OD1 2.73Å; R404-D406 IonicContact NH2-OD1 3.58Å; R404-D406 PolarHBondContact NH2-OD1 3.19Å; R404-D406 IonicContact NH2-OD2 3.87Å; R404-D406 PolarHBondContact NH2-OD2 3.23Å; R404-D406 PolarHBondContact O-N 3.2Å
407	R	91.5	Very high	94.6	Very high	91 Å²	91	95.6 Å²	95.6	34%	0.343	52%	0.523	S	S	.	.	S	Bend	trans	-142.3	64	178.9	-61.2	-173.9	-171.1	-174.3	2.4	109.4	G403 R404 D435	G403-R407 CarbonylContact C-O 3.55Å; G403-R407 WeakPolarHBondContact CA-O 3.44Å; R404-R407 PolarHBondContact N-O 2.69Å; R404-R407 CarbonylContact O-C 3.52Å; R404-R407 WeakPolarHBondContact O-CA 3.25Å; R404-R407 PolarHBondContact O-N 2.97Å; R407-D435 IonicContact CZ-OD2 2.91Å; R407-D435 IonicContact NH1-OD1 3.52Å; R407-D435 IonicContact NH1-OD2 2.71Å; R407-D435 PolarHBondContact NH1-OD2 3.37Å; R407-D435 IonicContact NH2-OD2 3.53Å; R407-D435 PolarHBondContact NH2-OD2 3.27Å
408	K	94.4	Very high	94.7	Very high	156 Å²	156	97.9 Å²	97.9	68%	0.678	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-66.6	145.1	-169.3	-59.8	-175.9	178.3	71.5	0	112	R404 P405	R404-K408 WeakPolarHBondContact O-CA 3.21Å; R404-K408 PolarHBondContact O-N 2.97Å; R404-K408 VanDerWaalsContact O-N 3.08Å; P405-K408 WeakPolarHBondContact O-CE 3.32Å; P405-K408 VanDerWaalsContact O-CG 3.29Å; P405-K408 WeakPolarHBondContact O-CG 3.13Å; P405-K408 PolarHBondContact O-NZ 3.26Å
409	T	95.5	Very high	94.6	Very high	55 Å²	55	101.5 Å²	101.5	34%	0.337	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-64.1	125.4	162.2	-59.6	0	0	0	0	108.5	I381 G403	I381-T409 HydrophobicContact CD1-CG2 4.03Å; I381-T409 HydrophobicContact CG1-CG2 4.44Å; G403-T409 PolarHBondContact N-OG1 3.3Å
410	P	95.3	Very high	94.7	Very high	87 Å²	87	99.1 Å²	99.1	57%	0.565	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-68.6	146.7	179	28.9	-34.5	0	0	0	110.9	M412	P410-M412 PolarHBondContact O-N 3.06Å
411	M	94.4	Very high	94.7	Very high	87 Å²	87	102.9 Å²	102.9	43%	0.429	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-76.6	120.2	166.5	-65.6	-179.6	-68.4	0	0	108.2	Y176 I381	Y176-M411 HydrophobicContact CD1-CE 4.14Å; Y176-M411 HydrophobicContact CD1-SD 4.02Å; Y176-M411 HydrophobicContact CD2-CE 3.68Å; Y176-M411 HydrophobicContact CD2-SD 3.93Å; Y176-M411 HydrophobicContact CE1-CE 4.42Å; Y176-M411 HydrophobicContact CE1-SD 3.72Å; Y176-M411 HydrophobicContact CE2-CE 3.98Å; Y176-M411 HydrophobicContact CE2-SD 3.6Å; Y176-M411 HydrophobicContact CG-CE 3.75Å; Y176-M411 HydrophobicContact CG-SD 4.12Å; I381-M411 HydrophobicContact CD1-CG 4.28Å
412	M	94.3	Very high	94.7	Very high	142 Å²	142	101.4 Å²	101.4	70%	0.7	57%	0.571	S	S	*	*			trans	-147.8	162.5	-177.2	62.1	174.7	-76.4	0	0	111.6	P410	P410-M412 PolarHBondContact O-N 3.06Å
413	S	92.8	Very high	94.6	Very high	125 Å²	125	103.8 Å²	103.8	87%	0.874	59%	0.587	S	S	*	*			trans	-127.5	131.1	167.7	-177.4	0	0	0	0	108
414	S	94.5	Very high	94.4	Very high	92 Å²	92	105.4 Å²	105.4	64%	0.643	59%	0.592	S	S	*	*			trans	-160	178.1	-178.1	-168.1	0	0	0	0	109.7
415	A	95.6	Very high	94.3	Very high	82 Å²	82	104.4 Å²	104.4	68%	0.678	59%	0.588	S	S	*	*			trans	-117.3	141.4	175.6	0	0	0	0	0	110.2	N417	A415-N417 PolarHBondContact O-N 2.9Å
416	L	95.8	Very high	94.3	Very high	147 Å²	147	105.4 Å²	105.4	77%	0.77	59%	0.59	S	S	*	*			trans	-70.5	121.4	168.6	-69.8	-179.2	0	0	0	108.9	I377	I377-L416 HydrophobicContact CD1-CD1 3.54Å
417	N	96	Very high	94.2	Very high	148 Å²	148	100.4 Å²	100.4	79%	0.791	56%	0.564	S	S	*	*			trans	-99.8	-30.4	179.7	55.7	-8.3	0	0	0	112.6	A415	A415-N417 PolarHBondContact O-N 2.9Å
418	N	95.8	Very high	94.2	Very high	105 Å²	105	98.8 Å²	98.8	56%	0.561	57%	0.565	S	S	*	*			trans	-151.6	164.1	175.6	69.6	-32.4	0	0	0	112.3
419	V	95.9	Very high	94.1	Very high	130 Å²	130	94.7 Å²	94.7	79%	0.788	55%	0.554	S	S	*	*			trans	-121.5	132.9	166	63.1	0	0	0	0	108
420	V	95.8	Very high	93.8	Very high	77 Å²	77	96.2 Å²	96.2	47%	0.467	56%	0.563	S	S	.	*			trans	-109.7	113.3	178.2	-175.4	0	0	0	0	108.1	P423	V420-P423 HydrophobicContact CB-CB 4.11Å; V420-P423 HydrophobicContact CG1-CB 3.81Å; V420-P423 WeakPolarHBondContact O-CD 3.48Å
421	V	97.5	Very high	93.7	Very high	117 Å²	117	94.2 Å²	94.2	71%	0.709	55%	0.548	S	S	*	.	S	Bend	trans	-82.2	128.6	173	-177.7	0	0	0	0	108.3
422	N	94.9	Very high	93.5	Very high	141 Å²	141	90.7 Å²	90.7	75%	0.754	53%	0.532	S	S	*	.	S	Bend	trans	57.2	58.6	-171.9	-51.2	-46.6	0	0	0	112.9
423	P	94	Very high	93.5	Very high	76 Å²	76	92.4 Å²	92.4	49%	0.494	53%	0.531	S	S	.	.			trans	-66.1	142.5	-176.7	29.3	-34	0	0	0	111.2	V420	V420-P423 HydrophobicContact CB-CB 4.11Å; V420-P423 HydrophobicContact CG1-CB 3.81Å; V420-P423 WeakPolarHBondContact O-CD 3.48Å
424	P	90.4	Very high	93.5	Very high	67 Å²	67	93.1 Å²	93.1	44%	0.435	52%	0.518	S	S	.	.			trans	-61.8	142.4	160.2	27.2	-31.8	0	0	0	109.2	N4	N4-P424 VanDerWaalsContact OD1-CB 3.25Å; N4-P424 WeakPolarHBondContact OD1-CB 3.49Å
425	W	91.7	Very high	93.4	Very high	106 Å²	106	91.5 Å²	91.5	40%	0.402	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	98.5	170.5	-176.2	43.9	0	0	0	110.5	N4 M5 V427 L431 Y452	N4-W425 WeakPolarHBondContact CA-O 3.26Å; M5-W425 HydrophobicContact CB-CB 4.09Å; M5-W425 HydrophobicContact CB-CE3 4.35Å; M5-W425 PolarHBondContact N-O 2.92Å; M5-W425 PolarHBondContact O-N 3.04Å; M5-W425 HydrophobicContact SD-CE3 4.16Å; W425-V427 HydrophobicContact CD2-CG2 3.97Å; W425-V427 HydrophobicContact CE3-CG2 3.84Å; W425-V427 HydrophobicContact CH2-CG1 4.32Å; W425-V427 HydrophobicContact CH2-CG2 4.06Å; W425-V427 HydrophobicContact CZ2-CG1 4.2Å; W425-V427 HydrophobicContact CZ2-CG2 4.17Å; W425-V427 HydrophobicContact CZ3-CG2 3.92Å; W425-V427 PolarHBondContact O-N 2.95Å; W425-L431 HydrophobicContact CH2-CD2 3.53Å; W425-L431 HydrophobicContact CZ2-CD2 3.71Å; W425-Y452 AromaticContact CE3-CE1 3.83Å; W425-Y452 HydrophobicContact CE3-CE1 3.83Å; W425-Y452 AromaticContact CZ3-CE1 3.74Å; W425-Y452 HydrophobicContact CZ3-CE1 3.74Å; W425-Y452 AromaticContact CZ3-CZ 3.91Å; W425-Y452 WeakPolarHBondContact CZ3-OH 3.33Å
426	N	91	Very high	93.3	Very high	77 Å²	77	87.8 Å²	87.8	41%	0.412	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	103.4	170.1	-64.5	-68.2	0	0	0	108.8	P428	N426-P428 WeakPolarHBondContact O-CD 3.02Å
427	V	91.8	Very high	93.1	Very high	1 Å²	1	84.3 Å²	84.3	1%	0.006	45%	0.453	C	S	.	.			trans	-66.6	124.5	-174.2	-175.4	0	0	0	0	109.9	L3 W425 L431 A432 I436 Y452	L3-V427 HydrophobicContact CB-CB 4.07Å; L3-V427 HydrophobicContact CB-CG2 3.86Å; L3-V427 WeakPolarHBondContact O-CG2 3.39Å; L3-V427 PolarHBondContact O-N 2.78Å; W425-V427 HydrophobicContact CD2-CG2 3.97Å; W425-V427 HydrophobicContact CE3-CG2 3.84Å; W425-V427 HydrophobicContact CH2-CG1 4.32Å; W425-V427 HydrophobicContact CH2-CG2 4.06Å; W425-V427 HydrophobicContact CZ2-CG1 4.2Å; W425-V427 HydrophobicContact CZ2-CG2 4.17Å; W425-V427 HydrophobicContact CZ3-CG2 3.92Å; W425-V427 PolarHBondContact O-N 2.95Å; V427-L431 HydrophobicContact CG1-CB 4.07Å; V427-L431 HydrophobicContact CG1-CD2 3.77Å; V427-A432 HydrophobicContact CG1-CB 3.94Å; V427-I436 HydrophobicContact CB-CD1 4.22Å; V427-I436 HydrophobicContact CG1-CD1 3.64Å; V427-I436 HydrophobicContact CG2-CD1 3.74Å; V427-Y452 HydrophobicContact CG2-CD1 4.01Å; V427-Y452 HydrophobicContact CG2-CE1 3.59Å
428	P	91.4	Very high	93.1	Very high	57 Å²	57	80 Å²	80	37%	0.37	43%	0.433	S	S	.	.			trans	-57.3	141.8	175.6	-25.8	34.9	0	0	0	111.5	N426 T430 L431 A432	N426-P428 WeakPolarHBondContact O-CD 3.02Å; P428-T430 PolarHBondContact O-N 3.1Å; P428-L431 PolarHBondContact O-N 3.4Å; P428-A432 PolarHBondContact O-N 3.26Å
429	P	90.7	Very high	93.1	Very high	70 Å²	70	79.7 Å²	79.7	46%	0.455	43%	0.427	S	S	.	.	H	α-helix	trans	-54.7	-33.3	-176.9	-27.5	34.1	0	0	0	113.9	R433	P429-R433 VanDerWaalsContact O-CB 3.3Å; P429-R433 WeakPolarHBondContact O-CB 3.3Å; P429-R433 PolarHBondContact O-N 3.1Å
430	T	91	Very high	93	Very high	86 Å²	86	75 Å²	75	53%	0.528	40%	0.399	S	S	.	.	H	α-helix	trans	-64.8	-44.2	177.5	52.2	0	0	0	0	112	P428 K434	P428-T430 PolarHBondContact O-N 3.1Å; T430-K434 VanDerWaalsContact O-CB 3.26Å; T430-K434 WeakPolarHBondContact O-CB 3.43Å; T430-K434 WeakPolarHBondContact O-CG 3.33Å; T430-K434 PolarHBondContact O-N 3.43Å
431	L	91.6	Very high	92.8	Very high	45 Å²	45	80.4 Å²	80.4	24%	0.236	41%	0.411	C	S	.	.	H	α-helix	trans	-76.4	-38.2	179.9	-158.9	130.3	0	0	0	111.2	W425 V427 P428 R433 K434 D435 I436	W425-L431 HydrophobicContact CH2-CD2 3.53Å; W425-L431 HydrophobicContact CZ2-CD2 3.71Å; V427-L431 HydrophobicContact CG1-CB 4.07Å; V427-L431 HydrophobicContact CG1-CD2 3.77Å; P428-L431 PolarHBondContact O-N 3.4Å; L431-R433 VanDerWaalsContact C-N 3.29Å; L431-R433 PolarHBondContact O-N 3.04Å; L431-K434 PolarHBondContact O-N 3.18Å; L431-D435 HydrophobicContact CD2-CB 4.22Å; L431-D435 HydrophobicContact CG-CB 3.97Å; L431-D435 WeakPolarHBondContact O-CA 3.26Å; L431-D435 VanDerWaalsContact O-CB 3.3Å; L431-D435 WeakPolarHBondContact O-CB 3.41Å; L431-D435 PolarHBondContact O-N 2.86Å; L431-I436 HydrophobicContact CD2-CG1 4.44Å; L431-I436 PolarHBondContact O-N 3.47Å
432	A	91.6	Very high	92.6	Very high	13 Å²	13	81.7 Å²	81.7	11%	0.107	41%	0.414	C	S	.	.	I	π-helix	trans	-55.4	-46	171	0	0	0	0	0	111.2	L3 V427 P428 L437	L3-A432 HydrophobicContact CD1-CB 4.09Å; V427-A432 HydrophobicContact CG1-CB 3.94Å; P428-A432 PolarHBondContact O-N 3.26Å; A432-L437 VanDerWaalsContact O-CB 3.32Å; A432-L437 WeakPolarHBondContact O-CB 3.27Å; A432-L437 PolarHBondContact O-N 2.95Å
433	R	92.7	Very high	92.6	Very high	178 Å²	178	78.7 Å²	78.7	67%	0.672	40%	0.397	S	S	*	.	I	π-helix	trans	-73.6	-42.8	-179.3	-169.7	-174.6	-58.9	159.8	2.6	113.5	P429 L431	P429-R433 VanDerWaalsContact O-CB 3.3Å; P429-R433 WeakPolarHBondContact O-CB 3.3Å; P429-R433 PolarHBondContact O-N 3.1Å; L431-R433 VanDerWaalsContact C-N 3.29Å; L431-R433 PolarHBondContact O-N 3.04Å
434	K	93.1	Very high	92.2	Very high	140 Å²	140	80.1 Å²	80.1	61%	0.609	41%	0.407	S	S	*	.	I	π-helix	trans	-90.2	-27.8	-170.9	-68.8	-175.8	177.3	-175.2	0	113.9	T430 L431	T430-K434 VanDerWaalsContact O-CB 3.26Å; T430-K434 WeakPolarHBondContact O-CB 3.43Å; T430-K434 WeakPolarHBondContact O-CG 3.33Å; T430-K434 PolarHBondContact O-N 3.43Å; L431-K434 PolarHBondContact O-N 3.18Å
435	D	92.4	Very high	92.3	Very high	59 Å²	59	78.3 Å²	78.3	32%	0.316	40%	0.4	S	S	.	.	I	π-helix	trans	-118.7	-39.8	-168.4	-59.5	-109.7	0	0	0	112.2	R407 L431 K439	R407-D435 IonicContact CZ-OD2 2.91Å; R407-D435 IonicContact NH1-OD1 3.52Å; R407-D435 IonicContact NH1-OD2 2.71Å; R407-D435 PolarHBondContact NH1-OD2 3.37Å; R407-D435 IonicContact NH2-OD2 3.53Å; R407-D435 PolarHBondContact NH2-OD2 3.27Å; L431-D435 HydrophobicContact CD2-CB 4.22Å; L431-D435 HydrophobicContact CG-CB 3.97Å; L431-D435 WeakPolarHBondContact O-CA 3.26Å; L431-D435 VanDerWaalsContact O-CB 3.3Å; L431-D435 WeakPolarHBondContact O-CB 3.41Å; L431-D435 PolarHBondContact O-N 2.86Å; D435-K439 WeakPolarHBondContact O-CE 3.4Å
436	I	93.1	Very high	92.5	Very high	4 Å²	4	74.5 Å²	74.5	2%	0.021	39%	0.386	C	S	.	.	I	π-helix	trans	-89.4	-51.8	-177.7	-58	-174.8	0	0	0	112.3	L3 V427 L431 P438 K439 V440 Y446 L447 Y452	L3-I436 HydrophobicContact CD1-CB 4.37Å; L3-I436 HydrophobicContact CD1-CD1 4.28Å; L3-I436 HydrophobicContact CD1-CG2 3.89Å; V427-I436 HydrophobicContact CB-CD1 4.22Å; V427-I436 HydrophobicContact CG1-CD1 3.64Å; V427-I436 HydrophobicContact CG2-CD1 3.74Å; L431-I436 HydrophobicContact CD2-CG1 4.44Å; L431-I436 PolarHBondContact O-N 3.47Å; I436-P438 VanDerWaalsContact C-CD 3.43Å; I436-P438 VanDerWaalsContact C-N 3.31Å; I436-K439 WeakPolarHBondContact O-CA 3.3Å; I436-K439 WeakPolarHBondContact O-CB 3.44Å; I436-K439 PolarHBondContact O-N 3.01Å; I436-V440 HydrophobicContact CG2-CG2 3.89Å; I436-V440 PolarHBondContact O-N 3.28Å; I436-V440 VanDerWaalsContact O-N 3.08Å; I436-Y446 HydrophobicContact CG2-CD1 4.24Å; I436-Y446 HydrophobicContact CG2-CE1 4.03Å; I436-L447 HydrophobicContact CG2-CD2 3.9Å; I436-Y452 HydrophobicContact CD1-CD1 4.46Å; I436-Y452 HydrophobicContact CD1-CE1 3.76Å; I436-Y452 HydrophobicContact CD1-CE2 4.42Å
437	L	93.2	Very high	92.6	Very high	74 Å²	74	72.1 Å²	72.1	39%	0.387	37%	0.373	S	S	.	.	H	α-helix	trans	-53.6	-39.9	-176.8	-179.6	64.2	0	0	0	113.5	A432 K439 V440 R441	A432-L437 VanDerWaalsContact O-CB 3.32Å; A432-L437 WeakPolarHBondContact O-CB 3.27Å; A432-L437 PolarHBondContact O-N 2.95Å; L437-K439 VanDerWaalsContact C-N 3.27Å; L437-K439 PolarHBondContact O-N 2.98Å; L437-V440 PolarHBondContact O-N 3.38Å; L437-R441 WeakPolarHBondContact O-CG 3.32Å; L437-R441 PolarHBondContact O-N 3.36Å; L437-R441 VanDerWaalsContact O-N 3.08Å
438	P	95.6	Very high	92.6	Very high	58 Å²	58	80.1 Å²	80.1	38%	0.377	41%	0.41	S	S	.	.	H	α-helix	trans	-60.3	-34.3	174.3	-25.5	36.6	0	0	0	113.7	I436	I436-P438 VanDerWaalsContact C-CD 3.43Å; I436-P438 VanDerWaalsContact C-N 3.31Å
439	K	95.3	Very high	92.7	Very high	97 Å²	97	81.2 Å²	81.2	42%	0.422	42%	0.419	S	S	.	.	H	α-helix	trans	-74.4	-41.5	179	-58.4	178.5	-175.5	-178	0	111.5	D435 I436 L437 R441 N442 D443 Y446	D435-K439 WeakPolarHBondContact O-CE 3.4Å; I436-K439 WeakPolarHBondContact O-CA 3.3Å; I436-K439 WeakPolarHBondContact O-CB 3.44Å; I436-K439 PolarHBondContact O-N 3.01Å; L437-K439 VanDerWaalsContact C-N 3.27Å; L437-K439 PolarHBondContact O-N 2.98Å; K439-R441 VanDerWaalsContact C-N 3.26Å; K439-R441 PolarHBondContact O-N 3.12Å; K439-N442 PolarHBondContact O-N 2.83Å; K439-D443 PolarHBondContact O-N 2.91Å; K439-Y446 HydrophobicContact CB-CD1 4.11Å; K439-Y446 HydrophobicContact CB-CD2 3.85Å; K439-Y446 HydrophobicContact CB-CE1 4.21Å; K439-Y446 HydrophobicContact CB-CE2 3.92Å; K439-Y446 HydrophobicContact CB-CG 3.95Å; K439-Y446 HydrophobicContact CD-CD2 4.23Å; K439-Y446 HydrophobicContact CD-CE1 4.01Å; K439-Y446 HydrophobicContact CD-CE2 3.44Å; K439-Y446 VanDerWaalsContact CD-CE2 3.44Å; K439-Y446 VanDerWaalsContact CD-OH 3.27Å; K439-Y446 WeakPolarHBondContact CD-OH 3.31Å; K439-Y446 HydrophobicContact CG-CE2 4.3Å; K439-Y446 PolarHBondContact NZ-OH 3.28Å; K439-Y446 VanDerWaalsContact NZ-OH 3.1Å
440	V	93.5	Very high	92.8	Very high	33 Å²	33	81.7 Å²	81.7	20%	0.2	42%	0.415	C	S	.	.	H	α-helix	trans	-61.5	-34.9	175.7	179.9	0	0	0	0	112	I436 L437 N442 D443 Y446 L447	I436-V440 HydrophobicContact CG2-CG2 3.89Å; I436-V440 PolarHBondContact O-N 3.28Å; I436-V440 VanDerWaalsContact O-N 3.08Å; L437-V440 PolarHBondContact O-N 3.38Å; V440-N442 PolarHBondContact O-N 3.01Å; V440-D443 WeakPolarHBondContact CA-O 3.44Å; V440-D443 CarbonylContact O-C 3.27Å; V440-D443 VanDerWaalsContact O-C 3.27Å; V440-Y446 HydrophobicContact CG2-CD1 4.08Å; V440-L447 HydrophobicContact CG1-CG 4.48Å; V440-L447 HydrophobicContact CG2-CD1 4.35Å; V440-L447 HydrophobicContact CG2-CD2 3.45Å; V440-L447 VanDerWaalsContact CG2-CD2 3.45Å; V440-L447 HydrophobicContact CG2-CG 3.75Å
441	R	92.3	Very high	92.9	Very high	189 Å²	189	78.9 Å²	78.9	71%	0.713	40%	0.404	S	S	*	.	H	α-helix	trans	-63.5	-31.4	174.6	-75.4	176.7	178.6	-179.1	-1.3	112.9	L437 K439	L437-R441 WeakPolarHBondContact O-CG 3.32Å; L437-R441 PolarHBondContact O-N 3.36Å; L437-R441 VanDerWaalsContact O-N 3.08Å; K439-R441 VanDerWaalsContact C-N 3.26Å; K439-R441 PolarHBondContact O-N 3.12Å
442	N	93.6	Very high	92.9	Very high	145 Å²	145	78 Å²	78	78%	0.775	40%	0.397	S	S	*	.	H	α-helix	trans	-88.3	-36.6	179.5	-65.4	-16.5	0	0	0	111.8	K439 V440	K439-N442 PolarHBondContact O-N 2.83Å; V440-N442 PolarHBondContact O-N 3.01Å
443	D	94.2	Very high	92.8	Very high	77 Å²	77	79.8 Å²	79.8	41%	0.412	41%	0.407	S	S	.	.			trans	-134.9	100.3	179.6	174	17.1	0	0	0	109.7	K439 V440 G445 Y446	K439-D443 PolarHBondContact O-N 2.91Å; V440-D443 WeakPolarHBondContact CA-O 3.44Å; V440-D443 CarbonylContact O-C 3.27Å; V440-D443 VanDerWaalsContact O-C 3.27Å; D443-G445 PolarHBondContact O-N 2.84Å; D443-G445 WeakPolarHBondContact OD1-CA 3.22Å; D443-G445 PolarHBondContact OD1-N 3.25Å; D443-Y446 WeakPolarHBondContact O-CB 3.4Å; D443-Y446 PolarHBondContact O-N 3.08Å; D443-Y446 PolarHBondContact OD2-N 3.29Å
444	P	86.2	Confident	92.7	Very high	107 Å²	107	72.5 Å²	72.5	70%	0.695	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.2	176.5	-26.2	35.8	0	0	0	113.8	Y446	P444-Y446 PolarHBondContact O-N 3.38Å
445	G	92.9	Very high	92.4	Very high	28 Å²	28	67.8 Å²	67.8	29%	0.289	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.3	176.3	0	0	0	0	0	114	D443 L447 E448 S449	D443-G445 PolarHBondContact O-N 2.84Å; D443-G445 WeakPolarHBondContact OD1-CA 3.22Å; D443-G445 PolarHBondContact OD1-N 3.25Å; G445-L447 PolarHBondContact O-N 2.89Å; G445-E448 PolarHBondContact O-N 2.91Å; G445-S449 WeakPolarHBondContact O-CB 3.4Å; G445-S449 PolarHBondContact O-N 2.86Å; G445-S449 PolarHBondContact O-OG 3.02Å
446	Y	94.6	Very high	91.8	Very high	26 Å²	26	73.3 Å²	73.3	10%	0.102	38%	0.379	C	S	.	.	H	α-helix	trans	-57.7	-36.2	-178.6	-177.6	-91.8	0	0	0	112.4	I436 K439 V440 D443 P444 S449 H450 Y452	I436-Y446 HydrophobicContact CG2-CD1 4.24Å; I436-Y446 HydrophobicContact CG2-CE1 4.03Å; K439-Y446 HydrophobicContact CB-CD1 4.11Å; K439-Y446 HydrophobicContact CB-CD2 3.85Å; K439-Y446 HydrophobicContact CB-CE1 4.21Å; K439-Y446 HydrophobicContact CB-CE2 3.92Å; K439-Y446 HydrophobicContact CB-CG 3.95Å; K439-Y446 HydrophobicContact CD-CD2 4.23Å; K439-Y446 HydrophobicContact CD-CE1 4.01Å; K439-Y446 HydrophobicContact CD-CE2 3.44Å; K439-Y446 VanDerWaalsContact CD-CE2 3.44Å; K439-Y446 VanDerWaalsContact CD-OH 3.27Å; K439-Y446 WeakPolarHBondContact CD-OH 3.31Å; K439-Y446 HydrophobicContact CG-CE2 4.3Å; K439-Y446 PolarHBondContact NZ-OH 3.28Å; K439-Y446 VanDerWaalsContact NZ-OH 3.1Å; V440-Y446 HydrophobicContact CG2-CD1 4.08Å; D443-Y446 WeakPolarHBondContact O-CB 3.4Å; D443-Y446 PolarHBondContact O-N 3.08Å; D443-Y446 PolarHBondContact OD2-N 3.29Å; P444-Y446 PolarHBondContact O-N 3.38Å; Y446-S449 WeakPolarHBondContact CA-OG 3.48Å; Y446-S449 PolarHBondContact O-OG 2.83Å; Y446-H450 AromaticContact CD2-CE1 3.56Å; Y446-H450 AromaticContact CD2-ND1 3.7Å; Y446-H450 AromaticContact CE2-CE1 3.31Å; Y446-H450 WeakPolarHBondContact CE2-CE1 3.4Å; Y446-H450 AromaticContact CE2-ND1 3.65Å; Y446-H450 AromaticContact CE2-NE2 3.65Å; Y446-H450 AromaticContact CZ-CE1 3.93Å; Y446-H450 AromaticContact CZ-ND1 3.96Å; Y446-H450 WeakPolarHBondContact O-CB 3.32Å; Y446-H450 PolarHBondContact O-N 3.03Å; Y446-H450 PolarHBondContact O-ND1 3.38Å; Y446-Y452 HydrophobicContact CE1-CE2 4.01Å
447	L	93.6	Very high	91	Very high	27 Å²	27	74.2 Å²	74.2	14%	0.141	39%	0.39	C	S	.	.	H	α-helix	trans	-68.1	-50.7	-177.8	-62.2	-172.4	0	0	0	111.9	L3 I436 V440 G445 H450 G451 Y452 V454	L3-L447 HydrophobicContact CD2-CD1 3.82Å; L3-L447 HydrophobicContact CD2-CD2 3.31Å; L3-L447 HydrophobicContact CD2-CG 4.15Å; I436-L447 HydrophobicContact CG2-CD2 3.9Å; V440-L447 HydrophobicContact CG1-CG 4.48Å; V440-L447 HydrophobicContact CG2-CD1 4.35Å; V440-L447 HydrophobicContact CG2-CD2 3.45Å; V440-L447 VanDerWaalsContact CG2-CD2 3.45Å; V440-L447 HydrophobicContact CG2-CG 3.75Å; G445-L447 PolarHBondContact O-N 2.89Å; L447-H450 CarbonylContact O-C 3.49Å; L447-H450 PolarHBondContact O-N 3.22Å; L447-G451 PolarHBondContact O-N 3.08Å; L447-Y452 HydrophobicContact CD2-CD2 4.07Å; L447-Y452 HydrophobicContact CD2-CG 4.3Å; L447-Y452 PolarHBondContact O-N 3.35Å; L447-V454 HydrophobicContact CD1-CG2 3.44Å; L447-V454 VanDerWaalsContact CD1-CG2 3.44Å
448	E	91	Very high	89.8	Confident	170 Å²	170	79 Å²	79	79%	0.794	40%	0.403	S	S	*	.	H	α-helix	trans	-65	-45.6	-179.7	-65.9	175.1	-172.9	0	0	111.5	G445 H450 G451	G445-E448 PolarHBondContact O-N 2.91Å; E448-H450 PolarHBondContact O-N 3Å; E448-H450 VanDerWaalsContact O-N 3.12Å; E448-G451 PolarHBondContact O-N 3.48Å
449	S	93.9	Very high	88.7	Confident	80 Å²	80	84.1 Å²	84.1	56%	0.559	43%	0.427	S	S	*	.	H	α-helix	trans	-61	-22.8	178.3	56.4	0	0	0	0	113.6	G445 Y446	G445-S449 WeakPolarHBondContact O-CB 3.4Å; G445-S449 PolarHBondContact O-N 2.86Å; G445-S449 PolarHBondContact O-OG 3.02Å; Y446-S449 WeakPolarHBondContact CA-OG 3.48Å; Y446-S449 PolarHBondContact O-OG 2.83Å
450	H	93.2	Very high	87.7	Confident	79 Å²	79	80.9 Å²	80.9	37%	0.366	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	13.3	177.3	-63.1	74.8	0	0	0	112.7	M5 Y446 L447 E448 Y452	M5-H450 WeakPolarHBondContact CE-O 3.33Å; M5-H450 WeakPolarHBondContact CG-O 3.49Å; Y446-H450 AromaticContact CD2-CE1 3.56Å; Y446-H450 AromaticContact CD2-ND1 3.7Å; Y446-H450 AromaticContact CE2-CE1 3.31Å; Y446-H450 WeakPolarHBondContact CE2-CE1 3.4Å; Y446-H450 AromaticContact CE2-ND1 3.65Å; Y446-H450 AromaticContact CE2-NE2 3.65Å; Y446-H450 AromaticContact CZ-CE1 3.93Å; Y446-H450 AromaticContact CZ-ND1 3.96Å; Y446-H450 WeakPolarHBondContact O-CB 3.32Å; Y446-H450 PolarHBondContact O-N 3.03Å; Y446-H450 PolarHBondContact O-ND1 3.38Å; L447-H450 CarbonylContact O-C 3.49Å; L447-H450 PolarHBondContact O-N 3.22Å; E448-H450 PolarHBondContact O-N 3Å; E448-H450 VanDerWaalsContact O-N 3.12Å; H450-Y452 HydrophobicContact CB-CD2 3.67Å; H450-Y452 HydrophobicContact CB-CE2 3.39Å; H450-Y452 PolarHBondContact O-N 3.4Å
451	G	92.5	Very high	86.8	Confident	28 Å²	28	91 Å²	91	29%	0.289	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	26.2	172.7	0	0	0	0	0	115.7	M5 M6 L447 E448	M5-G451 CarbonylContact C-O 3.42Å; M5-G451 VanDerWaalsContact CA-O 3.26Å; M5-G451 WeakPolarHBondContact CA-O 3.25Å; M6-G451 PolarHBondContact N-O 3.28Å; L447-G451 PolarHBondContact O-N 3.08Å; E448-G451 PolarHBondContact O-N 3.48Å
452	Y	92.4	Very high	86.1	Confident	25 Å²	25	87.5 Å²	87.5	10%	0.098	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132.7	174	-59.3	-83.5	0	0	0	112.5	L3 N4 M5 W425 V427 I436 Y446 L447 H450	L3-Y452 HydrophobicContact CB-CD1 4.14Å; L3-Y452 HydrophobicContact CD2-CD1 4.25Å; L3-Y452 HydrophobicContact CD2-CG 3.99Å; N4-Y452 CarbonylContact O-C 3.55Å; N4-Y452 WeakPolarHBondContact O-CA 3.2Å; M5-Y452 HydrophobicContact CB-CD1 3.86Å; M5-Y452 HydrophobicContact CB-CE1 3.96Å; M5-Y452 HydrophobicContact CG-CD1 4.24Å; M5-Y452 HydrophobicContact CG-CE1 4.22Å; M5-Y452 HydrophobicContact SD-CE1 4.42Å; W425-Y452 AromaticContact CE3-CE1 3.83Å; W425-Y452 HydrophobicContact CE3-CE1 3.83Å; W425-Y452 AromaticContact CZ3-CE1 3.74Å; W425-Y452 HydrophobicContact CZ3-CE1 3.74Å; W425-Y452 AromaticContact CZ3-CZ 3.91Å; W425-Y452 WeakPolarHBondContact CZ3-OH 3.33Å; V427-Y452 HydrophobicContact CG2-CD1 4.01Å; V427-Y452 HydrophobicContact CG2-CE1 3.59Å; I436-Y452 HydrophobicContact CD1-CD1 4.46Å; I436-Y452 HydrophobicContact CD1-CE1 3.76Å; I436-Y452 HydrophobicContact CD1-CE2 4.42Å; Y446-Y452 HydrophobicContact CE1-CE2 4.01Å; L447-Y452 HydrophobicContact CD2-CD2 4.07Å; L447-Y452 HydrophobicContact CD2-CG 4.3Å; L447-Y452 PolarHBondContact O-N 3.35Å; H450-Y452 HydrophobicContact CB-CD2 3.67Å; H450-Y452 HydrophobicContact CB-CE2 3.39Å; H450-Y452 PolarHBondContact O-N 3.4Å
453	T	89.8	Confident	85.3	Confident	51 Å²	51	83.6 Å²	83.6	31%	0.313	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136	168.1	-53.7	0	0	0	0	109.8	L3 N4 A463	L3-T453 WeakPolarHBondContact CA-O 3.1Å; N4-T453 PolarHBondContact N-O 3.32Å; N4-T453 PolarHBondContact O-N 2.77Å; T453-A463 HydrophobicContact CG2-CB 3.6Å
454	V	89.6	Confident	84.4	Confident	25 Å²	25	86.1 Å²	86.1	15%	0.152	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	129.8	174.8	-175.8	0	0	0	0	109.6	M1 L2 L3 L447 A463 I464	M1-V454 HydrophobicContact CB-CG1 4.15Å; M1-V454 HydrophobicContact CE-CG1 4.45Å; M1-V454 HydrophobicContact CG-CG1 3.87Å; M1-V454 HydrophobicContact SD-CG1 4.27Å; L2-V454 WeakPolarHBondContact O-CA 3.29Å; L3-V454 HydrophobicContact CD2-CG2 4.07Å; L447-V454 HydrophobicContact CD1-CG2 3.44Å; L447-V454 VanDerWaalsContact CD1-CG2 3.44Å; V454-A463 CarbonylContact O-C 3.58Å; V454-A463 VanDerWaalsContact O-CA 3.22Å; V454-A463 WeakPolarHBondContact O-CA 3.39Å; V454-I464 HydrophobicContact CB-CB 4.39Å; V454-I464 HydrophobicContact CG1-CB 4.25Å; V454-I464 HydrophobicContact CG1-CD1 4.12Å; V454-I464 HydrophobicContact CG1-CG1 4.48Å; V454-I464 PolarHBondContact O-N 2.84Å
455	M	86.9	Confident	84.3	Confident	41 Å²	41	85.1 Å²	85.1	20%	0.202	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.6	179.1	-55.2	-175.3	79	0	0	111.6	M1 L2 N4 G457 S460	M1-M455 WeakPolarHBondContact CA-O 3.38Å; L2-M455 PolarHBondContact N-O 3.15Å; L2-M455 PolarHBondContact O-N 3.25Å; N4-M455 HydrophobicContact CB-SD 4.33Å; M455-G457 VanDerWaalsContact C-N 3.32Å; M455-G457 PolarHBondContact O-N 3.39Å; M455-S460 WeakPolarHBondContact CE-O 3.45Å
456	R	81.5	Confident	83.9	Confident	175 Å²	175	88.1 Å²	88.1	66%	0.66	44%	0.438	S	S	*	.	S	Bend	trans	-62.5	-34.3	178.1	-79.9	-164.6	175.9	-156.7	2.8	113.5	E462 I464	R456-E462 PolarHBondContact N-O 3.04Å; R456-I464 HydrophobicContact CB-CD1 4.48Å; R456-I464 HydrophobicContact CG-CD1 3.67Å; R456-I464 HydrophobicContact CG-CG1 3.55Å
457	G	76	Confident	83.3	Confident	24 Å²	24	91.6 Å²	91.6	25%	0.247	46%	0.457	C	S	.	.			trans	-173.4	172.6	178.5	0	0	0	0	0	112.4	M455 N459 S460	M455-G457 VanDerWaalsContact C-N 3.32Å; M455-G457 PolarHBondContact O-N 3.39Å; G457-N459 VanDerWaalsContact C-N 3.26Å; G457-N459 PolarHBondContact O-N 3.35Å; G457-S460 PolarHBondContact O-N 2.93Å; G457-S460 VanDerWaalsContact O-N 3.1Å
458	W	67	Low	82.7	Confident	173 Å²	173	95.4 Å²	95.4	66%	0.655	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-36	-175.6	-78.7	102.3	0	0	0	113.7	L2	L2-W458 HydrophobicContact CD1-CB 4Å; L2-W458 HydrophobicContact CD1-CD2 3.36Å; L2-W458 HydrophobicContact CD1-CE3 4Å; L2-W458 HydrophobicContact CD1-CG 3.34Å; L2-W458 HydrophobicContact CD1-CZ2 4.29Å; L2-W458 HydrophobicContact CD2-CD2 4.18Å; L2-W458 VanDerWaalsContact CD2-CE2 3.47Å; L2-W458 HydrophobicContact CD2-CH2 4.23Å; L2-W458 HydrophobicContact CD2-CZ2 3.5Å; L2-W458 VanDerWaalsContact CD2-CZ2 3.5Å; L2-W458 HydrophobicContact CG-CD2 4.4Å
459	N	72.5	Confident	82.2	Confident	166 Å²	166	90.7 Å²	90.7	89%	0.888	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	1	-178.7	-62.4	-20.3	0	0	0	113	G457	G457-N459 VanDerWaalsContact C-N 3.26Å; G457-N459 PolarHBondContact O-N 3.35Å
460	S	74.4	Confident	81.4	Confident	29 Å²	29	91.4 Å²	91.4	20%	0.203	45%	0.449	C	S	.	.			trans	-89.8	135.9	179.4	-178.4	0	0	0	0	109.1	M455 G457 E462	M455-S460 WeakPolarHBondContact CE-O 3.45Å; G457-S460 PolarHBondContact O-N 2.93Å; G457-S460 VanDerWaalsContact O-N 3.1Å; S460-E462 VanDerWaalsContact C-N 3.3Å; S460-E462 WeakPolarHBondContact OG-CB 3.41Å; S460-E462 PolarHBondContact OG-N 3.19Å
461	R	75	Confident	80.5	Confident	245 Å²	245	92.3 Å²	92.3	93%	0.925	46%	0.455	S	S	*	.			trans	-90.7	1.1	167.5	-65.4	-178.1	-179.4	162.1	0.1	112
462	E	76.6	Confident	79.6	Confident	117 Å²	117	97.2 Å²	97.2	55%	0.547	47%	0.467	S	S	.	.			trans	-86.6	116.9	-177.6	-61.5	175.9	175.7	0	0	110.2	R456 S460	R456-E462 PolarHBondContact N-O 3.04Å; S460-E462 VanDerWaalsContact C-N 3.3Å; S460-E462 WeakPolarHBondContact OG-CB 3.41Å; S460-E462 PolarHBondContact OG-N 3.19Å
463	A	76.7	Confident	78.6	Confident	63 Å²	63	103.3 Å²	103.3	52%	0.521	50%	0.498	S	S	.	.	B	Isolated β-bridge	trans	-73.7	151.8	165.7	0	0	0	0	0	110.5	T453 V454	T453-A463 HydrophobicContact CG2-CB 3.6Å; V454-A463 CarbonylContact O-C 3.58Å; V454-A463 VanDerWaalsContact O-CA 3.22Å; V454-A463 WeakPolarHBondContact O-CA 3.39Å
464	I	76.8	Confident	77.5	Confident	130 Å²	130	108 Å²	108	67%	0.667	52%	0.515	S	S	*	.			trans	-102.8	0	174.2	-56.3	177.9	0	0	0	109.3	M1 V454 R456	M1-I464 HydrophobicContact CE-CD1 3.76Å; M1-I464 HydrophobicContact CG-CD1 4.26Å; V454-I464 HydrophobicContact CB-CB 4.39Å; V454-I464 HydrophobicContact CG1-CB 4.25Å; V454-I464 HydrophobicContact CG1-CD1 4.12Å; V454-I464 HydrophobicContact CG1-CG1 4.48Å; V454-I464 PolarHBondContact O-N 2.84Å; R456-I464 HydrophobicContact CB-CD1 4.48Å; R456-I464 HydrophobicContact CG-CD1 3.67Å; R456-I464 HydrophobicContact CG-CG1 3.55Å

Retrieved 464 of 464 residues in 125.9 ms (Link to these results)

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