G4VPT8_SCHMA Loading...

Homeobox domain-containing protein

AlphaFold DB , UniProt , Accession G4VPT8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 525 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	38.9	Very low	35.8	Very low	245 Å²	245	147 Å²	147	100%	1.207	81%	0.809	S	S	*	*				0	156.8	0	-80.6	171.1	161.1	0	0	108.8
2	N	33.5	Very low	35.7	Very low	163 Å²	163	144.8 Å²	144.8	87%	0.872	80%	0.803	S	S	*	*			trans	-52.4	165.2	172.1	-65.4	18	0	0	0	113.1
3	S	34.8	Very low	35.5	Very low	110 Å²	110	145.5 Å²	145.5	77%	0.769	80%	0.797	S	S	*	*			cis	-167.3	-176.9	-18.7	-173.6	0	0	0	0	109
4	T	33.8	Very low	35.6	Very low	113 Å²	113	147.6 Å²	147.6	69%	0.693	80%	0.804	S	S	*	*			trans	-71.7	-173.2	-179.8	52.3	0	0	0	0	116.3
5	T	39.1	Very low	35.3	Very low	113 Å²	113	146.1 Å²	146.1	69%	0.693	80%	0.795	S	S	*	*			trans	83	146.5	168.2	69.1	0	0	0	0	116.6
6	D	35	Very low	35.4	Very low	143 Å²	143	149.4 Å²	149.4	77%	0.765	80%	0.803	S	S	*	*			cis	-169.5	161.7	-22.3	-94.6	-22.4	0	0	0	106.6
7	D	37.7	Very low	35.2	Very low	162 Å²	162	147.4 Å²	147.4	87%	0.866	80%	0.803	S	S	*	*			trans	-172.1	172.2	132.1	-123.1	-39.4	0	0	0	116.8
8	K	36.3	Very low	35.2	Very low	178 Å²	178	145.8 Å²	145.8	77%	0.774	80%	0.801	S	S	*	*			trans	-111.6	165.6	-171.7	-57.9	158.7	179.3	162.2	0	114.1
9	T	36.8	Very low	35.1	Very low	129 Å²	129	147 Å²	147	79%	0.791	81%	0.805	S	S	*	*				-170.2	120.5	125.5	29.3	0	0	0	0	110.3
10	T	33.6	Very low	34.8	Very low	110 Å²	110	144.9 Å²	144.9	68%	0.675	80%	0.797	S	S	*	*				64.8	118.5	87.3	-22.1	0	0	0	0	113.4
11	L	34.3	Very low	34.6	Very low	151 Å²	151	146.7 Å²	146.7	79%	0.791	80%	0.8	S	S	*	*				-174.6	169.5	74.7	-74.2	157.7	0	0	0	107.6
12	T	35.2	Very low	34.2	Very low	121 Å²	121	140.5 Å²	140.5	74%	0.742	78%	0.78	S	S	*	*			cis	-154.5	-171	1.9	-4	0	0	0	0	111.3
13	E	33.1	Very low	33.9	Very low	154 Å²	154	140.5 Å²	140.5	72%	0.72	78%	0.78	S	S	*	*			trans	-96.8	167.3	-174.4	-51.6	150.2	132.7	0	0	115.3
14	I	35.7	Very low	33.9	Very low	174 Å²	174	140.5 Å²	140.5	89%	0.892	78%	0.778	S	S	*	*				-150.1	150.4	115.8	-63.5	-159.5	0	0	0	107.8
15	N	32	Very low	33.8	Very low	126 Å²	126	140.5 Å²	140.5	67%	0.674	78%	0.779	S	S	*	*			trans	-100.8	163	-169.7	-58.1	-63.7	0	0	0	115.4
16	E	36.3	Very low	33.1	Very low	198 Å²	198	141.2 Å²	141.2	93%	0.925	78%	0.784	S	S	*	*				-169.4	170.5	118.1	-104.5	176.1	-163.9	0	0	112.7
17	S	32.7	Very low	32.8	Very low	115 Å²	115	140 Å²	140	80%	0.804	78%	0.782	S	S	*	*			trans	-124.2	164.1	-138.8	-57.8	0	0	0	0	117.5
18	P	34.6	Very low	32.2	Very low	119 Å²	119	137.7 Å²	137.7	77%	0.773	78%	0.779	S	S	*	*			trans	-112.7	158	-166.3	41	-33.5	0	0	0	117.2
19	I	33.7	Very low	31.7	Very low	169 Å²	169	134.7 Å²	134.7	87%	0.867	78%	0.78	S	S	*	*			trans	-153.3	154.3	168.5	-54.4	-178.3	0	0	0	108.5
20	T	29.5	Very low	31.3	Very low	105 Å²	105	133.6 Å²	133.6	64%	0.644	78%	0.776	S	S	*	*			cis	-170.3	142.1	-46.7	-79.9	0	0	0	0	108
21	E	29.3	Very low	31.1	Very low	183 Å²	183	136.5 Å²	136.5	86%	0.855	78%	0.782	S	S	*	*			trans	62.7	154.8	169	-79.4	165.7	-165.9	0	0	118.1
22	S	31.2	Very low	30.7	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	78%	0.781	S	S	*	*			cis	-147.5	180	3.3	46.2	0	0	0	0	111.6
23	N	27.3	Very low	30.3	Very low	163 Å²	163	135.1 Å²	135.1	87%	0.872	78%	0.778	S	S	*	*			trans	-92.2	161.6	-166.5	-92.7	-42.8	0	0	0	116.5
24	P	35.1	Very low	30.1	Very low	109 Å²	109	138 Å²	138	71%	0.708	79%	0.789	S	S	*	*			trans	-98.7	173.3	-167.8	40	-38.5	0	0	0	115.6
25	P	30.7	Very low	29.7	Very low	113 Å²	113	136.2 Å²	136.2	73%	0.734	78%	0.78	S	S	*	*			trans	-143.7	141.7	132.9	36.6	-21.3	0	0	0	117.1
26	T	26.1	Very low	29.4	Very low	128 Å²	128	137.4 Å²	137.4	79%	0.785	79%	0.786	S	S	*	*			trans	30.7	155.7	147.5	22	0	0	0	0	126.6
27	T	27.7	Very low	29	Very low	119 Å²	119	134.3 Å²	134.3	73%	0.73	79%	0.786	S	S	*	*			trans	80.5	93	149.2	38.7	0	0	0	0	122.7
28	S	24.7	Very low	28.7	Very low	113 Å²	113	134.4 Å²	134.4	79%	0.79	79%	0.787	S	S	*	*				39.7	104.4	123.9	60.7	0	0	0	0	121.9
29	S	27.3	Very low	28.4	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	79%	0.788	S	S	*	*			trans	-177.7	153.5	160.1	-175.6	0	0	0	0	108.3
30	C	26.7	Very low	28.1	Very low	105 Å²	105	131.3 Å²	131.3	71%	0.709	78%	0.783	S	S	*	*			cis	-162	172.4	-28.6	-105.3	0	0	0	0	109.4
31	H	30.4	Very low	28	Very low	171 Å²	171	132.9 Å²	132.9	79%	0.792	80%	0.795	S	S	*	*			trans	31.3	115.6	153.3	-79.8	-97.2	0	0	0	123
32	N	26.4	Very low	27.8	Very low	147 Å²	147	129.3 Å²	129.3	79%	0.786	79%	0.79	S	S	*	*			trans	10.7	150.5	136.3	-73.7	-6.7	0	0	0	123.3
33	S	26	Very low	27.7	Very low	97 Å²	97	128.9 Å²	128.9	68%	0.678	79%	0.788	S	S	*	*			trans	79.5	115.9	146.1	66.3	0	0	0	0	119.7
34	F	28.7	Very low	27.7	Very low	215 Å²	215	126.4 Å²	126.4	94%	0.943	78%	0.783	S	S	*	*				-142	166	129.7	-112	-80	0	0	0	109.7
35	I	27	Very low	27.3	Very low	135 Å²	135	127.4 Å²	127.4	69%	0.692	79%	0.791	S	S	*	*			trans	-135.8	151.8	-157.6	-81.7	174.3	0	0	0	111.6
36	N	27	Very low	27.6	Very low	151 Å²	151	126.1 Å²	126.1	81%	0.807	79%	0.79	S	S	*	*			trans	65.6	121.9	166.5	-70.3	-15.1	0	0	0	120
37	S	27.9	Very low	28.5	Very low	133 Å²	133	124.4 Å²	124.4	93%	0.93	78%	0.78	S	S	*	*				-152.9	153.3	121.3	-68	0	0	0	0	108.4
38	S	25	Very low	29.6	Very low	117 Å²	117	124.1 Å²	124.1	82%	0.818	77%	0.774	S	S	*	*			trans	-120.1	152.8	-166.3	53.5	0	0	0	0	114.2
39	S	29	Very low	30.9	Very low	115 Å²	115	121.8 Å²	121.8	80%	0.804	75%	0.752	S	S	*	*			trans	-172.3	152.2	152.2	31.2	0	0	0	0	112.9
40	S	28.1	Very low	32.4	Very low	109 Å²	109	116.5 Å²	116.5	76%	0.762	72%	0.715	S	S	*	*			trans	62	107.8	158.1	-57.5	0	0	0	0	119.9
41	P	26.4	Very low	33.7	Very low	138 Å²	138	114.3 Å²	114.3	90%	0.896	70%	0.704	S	S	*	*			trans	-87.1	128.9	174	33.8	-32	0	0	0	113
42	S	25.9	Very low	35	Very low	107 Å²	107	111.8 Å²	111.8	75%	0.748	69%	0.688	S	S	*	*			trans	-149.2	139.1	171.5	60.6	0	0	0	0	113.9
43	S	28	Very low	36.7	Very low	107 Å²	107	106.2 Å²	106.2	75%	0.748	66%	0.66	S	S	*	*	S	Bend	trans	46.7	88.5	166.4	61.4	0	0	0	0	118.3
44	S	27.4	Very low	38.4	Very low	111 Å²	111	109 Å²	109	78%	0.776	66%	0.662	S	S	*	*			trans	46.1	110.1	148	61.4	0	0	0	0	118.6	A46	S44-A46 VanDerWaalsContact C-N 3.33Å; S44-A46 PolarHBondContact O-N 3.42Å
45	C	27.3	Very low	39.6	Very low	129 Å²	129	105.2 Å²	105.2	87%	0.872	65%	0.646	S	S	*	*			trans	-59.5	91.3	162	-61.8	0	0	0	0	111.2	T47	C45-T47 PolarHBondContact O-N 3.08Å
46	A	36.5	Very low	40.6	Very low	87 Å²	87	103.1 Å²	103.1	72%	0.719	64%	0.64	S	S	*	*			trans	-66	100.9	159.5	0	0	0	0	0	106.4	S44 D48	S44-A46 VanDerWaalsContact C-N 3.33Å; S44-A46 PolarHBondContact O-N 3.42Å; A46-D48 PolarHBondContact O-N 3.16Å
47	T	46.1	Very low	41.6	Very low	92 Å²	92	102.2 Å²	102.2	56%	0.564	64%	0.636	S	S	*	*			trans	-59.6	135.4	-169.2	43.8	0	0	0	0	111.5	C45 L49	C45-T47 PolarHBondContact O-N 3.08Å; T47-L49 PolarHBondContact O-N 3.1Å
48	D	50.4	Low	42.2	Very low	113 Å²	113	99.1 Å²	99.1	60%	0.604	61%	0.608	S	S	*	*	S	Bend	trans	-69.9	24.5	178.5	-74.4	-27.1	0	0	0	113.7	A46 L58	A46-D48 PolarHBondContact O-N 3.16Å; D48-L58 HydrophobicContact CB-CD1 3.53Å; D48-L58 HydrophobicContact CB-CG 4.33Å; D48-L58 VanDerWaalsContact CG-CD1 3.49Å; D48-L58 WeakPolarHBondContact OD1-CD1 3.4Å
49	L	52.3	Low	43	Very low	64 Å²	64	98.9 Å²	98.9	34%	0.335	59%	0.594	S	S	.	*	B	Isolated β-bridge	trans	-113	136.5	-175.3	-52.1	-179.9	0	0	0	108	T47 A51 P56	T47-L49 PolarHBondContact O-N 3.1Å; L49-A51 PolarHBondContact O-N 2.93Å; L49-P56 HydrophobicContact CD2-CB 3.84Å; L49-P56 HydrophobicContact CD2-CG 4.23Å
50	C	57.5	Low	43.2	Very low	4 Å²	4	98 Å²	98	3%	0.027	59%	0.585	C	S	.	*			trans	-59.9	131.3	170.5	165.1	0	0	0	0	111.4	W52 C53 Q54 K55 P83 C85	C50-W52 PolarHBondContact O-N 3.01Å; C50-W52 PolarHBondContact SG-N 3.3Å; C50-C53 HydrophobicContact CB-CB 4.43Å; C50-C53 WeakPolarHBondContact CB-SG 3.47Å; C50-C53 PolarHBondContact O-N 3.09Å; C50-C53 PolarHBondContact SG-N 2.87Å; C50-C53 VanDerWaalsContact SG-SG 3.67Å; C50-Q54 VanDerWaalsContact O-CA 3.29Å; C50-Q54 WeakPolarHBondContact O-CA 3.39Å; C50-Q54 PolarHBondContact O-N 3.21Å; C50-K55 PolarHBondContact N-O 3.41Å; C50-P83 WeakPolarHBondContact CA-O 3.15Å; C50-C85 HydrophobicContact CB-CB 3.46Å; C50-C85 VanDerWaalsContact CB-CB 3.46Å; C50-C85 VanDerWaalsContact CB-N 3.25Å; C50-C85 PolarHBondContact SG-N 2.83Å
51	A	54.5	Low	43.4	Very low	58 Å²	58	99.8 Å²	99.8	48%	0.479	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.6	-6.3	-178.6	0	0	0	0	0	115.3	L49 V82 P83	L49-A51 PolarHBondContact O-N 2.93Å; A51-V82 HydrophobicContact CB-CG1 3.27Å; A51-P83 PolarHBondContact N-O 3.12Å; A51-P83 VanDerWaalsContact N-O 3.07Å
52	W	58.6	Low	43.6	Very low	118 Å²	118	102.1 Å²	102.1	45%	0.447	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121	-29.1	175.4	-69.1	-24	0	0	0	115.9	C50 V84 N93 L94 A97	C50-W52 PolarHBondContact O-N 3.01Å; C50-W52 PolarHBondContact SG-N 3.3Å; W52-V84 HydrophobicContact CE3-CG1 4.11Å; W52-V84 HydrophobicContact CE3-CG2 4.5Å; W52-V84 HydrophobicContact CZ3-CG1 4.28Å; W52-V84 HydrophobicContact CZ3-CG2 4.43Å; W52-N93 HydrophobicContact CD2-CB 4.33Å; W52-N93 HydrophobicContact CE3-CB 3.85Å; W52-N93 HydrophobicContact CZ3-CB 4.2Å; W52-L94 HydrophobicContact CH2-CB 4.22Å; W52-L94 HydrophobicContact CH2-CD1 3.89Å; W52-L94 HydrophobicContact CH2-CG 4.44Å; W52-L94 HydrophobicContact CZ3-CB 3.71Å; W52-L94 HydrophobicContact CZ3-CD1 3.74Å; W52-L94 HydrophobicContact CZ3-CG 4.26Å; W52-A97 HydrophobicContact CH2-CB 3.9Å; W52-A97 HydrophobicContact CZ2-CB 4.06Å
53	C	62.2	Low	43.8	Very low	31 Å²	31	104 Å²	104	21%	0.209	56%	0.563	C	S	.	*	T	Hydrogen-bonded Turn	trans	-99.9	-13.4	175.7	73.6	0	0	0	0	113.3	C50 K55 C85 C90	C50-C53 HydrophobicContact CB-CB 4.43Å; C50-C53 WeakPolarHBondContact CB-SG 3.47Å; C50-C53 PolarHBondContact O-N 3.09Å; C50-C53 PolarHBondContact SG-N 2.87Å; C50-C53 VanDerWaalsContact SG-SG 3.67Å; C53-K55 HydrophobicContact CB-CG 4.12Å; C53-K55 WeakPolarHBondContact O-CG 3.17Å; C53-K55 PolarHBondContact O-N 3Å; C53-K55 VanDerWaalsContact SG-CB 3.58Å; C53-C85 WeakPolarHBondContact CB-SG 3.28Å; C53-C85 WeakPolarHBondContact SG-CB 3.39Å; C53-C85 CovalentContact SG-SG 2.06Å; C53-C85 PolarHBondContact SG-SG 3.27Å; C53-C90 VanDerWaalsContact CB-SG 3.5Å
54	Q	59.9	Low	43.8	Very low	155 Å²	155	102.7 Å²	102.7	72%	0.724	55%	0.554	S	S	*	*			trans	50.9	14	-170.8	-65.3	-178.5	-14.8	0	0	114.7	C50	C50-Q54 VanDerWaalsContact O-CA 3.29Å; C50-Q54 WeakPolarHBondContact O-CA 3.39Å; C50-Q54 PolarHBondContact O-N 3.21Å
55	K	54.6	Low	43.9	Very low	136 Å²	136	102.5 Å²	102.5	59%	0.591	55%	0.553	S	S	*	*			trans	-86.3	135.6	179.4	-56.4	-167.9	176.2	-168.3	0	110.7	C50 C53 N57	C50-K55 PolarHBondContact N-O 3.41Å; C53-K55 HydrophobicContact CB-CG 4.12Å; C53-K55 WeakPolarHBondContact O-CG 3.17Å; C53-K55 PolarHBondContact O-N 3Å; C53-K55 VanDerWaalsContact SG-CB 3.58Å; K55-N57 PolarHBondContact O-N 2.91Å
56	P	48.3	Very low	44	Very low	90 Å²	90	102.5 Å²	102.5	58%	0.584	54%	0.538	S	S	*	.	B	Isolated β-bridge	trans	-72.1	110	164.7	29.6	-31	0	0	0	108.7	L49	L49-P56 HydrophobicContact CD2-CB 3.84Å; L49-P56 HydrophobicContact CD2-CG 4.23Å
57	N	47.7	Very low	43.6	Very low	132 Å²	132	105.6 Å²	105.6	71%	0.706	53%	0.532	S	S	*	.			trans	-166	75.2	164.1	-121.5	-91.8	0	0	0	109.6	K55 Q59	K55-N57 PolarHBondContact O-N 2.91Å; N57-Q59 PolarHBondContact O-N 2.9Å; N57-Q59 VanDerWaalsContact O-N 3.15Å
58	L	41.4	Very low	42.8	Very low	69 Å²	69	110.1 Å²	110.1	36%	0.361	55%	0.547	S	S	.	.			trans	-80.6	90.9	176.6	-62.9	175.4	0	0	0	110.3	D48 T60 P83	D48-L58 HydrophobicContact CB-CD1 3.53Å; D48-L58 HydrophobicContact CB-CG 4.33Å; D48-L58 VanDerWaalsContact CG-CD1 3.49Å; D48-L58 WeakPolarHBondContact OD1-CD1 3.4Å; L58-T60 HydrophobicContact CB-CG2 4.43Å; L58-T60 HydrophobicContact CD2-CG2 4.12Å; L58-T60 PolarHBondContact O-N 3.41Å; L58-P83 HydrophobicContact CD2-CB 4.31Å
59	Q	40.4	Very low	41.6	Very low	111 Å²	111	109.7 Å²	109.7	52%	0.519	55%	0.553	S	S	.	*			trans	-79.9	78.5	132.7	-75.5	-158.9	-49.9	0	0	107.5	N57 Y61	N57-Q59 PolarHBondContact O-N 2.9Å; N57-Q59 VanDerWaalsContact O-N 3.15Å; Q59-Y61 HydrophobicContact CB-CD2 4.46Å; Q59-Y61 HydrophobicContact CB-CE2 4.43Å; Q59-Y61 PolarHBondContact O-N 3.01Å
60	T	33.6	Very low	40.3	Very low	98 Å²	98	111.2 Å²	111.2	60%	0.601	56%	0.564	S	S	*	*			trans	-62.9	84.2	159.5	17.7	0	0	0	0	107.8	L58 K62	L58-T60 HydrophobicContact CB-CG2 4.43Å; L58-T60 HydrophobicContact CD2-CG2 4.12Å; L58-T60 PolarHBondContact O-N 3.41Å; T60-K62 PolarHBondContact O-N 3.38Å
61	Y	33.2	Very low	38.7	Very low	146 Å²	146	116.3 Å²	116.3	57%	0.573	60%	0.6	S	S	*	*			trans	-50.3	115.4	154.4	-84.1	-93.1	0	0	0	106.4	Q59 Y63	Q59-Y61 HydrophobicContact CB-CD2 4.46Å; Q59-Y61 HydrophobicContact CB-CE2 4.43Å; Q59-Y61 PolarHBondContact O-N 3.01Å; Y61-Y63 PolarHBondContact O-N 3Å
62	K	29.9	Very low	37.5	Very low	186 Å²	186	120.3 Å²	120.3	81%	0.809	61%	0.613	S	S	*	*			trans	-66.2	80.2	167.9	-74.9	-175.6	175.5	-179.5	0	107.6	T60 S64	T60-K62 PolarHBondContact O-N 3.38Å; K62-S64 PolarHBondContact O-N 3.46Å; K62-S64 PolarHBondContact O-OG 3.32Å
63	Y	29.8	Very low	36	Very low	147 Å²	147	121 Å²	121	58%	0.576	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	69.9	159.9	-87.9	-93.3	0	0	0	107.4	Y61 F66 Y67	Y61-Y63 PolarHBondContact O-N 3Å; Y63-F66 HydrophobicContact CD1-CB 4.24Å; Y63-F66 AromaticContact CD1-CD2 3.72Å; Y63-F66 HydrophobicContact CD1-CD2 3.72Å; Y63-F66 HydrophobicContact CD1-CG 4.32Å; Y63-F66 AromaticContact CE1-CD2 3.76Å; Y63-F66 HydrophobicContact CE1-CD2 3.76Å; Y63-F66 HydrophobicContact CE1-CE2 4.2Å; Y63-F66 HydrophobicContact CE1-CG 4.47Å; Y63-Y67 WeakPolarHBondContact O-CD2 3.38Å; Y63-Y67 WeakPolarHBondContact O-CE2 3.39Å
64	S	29	Very low	34.3	Very low	79 Å²	79	127.2 Å²	127.2	55%	0.552	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-35.6	164	43.5	0	0	0	0	109.7	K62 F66 Y67	K62-S64 PolarHBondContact O-N 3.46Å; K62-S64 PolarHBondContact O-OG 3.32Å; S64-F66 PolarHBondContact O-N 3.33Å; S64-F66 VanDerWaalsContact O-N 3.13Å; S64-Y67 PolarHBondContact O-N 3.35Å
65	S	28	Very low	32.9	Very low	107 Å²	107	124.9 Å²	124.9	75%	0.748	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-4.6	-173.2	-37	0	0	0	0	116.2
66	F	29.7	Very low	31.7	Very low	130 Å²	130	128.6 Å²	128.6	57%	0.57	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	0	-178.9	-81.6	-76.1	0	0	0	114.2	Y63 S64	Y63-F66 HydrophobicContact CD1-CB 4.24Å; Y63-F66 AromaticContact CD1-CD2 3.72Å; Y63-F66 HydrophobicContact CD1-CD2 3.72Å; Y63-F66 HydrophobicContact CD1-CG 4.32Å; Y63-F66 AromaticContact CE1-CD2 3.76Å; Y63-F66 HydrophobicContact CE1-CD2 3.76Å; Y63-F66 HydrophobicContact CE1-CE2 4.2Å; Y63-F66 HydrophobicContact CE1-CG 4.47Å; S64-F66 PolarHBondContact O-N 3.33Å; S64-F66 VanDerWaalsContact O-N 3.13Å
67	Y	28.9	Very low	30.7	Very low	152 Å²	152	133.9 Å²	133.9	60%	0.596	68%	0.679	S	S	*	*	S	Bend	trans	-96.1	7.8	-173.3	-79.6	-77.8	0	0	0	115.4	Y63 S64	Y63-Y67 WeakPolarHBondContact O-CD2 3.38Å; Y63-Y67 WeakPolarHBondContact O-CE2 3.39Å; S64-Y67 PolarHBondContact O-N 3.35Å
68	Q	28.3	Very low	29.8	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	69%	0.687	S	S	*	*	S	Bend	trans	-115.4	5.2	-167.4	-156.1	163	0.3	0	0	115.3
69	S	25	Very low	29.5	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	71%	0.707	S	S	*	*	S	Bend	trans	-145.7	42.9	-175.8	72.9	0	0	0	0	115.7
70	V	25.8	Very low	29.3	Very low	95 Å²	95	144.4 Å²	144.4	58%	0.576	72%	0.719	S	S	*	*			trans	-135.7	88.4	163.1	-173.8	0	0	0	0	109.7	L72	V70-L72 HydrophobicContact CG1-CB 4.34Å; V70-L72 HydrophobicContact CG1-CD1 3.79Å; V70-L72 HydrophobicContact CG1-CG 3.77Å; V70-L72 PolarHBondContact O-N 2.99Å
71	S	24.8	Very low	29.7	Very low	111 Å²	111	144.5 Å²	144.5	78%	0.776	72%	0.722	S	S	*	*			trans	-75.5	69.7	169.3	42.1	0	0	0	0	110.7	N73	S71-N73 VanDerWaalsContact C-N 3.33Å; S71-N73 PolarHBondContact O-N 3.09Å
72	L	28.4	Very low	30.2	Very low	142 Å²	142	141.9 Å²	141.9	74%	0.743	72%	0.721	S	S	*	*			trans	-68	92.5	168.5	-96.2	162.6	0	0	0	109.3	V70 N74	V70-L72 HydrophobicContact CG1-CB 4.34Å; V70-L72 HydrophobicContact CG1-CD1 3.79Å; V70-L72 HydrophobicContact CG1-CG 3.77Å; V70-L72 PolarHBondContact O-N 2.99Å; L72-N74 PolarHBondContact O-N 2.86Å
73	N	27	Very low	30.9	Very low	133 Å²	133	135.6 Å²	135.6	71%	0.711	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	136.5	-179.5	-70.8	-23.6	0	0	0	111.7	S71	S71-N73 VanDerWaalsContact C-N 3.33Å; S71-N73 PolarHBondContact O-N 3.09Å
74	N	26.8	Very low	32	Very low	161 Å²	161	131.1 Å²	131.1	86%	0.861	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.9	28.7	157	-57.1	-13.6	0	0	0	119.9	L72	L72-N74 PolarHBondContact O-N 2.86Å
75	T	29.9	Very low	33.1	Very low	107 Å²	107	127.9 Å²	127.9	66%	0.656	66%	0.664	S	S	*	*			trans	-132.2	130.7	156.5	58	0	0	0	0	113.9	Y77	T75-Y77 PolarHBondContact O-N 2.93Å; T75-Y77 VanDerWaalsContact O-N 3.09Å
76	K	29.4	Very low	34.4	Very low	213 Å²	213	126.5 Å²	126.5	93%	0.926	65%	0.653	S	S	*	*			trans	-75.6	12	-171.7	-81.5	-178.2	174.1	174.7	0	115.7	K78	K76-K78 PolarHBondContact O-N 3.48Å
77	Y	28.8	Very low	35.6	Very low	202 Å²	202	122.1 Å²	122.1	79%	0.792	64%	0.639	S	S	*	*			trans	-79.9	87.4	-172.8	-73.6	-74.8	0	0	0	113	T75 I79	T75-Y77 PolarHBondContact O-N 2.93Å; T75-Y77 VanDerWaalsContact O-N 3.09Å; Y77-I79 VanDerWaalsContact C-N 3.27Å; Y77-I79 PolarHBondContact O-N 2.86Å
78	K	28.6	Very low	36.9	Very low	203 Å²	203	120.6 Å²	120.6	88%	0.883	64%	0.637	S	S	*	*			trans	-64.6	84.3	163.2	-76.8	-173.1	174.5	-178.5	0	110.4	K76 K80	K76-K78 PolarHBondContact O-N 3.48Å; K78-K80 PolarHBondContact O-N 3.47Å
79	I	34.7	Very low	38.4	Very low	150 Å²	150	117.4 Å²	117.4	77%	0.769	63%	0.625	S	S	*	*			trans	-64.6	103.7	169.7	-58.4	176.2	0	0	0	107.7	Y77	Y77-I79 VanDerWaalsContact C-N 3.27Å; Y77-I79 PolarHBondContact O-N 2.86Å
80	K	36.3	Very low	39.7	Very low	179 Å²	179	112.4 Å²	112.4	78%	0.778	59%	0.59	S	S	*	*			trans	-64.5	134.3	173.4	-73.1	-174.6	174.8	-176.5	0	109.2	K78 V82	K78-K80 PolarHBondContact O-N 3.47Å; K80-V82 PolarHBondContact O-N 2.76Å
81	P	41.7	Very low	41.2	Very low	101 Å²	101	113.3 Å²	113.3	66%	0.656	59%	0.586	S	S	*	*			trans	-63.8	132.6	172.7	26.4	-33.1	0	0	0	109.8
82	V	43.7	Very low	42.8	Very low	91 Å²	91	110.6 Å²	110.6	55%	0.552	56%	0.563	S	S	*	*			trans	-108.6	128.9	178	179.1	0	0	0	0	108.1	A51 K80 V84	A51-V82 HydrophobicContact CB-CG1 3.27Å; K80-V82 PolarHBondContact O-N 2.76Å; V82-V84 PolarHBondContact O-N 2.78Å
83	P	45.1	Very low	44	Very low	53 Å²	53	106.7 Å²	106.7	34%	0.344	54%	0.543	S	S	.	.			trans	-66.5	128.8	-179.8	26.3	-33.6	0	0	0	111	C50 A51 L58	C50-P83 WeakPolarHBondContact CA-O 3.15Å; A51-P83 PolarHBondContact N-O 3.12Å; A51-P83 VanDerWaalsContact N-O 3.07Å; L58-P83 HydrophobicContact CD2-CB 4.31Å
84	V	51.6	Low	45.4	Very low	53 Å²	53	104 Å²	104	32%	0.321	53%	0.528	S	S	.	.			trans	-123.8	122.4	176.9	-176.8	0	0	0	0	109.1	W52 V82 C90 L94	W52-V84 HydrophobicContact CE3-CG1 4.11Å; W52-V84 HydrophobicContact CE3-CG2 4.5Å; W52-V84 HydrophobicContact CZ3-CG1 4.28Å; W52-V84 HydrophobicContact CZ3-CG2 4.43Å; V82-V84 PolarHBondContact O-N 2.78Å; V84-C90 HydrophobicContact CG1-CB 3.73Å; V84-L94 HydrophobicContact CG2-CD1 4.35Å
85	C	53.3	Low	46.9	Very low	11 Å²	11	103.7 Å²	103.7	7%	0.074	52%	0.515	C	S	.	.			trans	-67.2	138.4	178.6	64.4	0	0	0	0	109.8	C50 C53 S87 C90	C50-C85 HydrophobicContact CB-CB 3.46Å; C50-C85 VanDerWaalsContact CB-CB 3.46Å; C50-C85 VanDerWaalsContact CB-N 3.25Å; C50-C85 PolarHBondContact SG-N 2.83Å; C53-C85 WeakPolarHBondContact CB-SG 3.28Å; C53-C85 WeakPolarHBondContact SG-CB 3.39Å; C53-C85 CovalentContact SG-SG 2.06Å; C53-C85 PolarHBondContact SG-SG 3.27Å; C85-S87 PolarHBondContact O-N 3.03Å; C85-S87 PolarHBondContact SG-OG 3.34Å; C85-C90 VanDerWaalsContact O-CB 3.25Å; C85-C90 WeakPolarHBondContact O-CB 3.34Å; C85-C90 PolarHBondContact SG-SG 3.09Å
86	C	53.8	Low	48.4	Very low	78 Å²	78	106.6 Å²	106.6	53%	0.527	51%	0.514	S	S	.	.			trans	-67.8	22.4	177.7	-57.4	0	0	0	0	114.5
87	S	55.2	Low	49.4	Very low	39 Å²	39	98.3 Å²	98.3	27%	0.273	49%	0.485	S	S	.	.			trans	-70.9	142.7	172.2	74.7	0	0	0	0	110.5	C85 I89 C90 F91	C85-S87 PolarHBondContact O-N 3.03Å; C85-S87 PolarHBondContact SG-OG 3.34Å; S87-I89 PolarHBondContact O-N 3.43Å; S87-I89 VanDerWaalsContact O-N 3.16Å; S87-C90 PolarHBondContact O-N 3.4Å; S87-C90 WeakPolarHBondContact OG-CB 3.34Å; S87-C90 PolarHBondContact OG-N 2.93Å; S87-F91 PolarHBondContact O-N 2.94Å
88	Q	56.3	Low	50.5	Low	119 Å²	119	96.1 Å²	96.1	56%	0.556	48%	0.476	S	S	*	.	H	α-helix	trans	-52.3	-39.3	176.2	-177.9	60	37.6	0	0	112	C90 F91 D92	Q88-C90 VanDerWaalsContact C-N 3.32Å; Q88-C90 PolarHBondContact O-N 3.37Å; Q88-F91 PolarHBondContact O-N 3.18Å; Q88-D92 PolarHBondContact NE2-OD1 3.15Å; Q88-D92 PolarHBondContact NE2-OD2 3.39Å; Q88-D92 WeakPolarHBondContact O-CB 3.21Å; Q88-D92 PolarHBondContact O-N 2.95Å
89	I	60.1	Low	51.6	Low	120 Å²	120	91 Å²	91	62%	0.615	45%	0.454	S	S	*	.	H	α-helix	trans	-59.8	-41	177.2	-60.9	169.7	0	0	0	111.3	S87 N93	S87-I89 PolarHBondContact O-N 3.43Å; S87-I89 VanDerWaalsContact O-N 3.16Å; I89-N93 WeakPolarHBondContact O-CB 3.21Å; I89-N93 VanDerWaalsContact O-CG 3.22Å; I89-N93 PolarHBondContact O-N 2.97Å; I89-N93 PolarHBondContact O-ND2 3.2Å
90	C	52.2	Low	52.9	Low	0 Å²	0	90.5 Å²	90.5	0%	0	45%	0.447	C	S	.	.	H	α-helix	trans	-78.6	-31.8	177.7	-78.6	0	0	0	0	113.6	C53 V84 C85 S87 Q88 N93 L94	C53-C90 VanDerWaalsContact CB-SG 3.5Å; V84-C90 HydrophobicContact CG1-CB 3.73Å; C85-C90 VanDerWaalsContact O-CB 3.25Å; C85-C90 WeakPolarHBondContact O-CB 3.34Å; C85-C90 PolarHBondContact SG-SG 3.09Å; S87-C90 PolarHBondContact O-N 3.4Å; S87-C90 WeakPolarHBondContact OG-CB 3.34Å; S87-C90 PolarHBondContact OG-N 2.93Å; Q88-C90 VanDerWaalsContact C-N 3.32Å; Q88-C90 PolarHBondContact O-N 3.37Å; C90-N93 PolarHBondContact O-N 3.18Å; C90-L94 WeakPolarHBondContact O-CB 3.36Å; C90-L94 PolarHBondContact O-N 2.86Å
91	F	58.4	Low	53.6	Low	114 Å²	114	86.5 Å²	86.5	50%	0.5	43%	0.433	S	S	.	.	H	α-helix	trans	-66.8	-39.4	169.6	-105	-77.1	0	0	0	112.1	S87 Q88 L94 R95	S87-F91 PolarHBondContact O-N 2.94Å; Q88-F91 PolarHBondContact O-N 3.18Å; F91-L94 WeakPolarHBondContact O-CB 3.32Å; F91-L94 PolarHBondContact O-N 3.04Å; F91-R95 VanDerWaalsContact O-CB 3.26Å; F91-R95 WeakPolarHBondContact O-CB 3.27Å; F91-R95 PolarHBondContact O-N 3.17Å
92	D	57.4	Low	53.9	Low	53 Å²	53	88.1 Å²	88.1	28%	0.283	43%	0.426	S	S	.	.	H	α-helix	trans	-69.6	-34.7	173.3	-77.6	-37.8	0	0	0	111.8	Q88 R95 R96	Q88-D92 PolarHBondContact NE2-OD1 3.15Å; Q88-D92 PolarHBondContact NE2-OD2 3.39Å; Q88-D92 WeakPolarHBondContact O-CB 3.21Å; Q88-D92 PolarHBondContact O-N 2.95Å; D92-R95 PolarHBondContact O-N 2.9Å; D92-R96 VanDerWaalsContact O-CB 3.26Å; D92-R96 WeakPolarHBondContact O-CB 3.16Å; D92-R96 WeakPolarHBondContact O-CD 3.29Å; D92-R96 WeakPolarHBondContact O-CG 3.29Å; D92-R96 PolarHBondContact O-N 3.09Å
93	N	53.1	Low	54	Low	60 Å²	60	89.4 Å²	89.4	32%	0.321	42%	0.421	S	S	.	.	H	α-helix	trans	-68.7	-35.8	170.1	-75.2	-13.7	0	0	0	112.2	W52 I89 C90 R96 A97	W52-N93 HydrophobicContact CD2-CB 4.33Å; W52-N93 HydrophobicContact CE3-CB 3.85Å; W52-N93 HydrophobicContact CZ3-CB 4.2Å; I89-N93 WeakPolarHBondContact O-CB 3.21Å; I89-N93 VanDerWaalsContact O-CG 3.22Å; I89-N93 PolarHBondContact O-N 2.97Å; I89-N93 PolarHBondContact O-ND2 3.2Å; C90-N93 PolarHBondContact O-N 3.18Å; N93-R96 PolarHBondContact O-N 3.03Å; N93-A97 WeakPolarHBondContact O-CB 3.49Å; N93-A97 PolarHBondContact O-N 2.84Å
94	L	56.6	Low	54.2	Low	77 Å²	77	92.5 Å²	92.5	40%	0.403	43%	0.431	S	S	.	.	H	α-helix	trans	-62.3	-46.9	172.4	-163	96.6	0	0	0	110.2	W52 V84 C90 F91 A97 Y98	W52-L94 HydrophobicContact CH2-CB 4.22Å; W52-L94 HydrophobicContact CH2-CD1 3.89Å; W52-L94 HydrophobicContact CH2-CG 4.44Å; W52-L94 HydrophobicContact CZ3-CB 3.71Å; W52-L94 HydrophobicContact CZ3-CD1 3.74Å; W52-L94 HydrophobicContact CZ3-CG 4.26Å; V84-L94 HydrophobicContact CG2-CD1 4.35Å; C90-L94 WeakPolarHBondContact O-CB 3.36Å; C90-L94 PolarHBondContact O-N 2.86Å; F91-L94 WeakPolarHBondContact O-CB 3.32Å; F91-L94 PolarHBondContact O-N 3.04Å; L94-A97 PolarHBondContact O-N 3.33Å; L94-Y98 VanDerWaalsContact O-CB 3.26Å; L94-Y98 WeakPolarHBondContact O-CB 3.36Å; L94-Y98 PolarHBondContact O-N 3.09Å
95	R	58.8	Low	53.9	Low	155 Å²	155	95.6 Å²	95.6	59%	0.585	44%	0.442	S	S	*	.	H	α-helix	trans	-64.7	-40.7	178.2	-167.8	173.8	-175	-168.4	1.3	111.6	F91 D92 F99	F91-R95 VanDerWaalsContact O-CB 3.26Å; F91-R95 WeakPolarHBondContact O-CB 3.27Å; F91-R95 PolarHBondContact O-N 3.17Å; D92-R95 PolarHBondContact O-N 2.9Å; R95-F99 HydrophobicContact CG-CD2 3.87Å; R95-F99 HydrophobicContact CG-CE2 3.6Å; R95-F99 VanDerWaalsContact O-CB 3.32Å; R95-F99 WeakPolarHBondContact O-CB 3.41Å; R95-F99 WeakPolarHBondContact O-CD2 3.38Å; R95-F99 WeakPolarHBondContact O-CG 3.34Å; R95-F99 PolarHBondContact O-N 2.79Å
96	R	61.1	Low	53.5	Low	168 Å²	168	98.6 Å²	98.6	63%	0.634	46%	0.457	S	S	*	.	H	α-helix	trans	-66.2	-40.8	172.8	-73.9	162.9	-174.6	-113.1	2.7	112.1	D92 N93 K100	D92-R96 VanDerWaalsContact O-CB 3.26Å; D92-R96 WeakPolarHBondContact O-CB 3.16Å; D92-R96 WeakPolarHBondContact O-CD 3.29Å; D92-R96 WeakPolarHBondContact O-CG 3.29Å; D92-R96 PolarHBondContact O-N 3.09Å; N93-R96 PolarHBondContact O-N 3.03Å; R96-K100 WeakPolarHBondContact O-CB 3.44Å; R96-K100 WeakPolarHBondContact O-CG 3.42Å; R96-K100 PolarHBondContact O-N 3.41Å
97	A	51.6	Low	53	Low	38 Å²	38	99.4 Å²	99.4	31%	0.314	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-43.4	177.2	0	0	0	0	0	111.1	W52 N93 L94 K100 N101	W52-A97 HydrophobicContact CH2-CB 3.9Å; W52-A97 HydrophobicContact CZ2-CB 4.06Å; N93-A97 WeakPolarHBondContact O-CB 3.49Å; N93-A97 PolarHBondContact O-N 2.84Å; L94-A97 PolarHBondContact O-N 3.33Å; A97-K100 PolarHBondContact O-N 3.39Å; A97-N101 WeakPolarHBondContact O-CB 3.5Å; A97-N101 PolarHBondContact O-N 3.26Å
98	Y	50.2	Low	52.3	Low	156 Å²	156	104 Å²	104	61%	0.612	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-44.3	173.6	-170.2	-97.4	0	0	0	111.6	L94 N101 R102	L94-Y98 VanDerWaalsContact O-CB 3.26Å; L94-Y98 WeakPolarHBondContact O-CB 3.36Å; L94-Y98 PolarHBondContact O-N 3.09Å; Y98-N101 PolarHBondContact O-N 3.08Å; Y98-R102 WeakPolarHBondContact O-CB 3.45Å; Y98-R102 PolarHBondContact O-N 2.83Å
99	F	52.7	Low	51.5	Low	95 Å²	95	106 Å²	106	42%	0.417	49%	0.487	S	S	.	.	H	α-helix	trans	-66.6	-33.3	173.2	-77.6	-49.7	0	0	0	113.3	R95 R103	R95-F99 HydrophobicContact CG-CD2 3.87Å; R95-F99 HydrophobicContact CG-CE2 3.6Å; R95-F99 VanDerWaalsContact O-CB 3.32Å; R95-F99 WeakPolarHBondContact O-CB 3.41Å; R95-F99 WeakPolarHBondContact O-CD2 3.38Å; R95-F99 WeakPolarHBondContact O-CG 3.34Å; R95-F99 PolarHBondContact O-N 2.79Å; F99-R103 VanDerWaalsContact O-CB 3.27Å; F99-R103 WeakPolarHBondContact O-CB 3.44Å; F99-R103 PolarHBondContact O-N 2.6Å
100	K	62.2	Low	50.3	Low	141 Å²	141	105 Å²	105	61%	0.613	48%	0.483	S	S	*	.	H	α-helix	trans	-66.6	-48.6	171.1	-84.8	-172.5	173.5	-168.5	0	111.3	R96 A97 R103 H104	R96-K100 WeakPolarHBondContact O-CB 3.44Å; R96-K100 WeakPolarHBondContact O-CG 3.42Å; R96-K100 PolarHBondContact O-N 3.41Å; A97-K100 PolarHBondContact O-N 3.39Å; K100-R103 CarbonylContact O-C 3.59Å; K100-R103 WeakPolarHBondContact O-CA 3.49Å; K100-R103 WeakPolarHBondContact O-CB 3.29Å; K100-R103 PolarHBondContact O-N 3.42Å; K100-R103 VanDerWaalsContact O-N 3.08Å; K100-H104 PolarHBondContact O-CD2 3.02Å; K100-H104 PolarHBondContact O-N 2.98Å
101	N	51.5	Low	49.2	Very low	94 Å²	94	112 Å²	112	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-65.2	-43.2	-178.7	-160.1	11.4	0	0	0	110.8	A97 Y98 R103 H104 Q105	A97-N101 WeakPolarHBondContact O-CB 3.5Å; A97-N101 PolarHBondContact O-N 3.26Å; Y98-N101 PolarHBondContact O-N 3.08Å; N101-R103 VanDerWaalsContact C-N 3.3Å; N101-R103 PolarHBondContact O-N 2.92Å; N101-H104 PolarHBondContact O-N 2.8Å; N101-H104 VanDerWaalsContact O-N 3.09Å; N101-Q105 WeakPolarHBondContact O-CG 3.47Å; N101-Q105 PolarHBondContact O-N 2.81Å
102	R	47.6	Very low	47.8	Very low	135 Å²	135	113 Å²	113	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-62.2	-34.3	170.7	-169	174	-178.7	-177.9	0.2	112.4	Y98 L106	Y98-R102 WeakPolarHBondContact O-CB 3.45Å; Y98-R102 PolarHBondContact O-N 2.83Å; R102-L106 HydrophobicContact CG-CD1 4.01Å; R102-L106 HydrophobicContact CG-CG 4.47Å; R102-L106 VanDerWaalsContact O-CB 3.29Å; R102-L106 WeakPolarHBondContact O-CB 3.37Å; R102-L106 WeakPolarHBondContact O-CG 3.4Å; R102-L106 PolarHBondContact O-N 3.47Å
103	R	45.8	Very low	46.5	Very low	118 Å²	118	119.4 Å²	119.4	45%	0.445	56%	0.558	S	S	.	*	H	α-helix	trans	-66.4	-39.7	169.6	-96.3	-179.4	162.6	172	-6.3	112.7	F99 K100 N101 N107	F99-R103 VanDerWaalsContact O-CB 3.27Å; F99-R103 WeakPolarHBondContact O-CB 3.44Å; F99-R103 PolarHBondContact O-N 2.6Å; K100-R103 CarbonylContact O-C 3.59Å; K100-R103 WeakPolarHBondContact O-CA 3.49Å; K100-R103 WeakPolarHBondContact O-CB 3.29Å; K100-R103 PolarHBondContact O-N 3.42Å; K100-R103 VanDerWaalsContact O-N 3.08Å; N101-R103 VanDerWaalsContact C-N 3.3Å; N101-R103 PolarHBondContact O-N 2.92Å; R103-N107 WeakPolarHBondContact O-CB 3.41Å; R103-N107 PolarHBondContact O-N 3.06Å; R103-N107 PolarHBondContact O-OD1 2.97Å
104	H	48.1	Very low	45.5	Very low	118 Å²	118	122.7 Å²	122.7	55%	0.546	57%	0.574	S	S	.	*	H	α-helix	trans	-68	-42.6	175.6	-74.1	-70	0	0	0	111.6	K100 N101 L106 N107 N108	K100-H104 PolarHBondContact O-CD2 3.02Å; K100-H104 PolarHBondContact O-N 2.98Å; N101-H104 PolarHBondContact O-N 2.8Å; N101-H104 VanDerWaalsContact O-N 3.09Å; H104-L106 PolarHBondContact O-N 2.99Å; H104-N107 PolarHBondContact O-N 3.34Å; H104-N108 WeakPolarHBondContact O-CB 3.26Å; H104-N108 PolarHBondContact O-N 3.21Å; H104-N108 PolarHBondContact O-OD1 3.23Å
105	Q	46.9	Very low	44.2	Very low	118 Å²	118	123.4 Å²	123.4	55%	0.551	58%	0.583	S	S	*	*	H	α-helix	trans	-60.3	-44	174	-70.7	171.2	-22	0	0	112.1	N101	N101-Q105 WeakPolarHBondContact O-CG 3.47Å; N101-Q105 PolarHBondContact O-N 2.81Å
106	L	44.3	Very low	42.7	Very low	74 Å²	74	120 Å²	120	39%	0.387	59%	0.589	S	S	.	*	H	α-helix	trans	-72.4	-41.9	176.9	-71	169.8	0	0	0	112.9	R102 H104 N108 Q109 L110	R102-L106 HydrophobicContact CG-CD1 4.01Å; R102-L106 HydrophobicContact CG-CG 4.47Å; R102-L106 VanDerWaalsContact O-CB 3.29Å; R102-L106 WeakPolarHBondContact O-CB 3.37Å; R102-L106 WeakPolarHBondContact O-CG 3.4Å; R102-L106 PolarHBondContact O-N 3.47Å; H104-L106 PolarHBondContact O-N 2.99Å; L106-N108 PolarHBondContact O-N 3.35Å; L106-Q109 CarbonylContact O-C 3.55Å; L106-Q109 WeakPolarHBondContact O-CA 3.09Å; L106-Q109 PolarHBondContact O-N 3.1Å; L106-L110 PolarHBondContact O-N 3.09Å
107	N	42.9	Very low	41.2	Very low	95 Å²	95	119 Å²	119	51%	0.508	59%	0.593	S	S	.	*	H	α-helix	trans	-66.3	-24.5	178	-76.3	30.3	0	0	0	112.5	R103 H104 Q109	R103-N107 WeakPolarHBondContact O-CB 3.41Å; R103-N107 PolarHBondContact O-N 3.06Å; R103-N107 PolarHBondContact O-OD1 2.97Å; H104-N107 PolarHBondContact O-N 3.34Å; N107-Q109 PolarHBondContact O-N 2.98Å
108	N	40.8	Very low	40.4	Very low	135 Å²	135	123.1 Å²	123.1	72%	0.722	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-7.5	170.7	-72.8	9.9	0	0	0	113.2	H104 L106	H104-N108 WeakPolarHBondContact O-CB 3.26Å; H104-N108 PolarHBondContact O-N 3.21Å; H104-N108 PolarHBondContact O-OD1 3.23Å; L106-N108 PolarHBondContact O-N 3.35Å
109	Q	39.5	Very low	39.5	Very low	161 Å²	161	120.4 Å²	120.4	75%	0.752	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.1	-21.4	176.4	-64.7	-176.3	-43.9	0	0	113	L106 N107	L106-Q109 CarbonylContact O-C 3.55Å; L106-Q109 WeakPolarHBondContact O-CA 3.09Å; L106-Q109 PolarHBondContact O-N 3.1Å; N107-Q109 PolarHBondContact O-N 2.98Å
110	L	34.6	Very low	38.6	Very low	101 Å²	101	119.6 Å²	119.6	53%	0.529	62%	0.615	S	S	.	*			trans	-130.9	80.6	-179.3	-74.7	157.6	0	0	0	108.9	L106	L106-L110 PolarHBondContact O-N 3.09Å
111	L	28.9	Very low	36.9	Very low	146 Å²	146	116.8 Å²	116.8	76%	0.764	63%	0.626	S	S	*	*			trans	-72	131.9	159.8	-88.9	146.4	0	0	0	108.5
112	N	30	Very low	35.7	Very low	135 Å²	135	121.4 Å²	121.4	72%	0.722	64%	0.636	S	S	*	*	S	Bend	trans	81.9	154.9	179.1	-45.5	-37.4	0	0	0	117
113	E	30.1	Very low	34.9	Very low	187 Å²	187	122.3 Å²	122.3	87%	0.874	65%	0.651	S	S	*	*			trans	69.7	22.7	159.2	-47.9	-150.2	136.6	0	0	122.3	P115	E113-P115 WeakPolarHBondContact O-CD 3.37Å
114	I	30.7	Very low	34.2	Very low	130 Å²	130	121.1 Å²	121.1	67%	0.667	66%	0.658	S	S	*	*			trans	-111.7	96.7	161.6	-55	-176.1	0	0	0	112
115	P	29.6	Very low	33.2	Very low	92 Å²	92	125.7 Å²	125.7	60%	0.597	67%	0.672	S	S	*	*			trans	-57.1	145	174.5	-26.3	35.2	0	0	0	113.2	E113 M117	E113-P115 WeakPolarHBondContact O-CD 3.37Å; P115-M117 PolarHBondContact O-N 2.82Å
116	A	28.7	Very low	32.4	Very low	84 Å²	84	124.4 Å²	124.4	69%	0.694	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	6.1	-171.8	0	0	0	0	0	116.2
117	M	29.1	Very low	31.7	Very low	146 Å²	146	123.5 Å²	123.5	72%	0.719	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-18.8	-160.7	-148.4	-176.5	-58.7	0	0	115.3	P115	P115-M117 PolarHBondContact O-N 2.82Å
118	V	33.5	Very low	31	Very low	124 Å²	124	124.7 Å²	124.7	75%	0.752	68%	0.679	S	S	*	*	S	Bend	trans	-94.7	-19.5	-160.7	-176.5	0	0	0	0	114.6
119	I	32.1	Very low	30.8	Very low	99 Å²	99	122.6 Å²	122.6	51%	0.508	68%	0.675	S	S	.	*	S	Bend	trans	-112	-9.7	-156.7	-51.8	-177	0	0	0	114
120	S	32.8	Very low	30.5	Very low	78 Å²	78	120.4 Å²	120.4	55%	0.545	67%	0.668	S	S	.	*	S	Bend	trans	-82.7	-24.7	-177.4	54.1	0	0	0	0	115.1	R122	S120-R122 PolarHBondContact O-N 2.92Å; S120-R122 VanDerWaalsContact O-N 3.16Å; S120-R122 PolarHBondContact OG-N 2.94Å; S120-R122 PolarHBondContact OG-O 2.91Å
121	G	27.3	Very low	30.5	Very low	83 Å²	83	122.5 Å²	122.5	86%	0.856	67%	0.673	S	S	*	*	S	Bend	trans	64.2	8.5	-167.7	0	0	0	0	0	114.6
122	R	27	Very low	30.6	Very low	190 Å²	190	123.4 Å²	123.4	72%	0.717	67%	0.673	S	S	*	*	S	Bend	trans	-126.8	141.7	174.6	-66.5	-175.6	174.7	-161.4	-3.7	108	S120	S120-R122 PolarHBondContact O-N 2.92Å; S120-R122 VanDerWaalsContact O-N 3.16Å; S120-R122 PolarHBondContact OG-N 2.94Å; S120-R122 PolarHBondContact OG-O 2.91Å
123	L	29.3	Very low	30.7	Very low	154 Å²	154	126.5 Å²	126.5	81%	0.806	68%	0.68	S	S	*	*			trans	-52.5	149.4	163.5	-82.2	75.2	0	0	0	108.9	Y125	L123-Y125 PolarHBondContact O-N 3.16Å
124	P	31.2	Very low	30.7	Very low	93 Å²	93	124.6 Å²	124.6	60%	0.604	68%	0.682	S	S	*	*			trans	-53.9	135.4	163.5	26.2	-33.6	0	0	0	108.2	T126	P124-T126 VanDerWaalsContact C-N 3.29Å; P124-T126 PolarHBondContact O-N 2.74Å
125	Y	27.3	Very low	30.7	Very low	215 Å²	215	126.6 Å²	126.6	84%	0.843	69%	0.694	S	S	*	*			trans	-65	98.7	164.6	-108.9	-96.7	0	0	0	106.3	L123 S127	L123-Y125 PolarHBondContact O-N 3.16Å; Y125-S127 PolarHBondContact O-N 2.98Å
126	T	31.6	Very low	30.7	Very low	90 Å²	90	125.5 Å²	125.5	55%	0.552	70%	0.699	S	S	*	*			trans	-68.2	110.4	159.6	52.1	0	0	0	0	106.1	P124 D128	P124-T126 VanDerWaalsContact C-N 3.29Å; P124-T126 PolarHBondContact O-N 2.74Å; T126-D128 PolarHBondContact O-N 3Å
127	S	27.8	Very low	30.7	Very low	56 Å²	56	131.4 Å²	131.4	39%	0.392	71%	0.709	S	S	.	*			trans	-53.1	123	165.3	-7	0	0	0	0	107.8	Y125 S129 D130	Y125-S127 PolarHBondContact O-N 2.98Å; S127-S129 VanDerWaalsContact CB-OG 3.29Å; S127-S129 WeakPolarHBondContact CB-OG 3.32Å; S127-S129 PolarHBondContact O-N 3.47Å; S127-D130 WeakPolarHBondContact CB-OD2 3.26Å; S127-D130 WeakPolarHBondContact O-CB 3.2Å; S127-D130 PolarHBondContact O-N 2.97Å; S127-D130 PolarHBondContact OG-OD2 3.15Å
128	D	30	Very low	30.6	Very low	119 Å²	119	136.8 Å²	136.8	64%	0.636	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-66.6	-7.9	177.9	-78.2	-55.8	0	0	0	112.7	T126 D130 K131	T126-D128 PolarHBondContact O-N 3Å; D128-D130 PolarHBondContact O-N 2.82Å; D128-K131 WeakPolarHBondContact OD1-CE 3.09Å; D128-K131 IonicContact OD1-NZ 2.65Å; D128-K131 PolarHBondContact OD1-NZ 3.5Å
129	S	35.2	Very low	30.4	Very low	91 Å²	91	139.6 Å²	139.6	64%	0.636	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-66.8	-17.9	166.1	56.8	0	0	0	0	114.5	S127 K131	S127-S129 VanDerWaalsContact CB-OG 3.29Å; S127-S129 WeakPolarHBondContact CB-OG 3.32Å; S127-S129 PolarHBondContact O-N 3.47Å; S129-K131 VanDerWaalsContact C-N 3.32Å
130	D	34.1	Very low	30.3	Very low	115 Å²	115	139.5 Å²	139.5	62%	0.615	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-94.1	9.8	-173.6	-52	-31.2	0	0	0	112.3	S127 D128	S127-D130 WeakPolarHBondContact CB-OD2 3.26Å; S127-D130 WeakPolarHBondContact O-CB 3.2Å; S127-D130 PolarHBondContact O-N 2.97Å; S127-D130 PolarHBondContact OG-OD2 3.15Å; D128-D130 PolarHBondContact O-N 2.82Å
131	K	34.8	Very low	30.1	Very low	146 Å²	146	143.7 Å²	143.7	64%	0.635	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-95.7	-6.1	178.4	-73	175.2	179.5	165.5	0	114.3	D128 S129	D128-K131 WeakPolarHBondContact OD1-CE 3.09Å; D128-K131 IonicContact OD1-NZ 2.65Å; D128-K131 PolarHBondContact OD1-NZ 3.5Å; S129-K131 VanDerWaalsContact C-N 3.32Å
132	E	31	Very low	30.1	Very low	165 Å²	165	146.8 Å²	146.8	77%	0.771	75%	0.747	S	S	*	*	S	Bend	trans	-118.1	92.3	174.9	-67.5	-172.6	150.7	0	0	110.6
133	K	31.3	Very low	30.1	Very low	200 Å²	200	141.8 Å²	141.8	87%	0.87	74%	0.741	S	S	*	*	S	Bend	trans	157.8	59	154.4	-84.9	152.2	-167.2	160.9	0	114.3
134	T	31.1	Very low	30	Very low	147 Å²	147	144.1 Å²	144.1	90%	0.902	74%	0.741	S	S	*	*			trans	-147.4	18.6	155.3	27	0	0	0	0	114.9
135	D	29.2	Very low	29.9	Very low	172 Å²	172	147.5 Å²	147.5	92%	0.92	75%	0.748	S	S	*	*	S	Bend	trans	-74.7	135	158.8	-84	-51.7	0	0	0	109.7
136	G	29.9	Very low	29.9	Very low	69 Å²	69	141.9 Å²	141.9	71%	0.711	74%	0.74	S	S	*	*			trans	86.1	72	172.9	0	0	0	0	0	116.9
137	K	29	Very low	29.6	Very low	208 Å²	208	144.6 Å²	144.6	90%	0.904	75%	0.752	S	S	*	*			trans	-159.3	56.6	145.7	-115.2	165	-168.8	177.7	0	115.7
138	R	27.5	Very low	29.8	Very low	258 Å²	258	148.1 Å²	148.1	97%	0.974	77%	0.771	S	S	*	*			trans	-140.3	55.3	157.4	-98.3	-167.2	175.5	-172.5	-1.3	111.4
139	Q	29.3	Very low	29.6	Very low	183 Å²	183	147 Å²	147	86%	0.855	77%	0.772	S	S	*	*			trans	-92.6	133.2	164.4	-83.6	177.7	-34.1	0	0	110.1
140	S	30.6	Very low	29.2	Very low	98 Å²	98	147.9 Å²	147.9	69%	0.685	78%	0.777	S	S	*	*			trans	21.8	118.3	153.5	51.4	0	0	0	0	119.8	L142	S140-L142 PolarHBondContact O-N 3.49Å; S140-L142 VanDerWaalsContact O-N 3.16Å
141	N	26.7	Very low	28.8	Very low	165 Å²	165	147.9 Å²	147.9	88%	0.882	79%	0.786	S	S	*	*			trans	-62.9	106.6	144.5	-70.8	-10.4	0	0	0	108.7
142	L	29.3	Very low	28.8	Very low	148 Å²	148	146.6 Å²	146.6	78%	0.775	79%	0.793	S	S	*	*			trans	178.3	93.9	156.5	-118.7	67.6	0	0	0	105	S140	S140-L142 PolarHBondContact O-N 3.49Å; S140-L142 VanDerWaalsContact O-N 3.16Å
143	S	25.6	Very low	28.9	Very low	85 Å²	85	144.5 Å²	144.5	59%	0.594	79%	0.793	S	S	*	*				88.3	128.8	84.9	68.3	0	0	0	0	114.3
144	Y	27.5	Very low	28.8	Very low	203 Å²	203	141 Å²	141	80%	0.796	79%	0.789	S	S	*	*			trans	88	99	164.6	-59.8	-67.1	0	0	0	121.9
145	H	28.6	Very low	28.5	Very low	165 Å²	165	139.9 Å²	139.9	76%	0.764	78%	0.781	S	S	*	*				75.9	147.4	127.3	-73.4	-38.4	0	0	0	125.2
146	S	28.2	Very low	28.4	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	78%	0.776	S	S	*	*			trans	74.1	120.2	163.4	-57.8	0	0	0	0	116.9
147	N	25.6	Very low	28.1	Very low	147 Å²	147	141.4 Å²	141.4	79%	0.786	78%	0.776	S	S	*	*				64.7	131.6	68.8	-59.4	-1.7	0	0	0	111.6
148	T	30.6	Very low	28.1	Very low	129 Å²	129	139.2 Å²	139.2	79%	0.791	77%	0.774	S	S	*	*			cis	-173.2	164.6	0.4	18.4	0	0	0	0	107.1
149	S	26.9	Very low	27.9	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	76%	0.762	S	S	*	*			cis	-173.2	-175.9	-8.2	49.1	0	0	0	0	110.5
150	C	26.1	Very low	27.8	Very low	111 Å²	111	129.2 Å²	129.2	75%	0.75	76%	0.755	S	S	*	*			trans	76.5	108.9	157.5	-59.2	0	0	0	0	122.8
151	S	26.2	Very low	27.6	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	76%	0.757	S	S	*	*				65.4	127.9	124.7	-50.1	0	0	0	0	124.4
152	P	34.8	Very low	27.9	Very low	119 Å²	119	128.7 Å²	128.7	77%	0.773	75%	0.749	S	S	*	*			trans	-95.8	172.2	161.5	41.7	-35.7	0	0	0	112.1
153	P	33	Very low	27.7	Very low	121 Å²	121	128.2 Å²	128.2	79%	0.786	75%	0.747	S	S	*	*				-160	-155	90.4	40.9	-17.7	0	0	0	116
154	V	29.6	Very low	28	Very low	128 Å²	128	131.8 Å²	131.8	78%	0.776	76%	0.76	S	S	*	*			trans	111.9	139.9	159.8	-174.1	0	0	0	0	117.1
155	T	23.5	Very low	28	Very low	122 Å²	122	131.2 Å²	131.2	75%	0.748	76%	0.761	S	S	*	*			trans	-127.5	140.5	-173.1	-59.8	0	0	0	0	110.8
156	I	28.6	Very low	28.2	Very low	158 Å²	158	132 Å²	132	81%	0.81	77%	0.77	S	S	*	*			trans	-139.3	131.3	160.4	-57.8	-178.5	0	0	0	109.6
157	T	24	Very low	28.2	Very low	116 Å²	116	132.4 Å²	132.4	71%	0.712	77%	0.773	S	S	*	*			trans	-109.7	143.8	167.6	47.6	0	0	0	0	110.2
158	N	28.4	Very low	28.4	Very low	161 Å²	161	130 Å²	130	86%	0.861	77%	0.768	S	S	*	*			trans	-161	170.5	151.8	-104.4	-25.5	0	0	0	112
159	T	23.7	Very low	28.7	Very low	117 Å²	117	133.1 Å²	133.1	72%	0.718	77%	0.77	S	S	*	*			trans	-115.1	179.1	-153.8	54.3	0	0	0	0	116
160	T	26.6	Very low	28.9	Very low	115 Å²	115	138.3 Å²	138.3	71%	0.706	78%	0.781	S	S	*	*			trans	86.7	120.6	144.8	31.2	0	0	0	0	122
161	T	27.2	Very low	29	Very low	118 Å²	118	143.8 Å²	143.8	72%	0.724	79%	0.786	S	S	*	*			trans	84.9	133.3	136.5	49.1	0	0	0	0	124.3
162	N	31.3	Very low	29.2	Very low	134 Å²	134	145.2 Å²	145.2	72%	0.717	78%	0.784	S	S	*	*			trans	80.7	105	143.5	-64.1	-12.1	0	0	0	122.3
163	N	26.4	Very low	28.8	Very low	137 Å²	137	146.8 Å²	146.8	73%	0.733	78%	0.78	S	S	*	*				32.2	115.2	124.3	-56.7	-18.2	0	0	0	119.4
164	N	32.4	Very low	28.7	Very low	161 Å²	161	148.1 Å²	148.1	86%	0.861	78%	0.781	S	S	*	*				-170.9	170	102.3	-105.3	-53	0	0	0	114.9
165	K	27.2	Very low	28.5	Very low	190 Å²	190	149.3 Å²	149.3	83%	0.826	78%	0.778	S	S	*	*			trans	-65.7	147.8	174.2	-62.3	166.5	177.8	168.8	0	111.9
166	L	31.4	Very low	28.7	Very low	181 Å²	181	155 Å²	155	95%	0.948	79%	0.787	S	S	*	*			trans	-141.7	173.2	143.6	-138.6	74.8	0	0	0	110.7
167	S	28.8	Very low	28.5	Very low	106 Å²	106	151.6 Å²	151.6	74%	0.741	78%	0.778	S	S	*	*			trans	-141.9	163.4	-157.1	-177	0	0	0	0	114
168	S	30.5	Very low	28.6	Very low	98 Å²	98	153.7 Å²	153.7	69%	0.685	78%	0.779	S	S	*	*			trans	114.8	128	134.1	79.7	0	0	0	0	120
169	K	35.7	Very low	28.5	Very low	193 Å²	193	155.1 Å²	155.1	84%	0.839	78%	0.781	S	S	*	*			trans	163	117.3	139.9	-87.4	155.9	-173.4	177.4	0	106.5
170	K	31.2	Very low	28.6	Very low	204 Å²	204	156.9 Å²	156.9	89%	0.887	78%	0.781	S	S	*	*				53.5	133	63.2	-67.9	-174.9	176	178.1	0	111.4
171	R	28.4	Very low	28.5	Very low	227 Å²	227	157.8 Å²	157.8	86%	0.857	78%	0.777	S	S	*	*			cis	-133.3	-178.8	5.8	-112	176.9	161.7	166.5	-5.1	107.7
172	L	30.9	Very low	28.5	Very low	143 Å²	143	159.5 Å²	159.5	75%	0.749	78%	0.776	S	S	*	*			cis	-151.4	-170.7	6.6	-132.9	170.9	0	0	0	108.7
173	H	26	Very low	28.1	Very low	152 Å²	152	159.9 Å²	159.9	70%	0.704	78%	0.778	S	S	*	*			trans	-151.4	149.8	173.3	-173.2	36	0	0	0	108.5
174	N	30.6	Very low	28.1	Very low	150 Å²	150	158 Å²	158	80%	0.802	78%	0.775	S	S	*	*			trans	-141.5	141.4	170.4	-112	10.7	0	0	0	109.6
175	Q	25.8	Very low	27.6	Very low	152 Å²	152	158.1 Å²	158.1	71%	0.71	77%	0.771	S	S	*	*			trans	-107.9	154.5	-179.6	-59.7	160.3	-83.6	0	0	109.7
176	Y	26.9	Very low	27.4	Very low	242 Å²	242	155.6 Å²	155.6	95%	0.949	77%	0.766	S	S	*	*			trans	-148	145.6	146	-102	-76.1	0	0	0	108.6
177	S	26.3	Very low	27.1	Very low	86 Å²	86	152.9 Å²	152.9	60%	0.601	76%	0.757	S	S	*	*			trans	-115.9	161.8	-162.8	-60.7	0	0	0	0	113.6
178	E	24.5	Very low	26.8	Very low	160 Å²	160	157.8 Å²	157.8	75%	0.748	77%	0.766	S	S	*	*			trans	48.3	107.9	142.2	-68.2	164.8	133	0	0	120.5
179	Q	27.8	Very low	26.6	Very low	192 Å²	192	160.6 Å²	160.6	90%	0.897	77%	0.772	S	S	*	*				-165.3	109.1	123.3	-99.9	157.7	27.4	0	0	106.7
180	Q	24.4	Very low	25.9	Very low	154 Å²	154	160.6 Å²	160.6	72%	0.72	77%	0.772	S	S	*	*				77.4	119.4	62.5	-81.8	-157.5	-4	0	0	116.1
181	H	25.8	Very low	25.7	Very low	134 Å²	134	156.8 Å²	156.8	62%	0.62	77%	0.771	S	S	*	*			trans	82.4	127.4	142.9	-85.1	-83.8	0	0	0	123.6
182	H	26.9	Very low	25.5	Very low	154 Å²	154	150.7 Å²	150.7	71%	0.713	76%	0.763	S	S	*	*			trans	65.7	162.9	153.7	-61.2	-53.9	0	0	0	119.9
183	L	23.2	Very low	25.1	Very low	142 Å²	142	149.2 Å²	149.2	74%	0.743	76%	0.76	S	S	*	*			cis	-170.5	173.5	-43	-155.6	82.8	0	0	0	106.6
184	S	25.3	Very low	25.1	Very low	97 Å²	97	148.7 Å²	148.7	68%	0.678	76%	0.763	S	S	*	*			trans	70.9	130.1	171.8	-51.5	0	0	0	0	114.6
185	Q	22.9	Very low	24.8	Very low	164 Å²	164	147.9 Å²	147.9	77%	0.766	76%	0.758	S	S	*	*			cis	96.5	134.6	43.3	-83.2	-170.5	-103.1	0	0	113.8
186	D	21.8	Very low	24.6	Very low	136 Å²	136	145.7 Å²	145.7	73%	0.727	76%	0.76	S	S	*	*			trans	65.5	156.9	167.5	-48.9	-35	0	0	0	116.3
187	T	26.1	Very low	24.5	Very low	125 Å²	125	142.7 Å²	142.7	77%	0.767	76%	0.755	S	S	*	*			cis	-142.7	145.3	11.7	-34.2	0	0	0	0	112
188	F	21.8	Very low	24.4	Very low	208 Å²	208	147.4 Å²	147.4	91%	0.912	77%	0.765	S	S	*	*			trans	-81	129.6	161.3	-110.4	-100.9	0	0	0	109.5
189	L	25.3	Very low	24.3	Very low	157 Å²	157	148.4 Å²	148.4	82%	0.822	77%	0.769	S	S	*	*			trans	-160.1	143.6	156.6	-111.7	161.2	0	0	0	114.6
190	K	22.9	Very low	24.2	Very low	194 Å²	194	148.7 Å²	148.7	84%	0.843	77%	0.771	S	S	*	*			trans	-55.7	150.3	-176.8	-61.7	159.5	169.7	174.6	0	115.5
191	S	26.3	Very low	24.3	Very low	124 Å²	124	149.4 Å²	149.4	87%	0.867	77%	0.771	S	S	*	*			trans	-138.5	162.1	131.8	65.9	0	0	0	0	109
192	S	22.9	Very low	24.3	Very low	98 Å²	98	147.5 Å²	147.5	69%	0.685	77%	0.773	S	S	*	*			trans	-147.1	158.8	-162.3	57.8	0	0	0	0	113.9
193	T	24.5	Very low	24.2	Very low	112 Å²	112	147.8 Å²	147.8	69%	0.687	78%	0.779	S	S	*	*			trans	52	110.7	151.9	50.5	0	0	0	0	117
194	N	24.8	Very low	24.4	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	78%	0.78	S	S	*	*				-173.9	161.1	84.3	-94.9	-28.9	0	0	0	115.5
195	N	23.7	Very low	24.5	Very low	133 Å²	133	149.5 Å²	149.5	71%	0.711	78%	0.777	S	S	*	*			trans	65.2	88.1	147.3	-62.8	1.2	0	0	0	121.7
196	S	23.3	Very low	24.7	Very low	107 Å²	107	149.7 Å²	149.7	75%	0.748	78%	0.776	S	S	*	*				50.4	92.9	115.1	66	0	0	0	0	120.4
197	Q	24.2	Very low	25.1	Very low	179 Å²	179	146.9 Å²	146.9	84%	0.836	77%	0.767	S	S	*	*			trans	-162.3	174.9	136.3	-107.6	165.7	26	0	0	109.3
198	F	24	Very low	25.1	Very low	185 Å²	185	145.9 Å²	145.9	81%	0.811	76%	0.756	S	S	*	*			trans	66	72.7	-175.5	-67	-81	0	0	0	117.2
199	Q	23.2	Very low	25.3	Very low	181 Å²	181	144.6 Å²	144.6	85%	0.846	75%	0.747	S	S	*	*			trans	-61.3	169.8	145.3	-66.2	171.7	-14.3	0	0	110.5
200	Q	25.6	Very low	25.6	Very low	198 Å²	198	140.7 Å²	140.7	93%	0.925	73%	0.727	S	S	*	*	S	Bend	trans	74.4	24.6	176.9	-51.9	-173.2	-11.2	0	0	119
201	K	25.8	Very low	25.9	Very low	168 Å²	168	135.8 Å²	135.8	73%	0.73	71%	0.709	S	S	*	*			trans	-132	-4.2	175.4	-125.3	177.9	-174.7	177.5	0	118.1	L203	K201-L203 PolarHBondContact O-N 3.42Å
202	S	25.9	Very low	25.8	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-81.2	-2.9	-161.1	48.5	0	0	0	0	117.6
203	L	25.5	Very low	26.2	Very low	161 Å²	161	136 Å²	136	84%	0.843	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-76.9	-21.4	-175	-99.2	163.3	0	0	0	115	K201	K201-L203 PolarHBondContact O-N 3.42Å
204	N	27.2	Very low	26.5	Very low	144 Å²	144	135 Å²	135	77%	0.77	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-100.4	-0.5	-174.7	-79.7	-35.3	0	0	0	115.2
205	E	27.4	Very low	26.7	Very low	130 Å²	130	134.5 Å²	134.5	61%	0.607	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-17.6	-174.5	-67.2	-178.2	154	0	0	113.8	S207 N208	E205-S207 VanDerWaalsContact C-N 3.3Å; E205-S207 PolarHBondContact O-N 2.8Å; E205-N208 PolarHBondContact O-N 2.87Å
206	K	27.3	Very low	27.1	Very low	169 Å²	169	134.2 Å²	134.2	74%	0.735	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-58.6	-37.1	177.2	-89.8	-173.9	170	-176.5	0	113.4	N208 Y209	K206-N208 PolarHBondContact O-N 2.79Å; K206-Y209 PolarHBondContact O-N 3.29Å; K206-Y209 VanDerWaalsContact O-N 3.14Å
207	S	28.9	Very low	27.6	Very low	77 Å²	77	131.8 Å²	131.8	54%	0.538	65%	0.646	S	S	.	*	G	3₁₀ helix	trans	-63.5	-14.1	-176.5	63.5	0	0	0	0	115.2	E205	E205-S207 VanDerWaalsContact C-N 3.3Å; E205-S207 PolarHBondContact O-N 2.8Å
208	N	26.7	Very low	28.1	Very low	103 Å²	103	127.8 Å²	127.8	55%	0.551	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-90.3	-20.5	179.2	-70.3	-23.3	0	0	0	113.1	E205 K206 L211	E205-N208 PolarHBondContact O-N 2.87Å; K206-N208 PolarHBondContact O-N 2.79Å; N208-L211 WeakPolarHBondContact O-CB 3.38Å; N208-L211 PolarHBondContact O-N 2.76Å
209	Y	25.3	Very low	28.5	Very low	182 Å²	182	121.8 Å²	121.8	71%	0.714	61%	0.605	S	S	*	*	H	α-helix	trans	-74.9	-38.1	178.6	-83	-89.2	0	0	0	111.9	K206 L211 F212	K206-Y209 PolarHBondContact O-N 3.29Å; K206-Y209 VanDerWaalsContact O-N 3.14Å; Y209-L211 PolarHBondContact O-N 3.39Å; Y209-F212 PolarHBondContact O-N 2.8Å; Y209-F212 VanDerWaalsContact O-N 3.09Å
210	D	33.1	Very low	29.1	Very low	74 Å²	74	117.2 Å²	117.2	40%	0.396	58%	0.583	S	S	.	*	H	α-helix	trans	-63	-23.2	174.5	-65.7	-51.2	0	0	0	113.3	N214	D210-N214 PolarHBondContact O-N 3.32Å; D210-N214 PolarHBondContact O-ND2 3.07Å
211	L	28.3	Very low	29.7	Very low	92 Å²	92	109.5 Å²	109.5	48%	0.482	55%	0.548	S	S	.	.	H	α-helix	trans	-67	-37.4	175.3	-149.1	83.4	0	0	0	111.5	N208 Y209 F215	N208-L211 WeakPolarHBondContact O-CB 3.38Å; N208-L211 PolarHBondContact O-N 2.76Å; Y209-L211 PolarHBondContact O-N 3.39Å; L211-F215 PolarHBondContact O-N 3.46Å
212	F	25.5	Very low	30.2	Very low	156 Å²	156	107.8 Å²	107.8	68%	0.684	54%	0.538	S	S	*	.	H	α-helix	trans	-68.8	-42.2	178.7	-98.7	-90.8	0	0	0	112.1	Y209 N214 F215 Q216	Y209-F212 PolarHBondContact O-N 2.8Å; Y209-F212 VanDerWaalsContact O-N 3.09Å; F212-N214 VanDerWaalsContact C-N 3.27Å; F212-N214 PolarHBondContact O-N 2.93Å; F212-F215 PolarHBondContact O-N 3.04Å; F212-F215 VanDerWaalsContact O-N 3.1Å; F212-Q216 WeakPolarHBondContact O-CB 3.45Å; F212-Q216 PolarHBondContact O-N 3.23Å
213	S	30	Very low	30.7	Very low	69 Å²	69	107.1 Å²	107.1	48%	0.483	53%	0.527	S	S	.	.	H	α-helix	trans	-55.3	-43.5	176.7	-54.2	0	0	0	0	111.9	Q216 L217	S213-Q216 PolarHBondContact O-N 3.05Å; S213-L217 PolarHBondContact O-N 3.43Å
214	N	32	Very low	31.1	Very low	91 Å²	91	106.4 Å²	106.4	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-68.1	-37.9	177	-77.3	-82.7	0	0	0	112.9	D210 F212 L217 Y218	D210-N214 PolarHBondContact O-N 3.32Å; D210-N214 PolarHBondContact O-ND2 3.07Å; F212-N214 VanDerWaalsContact C-N 3.27Å; F212-N214 PolarHBondContact O-N 2.93Å; N214-L217 PolarHBondContact O-N 3.23Å; N214-Y218 WeakPolarHBondContact O-CB 3.43Å; N214-Y218 PolarHBondContact O-N 3.25Å
215	F	27.9	Very low	31.5	Very low	132 Å²	132	104 Å²	104	58%	0.579	50%	0.5	S	S	*	.	H	α-helix	trans	-67.9	-32.9	173.5	-99.6	-82.8	0	0	0	113.3	L211 F212 S219	L211-F215 PolarHBondContact O-N 3.46Å; F212-F215 PolarHBondContact O-N 3.04Å; F212-F215 VanDerWaalsContact O-N 3.1Å; F215-S219 WeakPolarHBondContact O-CB 3.42Å; F215-S219 PolarHBondContact O-N 3.23Å; F215-S219 PolarHBondContact O-OG 2.91Å
216	Q	31.7	Very low	32.1	Very low	126 Å²	126	102.3 Å²	102.3	59%	0.589	50%	0.495	S	S	*	.	H	α-helix	trans	-71.1	-40.1	175.2	-167.5	168.1	-2.3	0	0	110.9	F212 S213 S219 Q220	F212-Q216 WeakPolarHBondContact O-CB 3.45Å; F212-Q216 PolarHBondContact O-N 3.23Å; S213-Q216 PolarHBondContact O-N 3.05Å; Q216-S219 PolarHBondContact O-N 3.13Å; Q216-Q220 WeakPolarHBondContact O-CG 3.48Å; Q216-Q220 PolarHBondContact O-N 3.22Å
217	L	34.9	Very low	32.7	Very low	56 Å²	56	101.9 Å²	101.9	29%	0.293	49%	0.493	S	S	.	.	H	α-helix	trans	-60.5	-45.1	171.4	-148.9	94	0	0	0	111.8	S213 N214 S219 Q220 L221	S213-L217 PolarHBondContact O-N 3.43Å; N214-L217 PolarHBondContact O-N 3.23Å; L217-S219 PolarHBondContact O-N 3.16Å; L217-Q220 PolarHBondContact O-N 3.41Å; L217-L221 HydrophobicContact CD2-CD1 4.27Å; L217-L221 PolarHBondContact O-N 3.1Å
218	Y	33.4	Very low	32.9	Very low	96 Å²	96	101.8 Å²	101.8	38%	0.376	49%	0.487	S	S	.	.	H	α-helix	trans	-58.7	-45.7	174.9	176.1	-88.3	0	0	0	111.7	N214 Q220 L221 Y222	N214-Y218 WeakPolarHBondContact O-CB 3.43Å; N214-Y218 PolarHBondContact O-N 3.25Å; Y218-Q220 PolarHBondContact O-N 3.44Å; Y218-L221 PolarHBondContact O-N 2.92Å; Y218-Y222 WeakPolarHBondContact O-CB 3.45Å; Y218-Y222 PolarHBondContact O-N 3.17Å
219	S	32	Very low	33.2	Very low	59 Å²	59	105.2 Å²	105.2	41%	0.413	51%	0.505	S	S	.	.	H	α-helix	trans	-67.7	-32.9	178.6	-61	0	0	0	0	112.8	F215 Q216 L217 N223	F215-S219 WeakPolarHBondContact O-CB 3.42Å; F215-S219 PolarHBondContact O-N 3.23Å; F215-S219 PolarHBondContact O-OG 2.91Å; Q216-S219 PolarHBondContact O-N 3.13Å; L217-S219 PolarHBondContact O-N 3.16Å; S219-N223 WeakPolarHBondContact O-CB 3.47Å; S219-N223 PolarHBondContact O-N 3.19Å; S219-N223 PolarHBondContact O-ND2 3.4Å
220	Q	36	Very low	33.5	Very low	85 Å²	85	102.3 Å²	102.3	40%	0.397	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-54.5	172	-75.1	177.6	3.9	0	0	111	Q216 L217 Y218 Y222 N223 Y224	Q216-Q220 WeakPolarHBondContact O-CG 3.48Å; Q216-Q220 PolarHBondContact O-N 3.22Å; L217-Q220 PolarHBondContact O-N 3.41Å; Y218-Q220 PolarHBondContact O-N 3.44Å; Q220-Y222 PolarHBondContact O-N 3.12Å; Q220-N223 PolarHBondContact O-N 3.09Å; Q220-Y224 WeakPolarHBondContact O-CB 3.4Å; Q220-Y224 PolarHBondContact O-N 3.07Å
221	L	38.1	Very low	33.6	Very low	36 Å²	36	107.5 Å²	107.5	19%	0.188	52%	0.523	C	S	.	.	H	α-helix	trans	-58.4	-45.3	178.8	-82.7	160.8	0	0	0	112.3	L217 Y218 N223 Y224 I225 L236 Y239	L217-L221 HydrophobicContact CD2-CD1 4.27Å; L217-L221 PolarHBondContact O-N 3.1Å; Y218-L221 PolarHBondContact O-N 2.92Å; L221-N223 PolarHBondContact O-N 3.17Å; L221-Y224 PolarHBondContact O-N 2.92Å; L221-I225 HydrophobicContact CD2-CD1 4.48Å; L221-I225 WeakPolarHBondContact O-CB 3.32Å; L221-I225 VanDerWaalsContact O-CG1 3.27Å; L221-I225 WeakPolarHBondContact O-CG1 3.33Å; L221-I225 PolarHBondContact O-N 3.4Å; L221-L236 HydrophobicContact CD2-CD1 4.45Å; L221-Y239 HydrophobicContact CD2-CD1 4.14Å; L221-Y239 HydrophobicContact CD2-CE1 3.73Å; L221-Y239 HydrophobicContact CG-CE1 4.17Å
222	Y	36.2	Very low	33.8	Very low	132 Å²	132	107.9 Å²	107.9	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-38.2	179.6	-172.5	-88.3	0	0	0	112.4	Y218 Q220 N226	Y218-Y222 WeakPolarHBondContact O-CB 3.45Å; Y218-Y222 PolarHBondContact O-N 3.17Å; Q220-Y222 PolarHBondContact O-N 3.12Å; Y222-N226 WeakPolarHBondContact CD2-ND2 3.39Å; Y222-N226 WeakPolarHBondContact CE1-ND2 3.42Å; Y222-N226 WeakPolarHBondContact CE2-ND2 3.15Å; Y222-N226 WeakPolarHBondContact O-CB 3.44Å; Y222-N226 PolarHBondContact O-N 3.19Å; Y222-N226 PolarHBondContact O-ND2 3.25Å
223	N	36.3	Very low	34.1	Very low	79 Å²	79	106 Å²	106	42%	0.422	53%	0.53	S	S	.	.	H	α-helix	trans	-71.8	-39.5	174.5	-82.1	-67.2	0	0	0	112.2	S219 Q220 L221 K227	S219-N223 WeakPolarHBondContact O-CB 3.47Å; S219-N223 PolarHBondContact O-N 3.19Å; S219-N223 PolarHBondContact O-ND2 3.4Å; Q220-N223 PolarHBondContact O-N 3.09Å; L221-N223 PolarHBondContact O-N 3.17Å; N223-K227 WeakPolarHBondContact O-CB 3.43Å; N223-K227 PolarHBondContact O-N 3.26Å
224	Y	34.8	Very low	34.3	Very low	147 Å²	147	107.2 Å²	107.2	58%	0.576	53%	0.53	S	S	*	.	H	α-helix	trans	-65.7	-42.3	-179.2	-153.1	-92.5	0	0	0	111.7	Q220 L221	Q220-Y224 WeakPolarHBondContact O-CB 3.4Å; Q220-Y224 PolarHBondContact O-N 3.07Å; L221-Y224 PolarHBondContact O-N 2.92Å
225	I	36.4	Very low	34.4	Very low	92 Å²	92	106.4 Å²	106.4	47%	0.472	53%	0.53	S	S	.	.	H	α-helix	trans	-72.6	-33.7	179.4	-66.6	166.4	0	0	0	112.5	L221	L221-I225 HydrophobicContact CD2-CD1 4.48Å; L221-I225 WeakPolarHBondContact O-CB 3.32Å; L221-I225 VanDerWaalsContact O-CG1 3.27Å; L221-I225 WeakPolarHBondContact O-CG1 3.33Å; L221-I225 PolarHBondContact O-N 3.4Å
226	N	39.4	Very low	34.7	Very low	95 Å²	95	102.1 Å²	102.1	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-98.5	-22.2	-173.4	-68.9	-62.1	0	0	0	115.6	Y222	Y222-N226 WeakPolarHBondContact CD2-ND2 3.39Å; Y222-N226 WeakPolarHBondContact CE1-ND2 3.42Å; Y222-N226 WeakPolarHBondContact CE2-ND2 3.15Å; Y222-N226 WeakPolarHBondContact O-CB 3.44Å; Y222-N226 PolarHBondContact O-N 3.19Å; Y222-N226 PolarHBondContact O-ND2 3.25Å
227	K	39.8	Very low	34.8	Very low	160 Å²	160	99.9 Å²	99.9	70%	0.696	50%	0.499	S	S	*	.	H	α-helix	trans	-81.8	-28.9	178.7	-75.9	-167.3	170.5	-170.3	0	113.4	N223	N223-K227 WeakPolarHBondContact O-CB 3.43Å; N223-K227 PolarHBondContact O-N 3.26Å
228	N	32.5	Very low	34.8	Very low	75 Å²	75	99.8 Å²	99.8	40%	0.401	50%	0.499	S	S	.	.			trans	-125	110.9	-167.3	-70.4	0.6	0	0	0	109.8	I230	N228-I230 HydrophobicContact CB-CB 4.13Å; N228-I230 HydrophobicContact CB-CD1 3.87Å; N228-I230 HydrophobicContact CB-CG1 3.88Å; N228-I230 PolarHBondContact O-N 2.91Å
229	N	34.3	Very low	35	Very low	175 Å²	175	97.9 Å²	97.9	94%	0.936	49%	0.491	S	S	*	.			trans	-72.8	40.7	164.8	-74.8	-18.9	0	0	0	111.3
230	I	31.6	Very low	35.2	Very low	122 Å²	122	97.3 Å²	97.3	63%	0.626	48%	0.483	S	S	*	.			trans	-96.1	127.9	-176.6	-64.2	176.8	0	0	0	107.4	N228 M232	N228-I230 HydrophobicContact CB-CB 4.13Å; N228-I230 HydrophobicContact CB-CD1 3.87Å; N228-I230 HydrophobicContact CB-CG1 3.88Å; N228-I230 PolarHBondContact O-N 2.91Å; I230-M232 PolarHBondContact O-N 3.28Å
231	E	34.2	Very low	35.4	Very low	182 Å²	182	95.1 Å²	95.1	85%	0.85	47%	0.474	S	S	*	.			trans	-57.8	127.9	171.8	-62.7	-176.7	119.9	0	0	109.5	S233	E231-S233 PolarHBondContact O-N 2.97Å
232	M	31.8	Very low	35.5	Very low	100 Å²	100	100.1 Å²	100.1	49%	0.493	50%	0.496	S	S	.	.			trans	-66.3	101.1	178.6	-84	-174	-67.6	0	0	110.1	I230 I234 L236	I230-M232 PolarHBondContact O-N 3.28Å; M232-I234 PolarHBondContact O-N 2.81Å; M232-L236 HydrophobicContact CE-CB 3.91Å; M232-L236 HydrophobicContact CE-CD1 4.28Å; M232-L236 HydrophobicContact CE-CD2 4.47Å; M232-L236 HydrophobicContact CE-CG 4.44Å; M232-L236 HydrophobicContact SD-CB 4.18Å; M232-L236 HydrophobicContact SD-CD1 3.94Å
233	S	33.4	Very low	35.7	Very low	118 Å²	118	99.7 Å²	99.7	83%	0.825	49%	0.494	S	S	*	.	S	Bend	trans	-64.2	-19.7	175.9	54.5	0	0	0	0	113.6	E231	E231-S233 PolarHBondContact O-N 2.97Å
234	I	33.2	Very low	36	Very low	94 Å²	94	100.3 Å²	100.3	48%	0.482	50%	0.497	S	S	.	.	S	Bend	trans	-108.6	123.3	168.4	-60.7	173.3	0	0	0	107.2	M232 L236 D238	M232-I234 PolarHBondContact O-N 2.81Å; I234-L236 PolarHBondContact O-N 3.32Å; I234-D238 HydrophobicContact CG2-CB 3.93Å
235	P	34.2	Very low	36.5	Very low	74 Å²	74	97.1 Å²	97.1	48%	0.481	49%	0.489	S	S	.	.			trans	-51.3	135.8	175.2	-27.2	34.6	0	0	0	112.1	Y237 D238 Y239	P235-Y237 PolarHBondContact O-N 2.88Å; P235-D238 WeakPolarHBondContact CB-OD2 3.17Å; P235-D238 WeakPolarHBondContact CD-OD2 3.1Å; P235-D238 WeakPolarHBondContact CG-OD2 3.35Å; P235-D238 PolarHBondContact O-N 2.89Å; P235-Y239 PolarHBondContact O-N 3.27Å
236	L	34.7	Very low	36.9	Very low	42 Å²	42	94.8 Å²	94.8	22%	0.22	48%	0.477	C	S	.	.	H	α-helix	trans	-56.4	-25.6	176.1	-171.9	67.8	0	0	0	112.1	L221 M232 I234 I240	L221-L236 HydrophobicContact CD2-CD1 4.45Å; M232-L236 HydrophobicContact CE-CB 3.91Å; M232-L236 HydrophobicContact CE-CD1 4.28Å; M232-L236 HydrophobicContact CE-CD2 4.47Å; M232-L236 HydrophobicContact CE-CG 4.44Å; M232-L236 HydrophobicContact SD-CB 4.18Å; M232-L236 HydrophobicContact SD-CD1 3.94Å; I234-L236 PolarHBondContact O-N 3.32Å; L236-I240 HydrophobicContact CD1-CD1 4.25Å; L236-I240 HydrophobicContact CD1-CG1 4.39Å; L236-I240 HydrophobicContact CD2-CD1 4.21Å; L236-I240 HydrophobicContact CG-CD1 3.79Å; L236-I240 HydrophobicContact CG-CG1 4.29Å; L236-I240 WeakPolarHBondContact O-CB 3.26Å; L236-I240 VanDerWaalsContact O-CG1 3.28Å; L236-I240 WeakPolarHBondContact O-CG1 3.35Å; L236-I240 PolarHBondContact O-N 3.48Å
237	Y	32.6	Very low	37.2	Very low	78 Å²	78	93.7 Å²	93.7	31%	0.306	47%	0.471	S	S	.	.	H	α-helix	trans	-49.7	-57.5	167	173.4	-93.5	0	0	0	112	P235 I240 I241 F380	P235-Y237 PolarHBondContact O-N 2.88Å; Y237-I240 PolarHBondContact O-N 3.4Å; Y237-I241 HydrophobicContact CD1-CD1 4.18Å; Y237-I241 HydrophobicContact CD2-CD1 3.62Å; Y237-I241 HydrophobicContact CE1-CD1 3.87Å; Y237-I241 HydrophobicContact CE2-CD1 3.28Å; Y237-I241 HydrophobicContact CG-CD1 4.05Å; Y237-I241 VanDerWaalsContact CZ-CD1 3.41Å; Y237-I241 WeakPolarHBondContact O-CB 3.33Å; Y237-I241 WeakPolarHBondContact O-CG1 3.38Å; Y237-I241 PolarHBondContact O-N 3.36Å; Y237-F380 AromaticContact CD2-CD2 3.83Å; Y237-F380 HydrophobicContact CD2-CD2 3.83Å; Y237-F380 AromaticContact CD2-CE2 3.66Å; Y237-F380 HydrophobicContact CD2-CE2 3.66Å; Y237-F380 HydrophobicContact CD2-CZ 4.48Å; Y237-F380 HydrophobicContact CG-CE2 4.41Å
238	D	36.1	Very low	37.6	Very low	54 Å²	54	90.5 Å²	90.5	29%	0.289	46%	0.459	S	S	.	.	H	α-helix	trans	-67.3	-42.5	-178.1	-61	-59.1	0	0	0	111.3	I234 P235 I240 I241 Q242	I234-D238 HydrophobicContact CG2-CB 3.93Å; P235-D238 WeakPolarHBondContact CB-OD2 3.17Å; P235-D238 WeakPolarHBondContact CD-OD2 3.1Å; P235-D238 WeakPolarHBondContact CG-OD2 3.35Å; P235-D238 PolarHBondContact O-N 2.89Å; D238-I240 VanDerWaalsContact C-N 3.29Å; D238-I240 PolarHBondContact O-N 2.86Å; D238-I241 PolarHBondContact O-N 3.49Å; D238-Q242 WeakPolarHBondContact O-CB 3.1Å; D238-Q242 WeakPolarHBondContact O-CG 3.16Å; D238-Q242 PolarHBondContact O-N 3.33Å
239	Y	36.5	Very low	38.2	Very low	56 Å²	56	90.9 Å²	90.9	22%	0.22	46%	0.457	C	S	.	.	H	α-helix	trans	-61.6	-36.3	178.4	-172.5	-87.5	0	0	0	112.9	L221 P235 R243	L221-Y239 HydrophobicContact CD2-CD1 4.14Å; L221-Y239 HydrophobicContact CD2-CE1 3.73Å; L221-Y239 HydrophobicContact CG-CE1 4.17Å; P235-Y239 PolarHBondContact O-N 3.27Å; Y239-R243 WeakPolarHBondContact O-CB 3.37Å; Y239-R243 WeakPolarHBondContact O-CG 3.45Å; Y239-R243 VanDerWaalsContact OH-CZ 3.31Å; Y239-R243 PolarHBondContact OH-NH1 3.25Å
240	I	37.3	Very low	38.8	Very low	47 Å²	47	83.8 Å²	83.8	24%	0.241	42%	0.419	C	S	.	.	H	α-helix	trans	-75.8	-43.7	176.3	-71.9	175	0	0	0	110.7	L236 Y237 D238 R243 L244 I511	L236-I240 HydrophobicContact CD1-CD1 4.25Å; L236-I240 HydrophobicContact CD1-CG1 4.39Å; L236-I240 HydrophobicContact CD2-CD1 4.21Å; L236-I240 HydrophobicContact CG-CD1 3.79Å; L236-I240 HydrophobicContact CG-CG1 4.29Å; L236-I240 WeakPolarHBondContact O-CB 3.26Å; L236-I240 VanDerWaalsContact O-CG1 3.28Å; L236-I240 WeakPolarHBondContact O-CG1 3.35Å; L236-I240 PolarHBondContact O-N 3.48Å; Y237-I240 PolarHBondContact O-N 3.4Å; D238-I240 VanDerWaalsContact C-N 3.29Å; D238-I240 PolarHBondContact O-N 2.86Å; I240-R243 CarbonylContact O-C 3.56Å; I240-R243 PolarHBondContact O-N 2.99Å; I240-R243 VanDerWaalsContact O-N 3.15Å; I240-L244 HydrophobicContact CG2-CD1 3.95Å; I240-L244 WeakPolarHBondContact O-CB 3.29Å; I240-L244 PolarHBondContact O-N 2.99Å; I240-I511 HydrophobicContact CD1-CD1 3.91Å
241	I	39.5	Very low	39.5	Very low	40 Å²	40	82.3 Å²	82.3	21%	0.205	41%	0.412	C	S	.	.	H	α-helix	trans	-73.1	-33.5	-176.5	-74.1	172.5	0	0	0	112.4	Y237 D238 R243 S311	Y237-I241 HydrophobicContact CD1-CD1 4.18Å; Y237-I241 HydrophobicContact CD2-CD1 3.62Å; Y237-I241 HydrophobicContact CE1-CD1 3.87Å; Y237-I241 HydrophobicContact CE2-CD1 3.28Å; Y237-I241 HydrophobicContact CG-CD1 4.05Å; Y237-I241 VanDerWaalsContact CZ-CD1 3.41Å; Y237-I241 WeakPolarHBondContact O-CB 3.33Å; Y237-I241 WeakPolarHBondContact O-CG1 3.38Å; Y237-I241 PolarHBondContact O-N 3.36Å; D238-I241 PolarHBondContact O-N 3.49Å; I241-R243 PolarHBondContact O-N 2.83Å; I241-S311 WeakPolarHBondContact CG2-O 3.39Å; I241-S311 VanDerWaalsContact CG2-OG 3.26Å; I241-S311 WeakPolarHBondContact CG2-OG 3.47Å; I241-S311 WeakPolarHBondContact O-CB 3.31Å; I241-S311 PolarHBondContact O-OG 2.77Å
242	Q	40.3	Very low	39.9	Very low	141 Å²	141	77.3 Å²	77.3	66%	0.659	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-13.8	170	-69.9	171.7	6.8	0	0	113.3	D238	D238-Q242 WeakPolarHBondContact O-CB 3.1Å; D238-Q242 WeakPolarHBondContact O-CG 3.16Å; D238-Q242 PolarHBondContact O-N 3.33Å
243	R	40.8	Very low	40.4	Very low	122 Å²	122	74 Å²	74	46%	0.46	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-0.1	-179	-69.5	-177.1	166.2	-141.7	-1.8	114.1	Y239 I240 I241	Y239-R243 WeakPolarHBondContact O-CB 3.37Å; Y239-R243 WeakPolarHBondContact O-CG 3.45Å; Y239-R243 VanDerWaalsContact OH-CZ 3.31Å; Y239-R243 PolarHBondContact OH-NH1 3.25Å; I240-R243 CarbonylContact O-C 3.56Å; I240-R243 PolarHBondContact O-N 2.99Å; I240-R243 VanDerWaalsContact O-N 3.15Å; I241-R243 PolarHBondContact O-N 2.83Å
244	L	41.6	Very low	40.8	Very low	93 Å²	93	74 Å²	74	49%	0.487	36%	0.361	S	S	.	.			trans	-93.8	91.1	171.7	-111.7	168.4	0	0	0	108.8	I240 M246	I240-L244 HydrophobicContact CG2-CD1 3.95Å; I240-L244 WeakPolarHBondContact O-CB 3.29Å; I240-L244 PolarHBondContact O-N 2.99Å; L244-M246 PolarHBondContact O-N 3.43Å
245	D	46	Very low	41	Very low	79 Å²	79	73.2 Å²	73.2	42%	0.422	36%	0.363	S	S	.	.			trans	-68.9	99.7	173.4	-177.5	9.6	0	0	0	110.1	N247 Q248 F249	D245-N247 PolarHBondContact O-N 2.84Å; D245-N247 WeakPolarHBondContact OD1-CA 3.49Å; D245-N247 WeakPolarHBondContact OD1-CB 3.32Å; D245-N247 PolarHBondContact OD1-N 3.38Å; D245-N247 PolarHBondContact OD1-ND2 3.07Å; D245-Q248 HydrophobicContact CB-CB 3.93Å; D245-Q248 PolarHBondContact O-N 2.77Å; D245-Q248 VanDerWaalsContact O-N 3.15Å; D245-Q248 PolarHBondContact OD1-N 3.41Å; D245-Q248 WeakPolarHBondContact OD2-CB 3.34Å; D245-Q248 PolarHBondContact OD2-N 3.31Å; D245-F249 PolarHBondContact O-N 2.8Å
246	M	45.6	Very low	41	Very low	44 Å²	44	76.1 Å²	76.1	22%	0.217	37%	0.373	C	S	.	.	H	α-helix	trans	-61.8	-26.3	175.5	-72.8	-64.3	-66.2	0	0	112.1	L244 F249 I250	L244-M246 PolarHBondContact O-N 3.43Å; M246-F249 HydrophobicContact CE-CD1 4.41Å; M246-F249 PolarHBondContact O-N 3.13Å; M246-I250 WeakPolarHBondContact O-CB 3.37Å; M246-I250 WeakPolarHBondContact O-CD1 3.31Å; M246-I250 VanDerWaalsContact O-CG1 3.23Å; M246-I250 WeakPolarHBondContact O-CG1 3.48Å; M246-I250 PolarHBondContact O-N 2.75Å
247	N	45.2	Very low	41	Very low	72 Å²	72	77.2 Å²	77.2	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-70.7	-43.3	173.7	-51.5	-73.3	0	0	0	110.5	D245 F249 I250 N251	D245-N247 PolarHBondContact O-N 2.84Å; D245-N247 WeakPolarHBondContact OD1-CA 3.49Å; D245-N247 WeakPolarHBondContact OD1-CB 3.32Å; D245-N247 PolarHBondContact OD1-N 3.38Å; D245-N247 PolarHBondContact OD1-ND2 3.07Å; N247-F249 VanDerWaalsContact C-N 3.31Å; N247-F249 PolarHBondContact O-N 3.47Å; N247-I250 PolarHBondContact O-N 2.86Å; N247-N251 VanDerWaalsContact O-CB 3.23Å; N247-N251 WeakPolarHBondContact O-CB 3.37Å; N247-N251 PolarHBondContact O-N 2.78Å; N247-N251 PolarHBondContact O-ND2 3.33Å; N247-N251 VanDerWaalsContact O-ND2 3.16Å
248	Q	48.5	Very low	41	Very low	92 Å²	92	77.5 Å²	77.5	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-63.1	-37	172.5	-162.7	176.8	24.2	0	0	111.6	D245 N252	D245-Q248 HydrophobicContact CB-CB 3.93Å; D245-Q248 PolarHBondContact O-N 2.77Å; D245-Q248 VanDerWaalsContact O-N 3.15Å; D245-Q248 PolarHBondContact OD1-N 3.41Å; D245-Q248 WeakPolarHBondContact OD2-CB 3.34Å; D245-Q248 PolarHBondContact OD2-N 3.31Å; Q248-N252 VanDerWaalsContact O-CB 3.32Å; Q248-N252 WeakPolarHBondContact O-CB 3.49Å; Q248-N252 PolarHBondContact O-N 3.28Å; Q248-N252 PolarHBondContact O-ND2 2.88Å
249	F	45	Very low	40.9	Very low	84 Å²	84	79.5 Å²	79.5	37%	0.368	40%	0.395	S	S	.	.	H	α-helix	trans	-64.1	-46.9	173	-177.7	-103.9	0	0	0	112.5	D245 M246 N247 N252 L253 M321	D245-F249 PolarHBondContact O-N 2.8Å; M246-F249 HydrophobicContact CE-CD1 4.41Å; M246-F249 PolarHBondContact O-N 3.13Å; N247-F249 VanDerWaalsContact C-N 3.31Å; N247-F249 PolarHBondContact O-N 3.47Å; F249-N252 PolarHBondContact O-N 3.16Å; F249-L253 HydrophobicContact CD1-CD1 4.07Å; F249-L253 HydrophobicContact CE1-CD1 3.51Å; F249-L253 HydrophobicContact CZ-CD1 3.9Å; F249-L253 PolarHBondContact O-N 3.41Å; F249-M321 HydrophobicContact CE1-CE 4.44Å; F249-M321 HydrophobicContact CE1-SD 4.28Å
250	I	45.6	Very low	40.6	Very low	26 Å²	26	83.5 Å²	83.5	13%	0.133	42%	0.42	C	S	.	.	H	α-helix	trans	-65.7	-39.6	177.5	-71.4	165.6	0	0	0	111.2	M246 N247 N252 L253 K254 L307	M246-I250 WeakPolarHBondContact O-CB 3.37Å; M246-I250 WeakPolarHBondContact O-CD1 3.31Å; M246-I250 VanDerWaalsContact O-CG1 3.23Å; M246-I250 WeakPolarHBondContact O-CG1 3.48Å; M246-I250 PolarHBondContact O-N 2.75Å; N247-I250 PolarHBondContact O-N 2.86Å; I250-N252 VanDerWaalsContact C-N 3.35Å; I250-L253 CarbonylContact O-C 3.6Å; I250-L253 WeakPolarHBondContact O-CB 3.19Å; I250-L253 PolarHBondContact O-N 3.33Å; I250-L253 VanDerWaalsContact O-N 3.15Å; I250-K254 HydrophobicContact CG2-CD 4.32Å; I250-K254 WeakPolarHBondContact O-CG 3.38Å; I250-K254 PolarHBondContact O-N 2.83Å; I250-L307 HydrophobicContact CD1-CD1 3.62Å
251	N	47.1	Very low	40.3	Very low	90 Å²	90	88.6 Å²	88.6	48%	0.481	44%	0.443	S	S	.	.	H	α-helix	trans	-68.1	-34	176.3	-71.1	-26.6	0	0	0	112.1	N247 K254 S255	N247-N251 VanDerWaalsContact O-CB 3.23Å; N247-N251 WeakPolarHBondContact O-CB 3.37Å; N247-N251 PolarHBondContact O-N 2.78Å; N247-N251 PolarHBondContact O-ND2 3.33Å; N247-N251 VanDerWaalsContact O-ND2 3.16Å; N251-K254 PolarHBondContact O-N 3.41Å; N251-S255 PolarHBondContact O-N 3.5Å; N251-S255 PolarHBondContact O-OG 3.44Å
252	N	43.2	Very low	39.8	Very low	78 Å²	78	91 Å²	91	42%	0.417	46%	0.455	S	S	.	.	H	α-helix	trans	-69.1	-32.3	169.6	-75.6	-34.4	0	0	0	112.5	Q248 F249 I250 S255 I256	Q248-N252 VanDerWaalsContact O-CB 3.32Å; Q248-N252 WeakPolarHBondContact O-CB 3.49Å; Q248-N252 PolarHBondContact O-N 3.28Å; Q248-N252 PolarHBondContact O-ND2 2.88Å; F249-N252 PolarHBondContact O-N 3.16Å; I250-N252 VanDerWaalsContact C-N 3.35Å; N252-S255 PolarHBondContact O-OG 3.33Å; N252-I256 WeakPolarHBondContact O-CD1 3.47Å; N252-I256 WeakPolarHBondContact O-CG1 3.29Å; N252-I256 PolarHBondContact O-N 2.93Å; N252-I256 VanDerWaalsContact O-N 3.16Å
253	L	42.9	Very low	39.1	Very low	30 Å²	30	89.1 Å²	89.1	16%	0.157	46%	0.455	C	S	.	.	H	α-helix	trans	-67.1	-43.4	168.9	-93.2	162.9	0	0	0	111.6	F249 I250 S255 I256 I257 M321	F249-L253 HydrophobicContact CD1-CD1 4.07Å; F249-L253 HydrophobicContact CE1-CD1 3.51Å; F249-L253 HydrophobicContact CZ-CD1 3.9Å; F249-L253 PolarHBondContact O-N 3.41Å; I250-L253 CarbonylContact O-C 3.6Å; I250-L253 WeakPolarHBondContact O-CB 3.19Å; I250-L253 PolarHBondContact O-N 3.33Å; I250-L253 VanDerWaalsContact O-N 3.15Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 2.91Å; L253-I256 PolarHBondContact O-N 2.65Å; L253-I257 HydrophobicContact CD2-CD1 4.32Å; L253-I257 WeakPolarHBondContact O-CG1 3.33Å; L253-I257 PolarHBondContact O-N 3.48Å; L253-M321 HydrophobicContact CD1-SD 4.38Å
254	K	40.5	Very low	38.4	Very low	119 Å²	119	94.6 Å²	94.6	52%	0.517	48%	0.476	S	S	.	.	H	α-helix	trans	-62.6	-31.3	175.7	-72.3	176.6	178.4	179.7	0	113.1	I250 N251 I257	I250-K254 HydrophobicContact CG2-CD 4.32Å; I250-K254 WeakPolarHBondContact O-CG 3.38Å; I250-K254 PolarHBondContact O-N 2.83Å; N251-K254 PolarHBondContact O-N 3.41Å; K254-I257 CarbonylContact O-C 3.58Å
255	S	37.3	Very low	37.8	Very low	76 Å²	76	94.1 Å²	94.1	53%	0.531	48%	0.477	S	S	.	.	H	α-helix	trans	-83.4	-18.8	174.7	66.5	0	0	0	0	114.2	N251 N252 L253	N251-S255 PolarHBondContact O-N 3.5Å; N251-S255 PolarHBondContact O-OG 3.44Å; N252-S255 PolarHBondContact O-OG 3.33Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 2.91Å
256	I	34.3	Very low	36.8	Very low	135 Å²	135	95.9 Å²	95.9	69%	0.692	49%	0.491	S	S	*	.	H	α-helix	trans	-82.3	-41.3	170.6	-70.7	165.8	0	0	0	110.8	N252 L253 N258	N252-I256 WeakPolarHBondContact O-CD1 3.47Å; N252-I256 WeakPolarHBondContact O-CG1 3.29Å; N252-I256 PolarHBondContact O-N 2.93Å; N252-I256 VanDerWaalsContact O-N 3.16Å; L253-I256 PolarHBondContact O-N 2.65Å; I256-N258 VanDerWaalsContact C-N 3.32Å; I256-N258 PolarHBondContact O-N 2.83Å; I256-N258 VanDerWaalsContact O-N 3.13Å
257	I	35.1	Very low	36	Very low	65 Å²	65	99.3 Å²	99.3	33%	0.333	51%	0.509	S	S	.	.	S	Bend	trans	-84.4	79.1	173.6	-51.9	169	0	0	0	107.4	L253 K254 I259 I324	L253-I257 HydrophobicContact CD2-CD1 4.32Å; L253-I257 WeakPolarHBondContact O-CG1 3.33Å; L253-I257 PolarHBondContact O-N 3.48Å; K254-I257 CarbonylContact O-C 3.58Å; I257-I259 HydrophobicContact CG2-CD1 4.35Å; I257-I259 HydrophobicContact CG2-CG1 3.85Å; I257-I259 PolarHBondContact O-N 3.23Å; I257-I324 HydrophobicContact CD1-CG2 4.03Å
258	N	32.5	Very low	35.1	Very low	84 Å²	84	102 Å²	102	45%	0.449	52%	0.522	S	S	.	.			trans	-74.2	72.5	-175.5	-157.5	76.1	0	0	0	111.7	I256 D260 H261	I256-N258 VanDerWaalsContact C-N 3.32Å; I256-N258 PolarHBondContact O-N 2.83Å; I256-N258 VanDerWaalsContact O-N 3.13Å; N258-D260 PolarHBondContact O-N 3.37Å; N258-D260 VanDerWaalsContact O-N 3.15Å; N258-H261 PolarHBondContact O-N 2.9Å
259	I	33	Very low	34	Very low	96 Å²	96	105.3 Å²	105.3	49%	0.492	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-57	-27.6	-176.8	-64	177.4	0	0	0	111.8	I257 H261 I262	I257-I259 HydrophobicContact CG2-CD1 4.35Å; I257-I259 HydrophobicContact CG2-CG1 3.85Å; I257-I259 PolarHBondContact O-N 3.23Å; I259-H261 PolarHBondContact O-N 3.11Å; I259-I262 HydrophobicContact CG2-CD1 4.2Å; I259-I262 PolarHBondContact O-N 2.83Å
260	D	30.3	Very low	33.1	Very low	140 Å²	140	106.3 Å²	106.3	75%	0.749	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-57.2	-3.4	177.1	-61.3	-18.1	0	0	0	115.3	N258	N258-D260 PolarHBondContact O-N 3.37Å; N258-D260 VanDerWaalsContact O-N 3.15Å
261	H	31.3	Very low	32.1	Very low	155 Å²	155	111.8 Å²	111.8	72%	0.718	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-119.3	11.9	176.1	-70	0.6	0	0	0	114.3	N258 I259 P263	N258-H261 PolarHBondContact O-N 2.9Å; I259-H261 PolarHBondContact O-N 3.11Å; H261-P263 WeakPolarHBondContact O-CD 3.2Å
262	I	30.2	Very low	31.2	Very low	90 Å²	90	113.1 Å²	113.1	46%	0.462	60%	0.596	S	S	.	*	S	Bend	trans	-71.6	123.7	161.4	-58.9	-179.3	0	0	0	107.6	I259 R264	I259-I262 HydrophobicContact CG2-CD1 4.2Å; I259-I262 PolarHBondContact O-N 2.83Å; I262-R264 PolarHBondContact O-N 2.92Å
263	P	25.4	Very low	30.4	Very low	101 Å²	101	114.9 Å²	114.9	66%	0.656	61%	0.61	S	S	*	*			trans	-61.7	123.7	177.1	-22.1	33.7	0	0	0	110.9	H261 T265	H261-P263 WeakPolarHBondContact O-CD 3.2Å; P263-T265 PolarHBondContact O-N 3.42Å
264	R	26.4	Very low	29.7	Very low	238 Å²	238	120.9 Å²	120.9	90%	0.898	64%	0.643	S	S	*	*			trans	-70.4	84.6	163.5	-87.1	-177.2	164.7	177.2	-5.1	108.9	I262 T266	I262-R264 PolarHBondContact O-N 2.92Å; R264-T266 VanDerWaalsContact C-N 3.33Å; R264-T266 PolarHBondContact O-N 2.66Å; R264-T266 PolarHBondContact O-OG1 3.22Å
265	T	29	Very low	29	Very low	83 Å²	83	119.6 Å²	119.6	51%	0.509	65%	0.648	S	S	.	*			trans	-68.2	93.8	161.9	35.9	0	0	0	0	108.1	P263 I267	P263-T265 PolarHBondContact O-N 3.42Å; T265-I267 VanDerWaalsContact C-N 3.27Å; T265-I267 PolarHBondContact O-N 2.97Å
266	T	25.1	Very low	28.4	Very low	115 Å²	115	121.7 Å²	121.7	71%	0.706	66%	0.658	S	S	*	*			trans	-70.4	80.1	-177.6	-44.9	0	0	0	0	110.7	R264 I268	R264-T266 VanDerWaalsContact C-N 3.33Å; R264-T266 PolarHBondContact O-N 2.66Å; R264-T266 PolarHBondContact O-OG1 3.22Å; T266-I268 HydrophobicContact CG2-CG1 4.3Å; T266-I268 PolarHBondContact O-N 2.85Å
267	I	27.1	Very low	27.9	Very low	117 Å²	117	121.4 Å²	121.4	60%	0.6	66%	0.663	S	S	*	*			trans	-69.3	101.5	169	-60.3	-176.7	0	0	0	107.3	T265 N269 N289	T265-I267 VanDerWaalsContact C-N 3.27Å; T265-I267 PolarHBondContact O-N 2.97Å; I267-N269 PolarHBondContact O-N 3.3Å; I267-N289 WeakPolarHBondContact CD1-ND2 3.44Å
268	I	26.9	Very low	27.4	Very low	129 Å²	129	124.1 Å²	124.1	66%	0.662	68%	0.683	S	S	*	*			trans	-73.6	113.9	171.5	-59.8	174.1	0	0	0	106.6	T266 T270	T266-I268 HydrophobicContact CG2-CG1 4.3Å; T266-I268 PolarHBondContact O-N 2.85Å; I268-T270 HydrophobicContact CG2-CG2 4.25Å; I268-T270 PolarHBondContact O-N 3.26Å
269	N	24.9	Very low	27	Very low	160 Å²	160	125.9 Å²	125.9	86%	0.856	70%	0.697	S	S	*	*			trans	-63.7	102.2	172.4	-85	-10.2	0	0	0	109.7	I267	I267-N269 PolarHBondContact O-N 3.3Å
270	T	26.1	Very low	26.6	Very low	105 Å²	105	127.3 Å²	127.3	64%	0.644	71%	0.71	S	S	*	*			trans	-108.2	121.4	166.8	45.4	0	0	0	0	110.7	I268	I268-T270 HydrophobicContact CG2-CG2 4.25Å; I268-T270 PolarHBondContact O-N 3.26Å
271	N	26.5	Very low	26.3	Very low	141 Å²	141	126.6 Å²	126.6	75%	0.754	71%	0.711	S	S	*	*			trans	72.9	102.8	160.1	-45.2	-12.8	0	0	0	114.1
272	T	28.2	Very low	26	Very low	118 Å²	118	126.2 Å²	126.2	72%	0.724	71%	0.714	S	S	*	*				54.9	115.7	76.2	70.1	0	0	0	0	113.6
273	T	25.4	Very low	25.8	Very low	116 Å²	116	127 Å²	127	71%	0.712	72%	0.719	S	S	*	*			trans	36	111.7	142.9	55.7	0	0	0	0	116.4
274	D	28.3	Very low	25.7	Very low	156 Å²	156	128.8 Å²	128.8	83%	0.834	72%	0.722	S	S	*	*				-164.5	-167.8	63.8	-102	-36.3	0	0	0	115.1
275	S	25.2	Very low	25.7	Very low	91 Å²	91	124.4 Å²	124.4	64%	0.636	72%	0.716	S	S	*	*			trans	-93.1	154.2	-158.7	50.6	0	0	0	0	116.9
276	T	24.5	Very low	25.6	Very low	121 Å²	121	128.4 Å²	128.4	74%	0.742	73%	0.729	S	S	*	*			trans	77.3	139.4	145.5	41.1	0	0	0	0	123.3
277	T	24.3	Very low	25.6	Very low	129 Å²	129	128.9 Å²	128.9	79%	0.791	73%	0.727	S	S	*	*			trans	86.8	148.7	148.9	43	0	0	0	0	122.9
278	T	25.9	Very low	25.6	Very low	121 Å²	121	128.7 Å²	128.7	74%	0.742	73%	0.726	S	S	*	*			trans	66.4	76.8	164.3	45.3	0	0	0	0	120.5
279	T	23.7	Very low	25.6	Very low	122 Å²	122	126.4 Å²	126.4	75%	0.748	72%	0.715	S	S	*	*				51.4	147.8	116.2	52.4	0	0	0	0	123.3
280	T	23.9	Very low	26	Very low	126 Å²	126	121.3 Å²	121.3	77%	0.773	69%	0.687	S	S	*	*			trans	75.9	127.9	162.2	39.2	0	0	0	0	119.6
281	T	23.2	Very low	26.4	Very low	124 Å²	124	120 Å²	120	76%	0.761	68%	0.676	S	S	*	*			trans	53.5	79.1	156	54.2	0	0	0	0	118.8
282	N	26	Very low	26.9	Very low	148 Å²	148	116.8 Å²	116.8	79%	0.791	66%	0.663	S	S	*	*			trans	-153.8	117	130.1	-86.2	-38.3	0	0	0	106.4
283	N	24.9	Very low	27.5	Very low	106 Å²	106	116 Å²	116	57%	0.567	65%	0.653	S	S	*	*				74.9	68.9	73.1	-73.8	-2.8	0	0	0	114.6	D285	N283-D285 PolarHBondContact O-N 3.4Å; N283-D285 VanDerWaalsContact O-N 3.08Å
284	I	24.9	Very low	28	Very low	138 Å²	138	113.7 Å²	113.7	71%	0.708	64%	0.639	S	S	*	*			trans	42.8	54.3	140.4	-37	179.9	0	0	0	116.5	H286	I284-H286 HydrophobicContact CG2-CB 4.08Å; I284-H286 PolarHBondContact O-N 3.11Å
285	D	26.8	Very low	28.6	Very low	146 Å²	146	108.6 Å²	108.6	78%	0.781	61%	0.611	S	S	*	*			trans	-72.7	70.1	160.6	-68	-41.3	0	0	0	109.9	N283 D287	N283-D285 PolarHBondContact O-N 3.4Å; N283-D285 VanDerWaalsContact O-N 3.08Å; D285-D287 PolarHBondContact O-N 2.92Å
286	H	25.8	Very low	29.3	Very low	168 Å²	168	108.5 Å²	108.5	78%	0.778	60%	0.603	S	S	*	*			trans	-89.6	40.3	176.2	-105.1	-18.1	0	0	0	112.1	I284	I284-H286 HydrophobicContact CG2-CB 4.08Å; I284-H286 PolarHBondContact O-N 3.11Å
287	D	26.2	Very low	30.1	Very low	124 Å²	124	106.7 Å²	106.7	66%	0.663	59%	0.589	S	S	*	*			trans	-97.4	123.8	-163.3	-93.7	-2	0	0	0	115.4	D285 N289	D285-D287 PolarHBondContact O-N 2.92Å; D287-N289 PolarHBondContact O-N 3.32Å
288	I	26.3	Very low	31	Very low	113 Å²	113	101.9 Å²	101.9	58%	0.579	56%	0.558	S	S	*	*				44.6	73.4	124.1	-44.6	169.2	0	0	0	115.4
289	N	27.7	Very low	31.6	Very low	81 Å²	81	99.5 Å²	99.5	43%	0.433	54%	0.541	S	S	.	.			trans	-157.4	134.2	136.8	-113.1	-34.2	0	0	0	113	I267 D287 N291	I267-N289 WeakPolarHBondContact CD1-ND2 3.44Å; D287-N289 PolarHBondContact O-N 3.32Å; N289-N291 PolarHBondContact O-N 3.22Å; N289-N291 VanDerWaalsContact O-N 3.13Å
290	M	32.4	Very low	32.6	Very low	54 Å²	54	97.5 Å²	97.5	27%	0.266	53%	0.526	S	S	.	.			trans	-71.6	102	156.5	-73.8	-73	-83.1	0	0	105.7	P292 I295 L327	M290-P292 VanDerWaalsContact O-N 3.17Å; M290-I295 HydrophobicContact CB-CD1 4.31Å; M290-L327 HydrophobicContact CE-CD2 3.96Å
291	N	35.5	Very low	33.6	Very low	76 Å²	76	96.5 Å²	96.5	41%	0.406	51%	0.513	S	S	.	.			trans	-51.5	122.2	-168.5	-175	-10.5	0	0	0	110.2	N289 I293 T294 I295	N289-N291 PolarHBondContact O-N 3.22Å; N289-N291 VanDerWaalsContact O-N 3.13Å; N291-I293 PolarHBondContact O-N 3.03Å; N291-I293 VanDerWaalsContact O-N 3.11Å; N291-I293 WeakPolarHBondContact OD1-CB 3.23Å; N291-I293 WeakPolarHBondContact OD1-CG1 3.33Å; N291-I293 PolarHBondContact OD1-N 3.06Å; N291-T294 PolarHBondContact O-N 3.43Å; N291-T294 PolarHBondContact O-OG1 2.96Å; N291-I295 PolarHBondContact O-N 3.34Å
292	P	35.8	Very low	34.5	Very low	74 Å²	74	92.5 Å²	92.5	48%	0.481	49%	0.486	S	S	.	.	H	α-helix	trans	-56	-33.2	-177.3	19.8	-32.1	0	0	0	111.7	M290 T294 I295 D296	M290-P292 VanDerWaalsContact O-N 3.17Å; P292-T294 VanDerWaalsContact C-N 3.26Å; P292-T294 PolarHBondContact O-N 3.39Å; P292-I295 CarbonylContact O-C 3.49Å; P292-I295 WeakPolarHBondContact O-CA 3.11Å; P292-I295 PolarHBondContact O-N 3.47Å; P292-D296 PolarHBondContact O-N 3.46Å
293	I	40.7	Very low	35.2	Very low	103 Å²	103	91.1 Å²	91.1	53%	0.528	48%	0.478	S	S	.	.	H	α-helix	trans	-54	-40.3	172.6	-58.7	170.4	0	0	0	111.8	N291 N297	N291-I293 PolarHBondContact O-N 3.03Å; N291-I293 VanDerWaalsContact O-N 3.11Å; N291-I293 WeakPolarHBondContact OD1-CB 3.23Å; N291-I293 WeakPolarHBondContact OD1-CG1 3.33Å; N291-I293 PolarHBondContact OD1-N 3.06Å; I293-N297 WeakPolarHBondContact O-CB 3.39Å; I293-N297 PolarHBondContact O-N 3.45Å; I293-N297 PolarHBondContact O-ND2 3.01Å; I293-N297 PolarHBondContact O-OD1 2.9Å
294	T	36.8	Very low	36	Very low	66 Å²	66	92.5 Å²	92.5	41%	0.405	48%	0.481	S	S	.	.	H	α-helix	trans	-73.2	-24.8	175.9	39.1	0	0	0	0	114	N291 P292 L298	N291-T294 PolarHBondContact O-N 3.43Å; N291-T294 PolarHBondContact O-OG1 2.96Å; P292-T294 VanDerWaalsContact C-N 3.26Å; P292-T294 PolarHBondContact O-N 3.39Å; T294-L298 WeakPolarHBondContact O-CB 3.4Å; T294-L298 VanDerWaalsContact O-CD1 3.31Å; T294-L298 WeakPolarHBondContact O-CD1 3.37Å; T294-L298 PolarHBondContact O-N 2.88Å
295	I	39.8	Very low	36.8	Very low	50 Å²	50	87 Å²	87	26%	0.256	45%	0.454	S	S	.	.	H	α-helix	trans	-80.1	-41.8	175	-67.1	170.4	0	0	0	110.3	M290 N291 P292 L298 N299	M290-I295 HydrophobicContact CB-CD1 4.31Å; N291-I295 PolarHBondContact O-N 3.34Å; P292-I295 CarbonylContact O-C 3.49Å; P292-I295 WeakPolarHBondContact O-CA 3.11Å; P292-I295 PolarHBondContact O-N 3.47Å; I295-L298 PolarHBondContact O-N 3.18Å; I295-N299 PolarHBondContact O-N 2.85Å; I295-N299 PolarHBondContact O-ND2 3.44Å
296	D	40.3	Very low	37.3	Very low	88 Å²	88	86.6 Å²	86.6	47%	0.471	45%	0.452	S	S	.	.	H	α-helix	trans	-69.4	-38.9	177.3	-66.8	-32	0	0	0	111.5	P292 L298 N299 N300	P292-D296 PolarHBondContact O-N 3.46Å; D296-L298 VanDerWaalsContact C-N 3.34Å; D296-L298 PolarHBondContact O-N 3.47Å; D296-N299 PolarHBondContact O-N 2.98Å; D296-N300 WeakPolarHBondContact O-CB 3.45Å; D296-N300 PolarHBondContact O-N 3.4Å; D296-N300 PolarHBondContact O-ND2 2.81Å
297	N	40.8	Very low	38.1	Very low	84 Å²	84	80.7 Å²	80.7	45%	0.449	43%	0.426	S	S	.	.	H	α-helix	trans	-61.3	-41.3	169.5	-72.6	-3	0	0	0	111.7	I293 N300 E301	I293-N297 WeakPolarHBondContact O-CB 3.39Å; I293-N297 PolarHBondContact O-N 3.45Å; I293-N297 PolarHBondContact O-ND2 3.01Å; I293-N297 PolarHBondContact O-OD1 2.9Å; N297-N300 PolarHBondContact O-N 2.85Å; N297-E301 WeakPolarHBondContact O-CB 3.36Å; N297-E301 WeakPolarHBondContact O-CG 3.23Å; N297-E301 PolarHBondContact O-N 3.32Å
298	L	43	Very low	38.7	Very low	27 Å²	27	81.6 Å²	81.6	14%	0.141	43%	0.426	C	S	.	.	H	α-helix	trans	-66.4	-39.2	176	-114.7	122.3	0	0	0	113	T294 I295 D296 E301 L302 I323 L327	T294-L298 WeakPolarHBondContact O-CB 3.4Å; T294-L298 VanDerWaalsContact O-CD1 3.31Å; T294-L298 WeakPolarHBondContact O-CD1 3.37Å; T294-L298 PolarHBondContact O-N 2.88Å; I295-L298 PolarHBondContact O-N 3.18Å; D296-L298 VanDerWaalsContact C-N 3.34Å; D296-L298 PolarHBondContact O-N 3.47Å; L298-E301 PolarHBondContact O-N 3.4Å; L298-L302 HydrophobicContact CD2-CD1 3.96Å; L298-L302 VanDerWaalsContact O-CB 3.25Å; L298-L302 WeakPolarHBondContact O-CB 3.47Å; L298-L302 PolarHBondContact O-N 2.89Å; L298-I323 HydrophobicContact CD1-CG2 3.66Å; L298-I323 HydrophobicContact CD2-CG2 3.8Å; L298-I323 HydrophobicContact CG-CG2 3.69Å; L298-L327 HydrophobicContact CD1-CD1 3.64Å; L298-L327 HydrophobicContact CD1-CD2 3.85Å; L298-L327 HydrophobicContact CD1-CG 3.86Å; L298-L327 HydrophobicContact CD2-CD1 3.53Å; L298-L327 HydrophobicContact CD2-CG 4.48Å; L298-L327 HydrophobicContact CG-CD1 4.21Å
299	N	40.1	Very low	39.1	Very low	71 Å²	71	84.9 Å²	84.9	38%	0.38	44%	0.439	S	S	.	.	H	α-helix	trans	-63.8	-45.2	173.6	-78.7	-36.9	0	0	0	110	I295 D296 E301 L302 I303	I295-N299 PolarHBondContact O-N 2.85Å; I295-N299 PolarHBondContact O-ND2 3.44Å; D296-N299 PolarHBondContact O-N 2.98Å; N299-E301 PolarHBondContact O-N 2.83Å; N299-L302 PolarHBondContact O-N 3.46Å; N299-I303 HydrophobicContact CB-CD1 4.32Å; N299-I303 WeakPolarHBondContact O-CB 3.18Å; N299-I303 WeakPolarHBondContact O-CD1 3.47Å; N299-I303 WeakPolarHBondContact O-CG1 3.25Å; N299-I303 PolarHBondContact O-N 3.31Å
300	N	44.5	Very low	39.3	Very low	80 Å²	80	86.7 Å²	86.7	43%	0.428	45%	0.449	S	S	.	.	H	α-helix	trans	-60.2	-46.1	175.5	-70.1	-27.4	0	0	0	111.1	D296 N297 L302 I303 H304	D296-N300 WeakPolarHBondContact O-CB 3.45Å; D296-N300 PolarHBondContact O-N 3.4Å; D296-N300 PolarHBondContact O-ND2 2.81Å; N297-N300 PolarHBondContact O-N 2.85Å; N300-L302 PolarHBondContact O-N 3.31Å; N300-I303 PolarHBondContact O-N 3.46Å; N300-H304 WeakPolarHBondContact O-CA 3.14Å; N300-H304 WeakPolarHBondContact O-CB 3.37Å; N300-H304 PolarHBondContact O-N 3Å; N300-H304 PolarHBondContact O-ND1 3.5Å
301	E	43.4	Very low	39.6	Very low	105 Å²	105	86.3 Å²	86.3	49%	0.491	45%	0.451	S	S	.	.	H	α-helix	trans	-66.6	-35.8	176.9	-73.6	176.4	-179.4	0	0	113.1	N297 L298 N299 S305 I323	N297-E301 WeakPolarHBondContact O-CB 3.36Å; N297-E301 WeakPolarHBondContact O-CG 3.23Å; N297-E301 PolarHBondContact O-N 3.32Å; L298-E301 PolarHBondContact O-N 3.4Å; N299-E301 PolarHBondContact O-N 2.83Å; E301-S305 WeakPolarHBondContact O-CB 3.28Å; E301-S305 PolarHBondContact O-N 2.84Å; E301-S305 PolarHBondContact O-OG 3.14Å; E301-I323 VanDerWaalsContact OE2-CD1 3.28Å; E301-I323 WeakPolarHBondContact OE2-CD1 3.45Å
302	L	43.8	Very low	39.7	Very low	40 Å²	40	88.7 Å²	88.7	21%	0.209	46%	0.46	C	S	.	.	H	α-helix	trans	-78.2	-14.9	174.9	-84.4	161.6	0	0	0	114.7	L298 N299 N300 S305 I320	L298-L302 HydrophobicContact CD2-CD1 3.96Å; L298-L302 VanDerWaalsContact O-CB 3.25Å; L298-L302 WeakPolarHBondContact O-CB 3.47Å; L298-L302 PolarHBondContact O-N 2.89Å; N299-L302 PolarHBondContact O-N 3.46Å; N300-L302 PolarHBondContact O-N 3.31Å; L302-S305 PolarHBondContact O-OG 2.81Å; L302-I320 HydrophobicContact CD2-CG2 3.77Å
303	I	40.9	Very low	40.1	Very low	119 Å²	119	90.2 Å²	90.2	61%	0.61	46%	0.464	S	S	*	.	H	α-helix	trans	-100.9	-33.5	177.4	-67.8	166.5	0	0	0	110.4	N299 N300	N299-I303 HydrophobicContact CB-CD1 4.32Å; N299-I303 WeakPolarHBondContact O-CB 3.18Å; N299-I303 WeakPolarHBondContact O-CD1 3.47Å; N299-I303 WeakPolarHBondContact O-CG1 3.25Å; N299-I303 PolarHBondContact O-N 3.31Å; N300-I303 PolarHBondContact O-N 3.46Å
304	H	39.9	Very low	40.4	Very low	136 Å²	136	88.7 Å²	88.7	63%	0.63	46%	0.456	S	S	*	.	H	α-helix	trans	-88.9	-10.2	175.6	-61.8	23.6	0	0	0	112.2	N300 N306	N300-H304 WeakPolarHBondContact O-CA 3.14Å; N300-H304 WeakPolarHBondContact O-CB 3.37Å; N300-H304 PolarHBondContact O-N 3Å; N300-H304 PolarHBondContact O-ND1 3.5Å; H304-N306 PolarHBondContact O-N 3.35Å
305	S	41.8	Very low	40.6	Very low	22 Å²	22	91.9 Å²	91.9	15%	0.154	46%	0.462	C	S	.	.	S	Bend	trans	-64.3	88.3	159.7	63	0	0	0	0	109.3	E301 L302 L307	E301-S305 WeakPolarHBondContact O-CB 3.28Å; E301-S305 PolarHBondContact O-N 2.84Å; E301-S305 PolarHBondContact O-OG 3.14Å; L302-S305 PolarHBondContact O-OG 2.81Å; S305-L307 PolarHBondContact O-N 2.86Å
306	N	37.4	Very low	40.8	Very low	137 Å²	137	92.3 Å²	92.3	73%	0.733	47%	0.469	S	S	*	.			trans	-62.5	83.7	166	-80.4	-20.9	0	0	0	108.9	H304 E308	H304-N306 PolarHBondContact O-N 3.35Å; N306-E308 PolarHBondContact O-N 2.74Å
307	L	43.4	Very low	41.2	Very low	44 Å²	44	88.9 Å²	88.9	23%	0.23	45%	0.451	C	S	.	.			trans	-67.6	75.7	162.7	-83.8	151.4	0	0	0	107.7	I250 S305 N317	I250-L307 HydrophobicContact CD1-CD1 3.62Å; S305-L307 PolarHBondContact O-N 2.86Å; L307-N317 VanDerWaalsContact CD2-OD1 3.28Å; L307-N317 WeakPolarHBondContact CD2-OD1 3.26Å
308	E	37.8	Very low	41.5	Very low	144 Å²	144	86.5 Å²	86.5	67%	0.673	44%	0.438	S	S	*	.			trans	-47.7	144.5	166.3	-65.1	-169.8	150.3	0	0	109.3	N306 N310	N306-E308 PolarHBondContact O-N 2.74Å; E308-N310 PolarHBondContact O-N 2.82Å
309	H	35.4	Very low	41.7	Very low	181 Å²	181	89.8 Å²	89.8	84%	0.838	45%	0.452	S	S	*	.	S	Bend	trans	-65	1.1	-174.7	-76.4	11.4	0	0	0	114.9	S311	H309-S311 PolarHBondContact O-N 3.01Å
310	N	32.7	Very low	42	Very low	120 Å²	120	87.2 Å²	87.2	64%	0.642	44%	0.439	S	S	*	.			trans	-76.8	105.7	168.6	-62.9	-40.4	0	0	0	109.4	E308 Q312	E308-N310 PolarHBondContact O-N 2.82Å; N310-Q312 PolarHBondContact O-N 3.31Å
311	S	37.9	Very low	42.2	Very low	46 Å²	46	86.3 Å²	86.3	32%	0.322	43%	0.433	S	S	.	.			trans	-68.9	22.9	-174	51.4	0	0	0	0	116	I241 H309	I241-S311 WeakPolarHBondContact CG2-O 3.39Å; I241-S311 VanDerWaalsContact CG2-OG 3.26Å; I241-S311 WeakPolarHBondContact CG2-OG 3.47Å; I241-S311 WeakPolarHBondContact O-CB 3.31Å; I241-S311 PolarHBondContact O-OG 2.77Å; H309-S311 PolarHBondContact O-N 3.01Å
312	Q	38.5	Very low	42.3	Very low	125 Å²	125	83.2 Å²	83.2	58%	0.584	42%	0.42	S	S	*	.			trans	-72.4	141.2	175.2	-101.9	-177.2	-8.1	0	0	112.5	N310 N314 N317	N310-Q312 PolarHBondContact O-N 3.31Å; Q312-N314 PolarHBondContact O-N 3.17Å; Q312-N317 PolarHBondContact O-ND2 3.27Å
313	L	42.8	Very low	42.6	Very low	107 Å²	107	83 Å²	83	56%	0.56	42%	0.418	S	S	*	.			trans	-84.2	80.7	-180	-154.2	149.4	0	0	0	109.6	I318	L313-I318 HydrophobicContact CD2-CD1 3.95Å; L313-I318 HydrophobicContact CD2-CG1 3.49Å; L313-I318 VanDerWaalsContact CD2-CG1 3.49Å
314	N	46.5	Very low	42.9	Very low	71 Å²	71	78.4 Å²	78.4	38%	0.38	40%	0.395	S	S	.	.			trans	-75.6	177.3	-179.9	72	19.4	0	0	0	112.8	Q312 S316 N317 I318	Q312-N314 PolarHBondContact O-N 3.17Å; N314-S316 WeakPolarHBondContact OD1-CB 3.48Å; N314-S316 PolarHBondContact OD1-N 2.93Å; N314-N317 PolarHBondContact O-N 3.3Å; N314-N317 WeakPolarHBondContact OD1-CB 3.34Å; N314-N317 PolarHBondContact OD1-N 2.95Å; N314-N317 PolarHBondContact OD1-ND2 3.29Å; N314-N317 PolarHBondContact OD1-OD1 2.06Å; N314-I318 PolarHBondContact O-N 3.23Å
315	Y	42	Very low	43.1	Very low	132 Å²	132	75.5 Å²	75.5	52%	0.518	38%	0.384	S	S	.	.	H	α-helix	trans	-61.4	-44.7	-178.6	-171.8	-85.1	0	0	0	112.2	N317 I318 E319 Y393	Y315-N317 VanDerWaalsContact C-N 3.28Å; Y315-N317 PolarHBondContact O-N 3.39Å; Y315-I318 WeakPolarHBondContact O-CA 3.42Å; Y315-I318 WeakPolarHBondContact O-CB 3.42Å; Y315-I318 PolarHBondContact O-N 3.26Å; Y315-E319 PolarHBondContact O-N 3.18Å; Y315-Y393 PolarHBondContact OH-OH 2.95Å; Y315-Y393 VanDerWaalsContact OH-OH 3.07Å
316	S	44.3	Very low	43.2	Very low	59 Å²	59	80.5 Å²	80.5	41%	0.413	41%	0.405	S	S	.	.	H	α-helix	trans	-57.4	-39.2	177.3	-40.3	0	0	0	0	112.3	N314 I318 E319 I320	N314-S316 WeakPolarHBondContact OD1-CB 3.48Å; N314-S316 PolarHBondContact OD1-N 2.93Å; S316-I318 VanDerWaalsContact C-N 3.27Å; S316-I318 PolarHBondContact O-N 3.16Å; S316-E319 WeakPolarHBondContact O-CB 3.27Å; S316-E319 PolarHBondContact O-N 2.79Å; S316-E319 VanDerWaalsContact O-N 3.17Å; S316-I320 WeakPolarHBondContact O-CD1 3.17Å; S316-I320 VanDerWaalsContact O-CG1 3.27Å; S316-I320 WeakPolarHBondContact O-CG1 3.43Å; S316-I320 PolarHBondContact O-N 2.83Å
317	N	48.4	Very low	43.5	Very low	17 Å²	17	76.5 Å²	76.5	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-66.3	-28.1	176.9	-67.3	-14.2	0	0	0	112.5	L307 Q312 N314 Y315 M321	L307-N317 VanDerWaalsContact CD2-OD1 3.28Å; L307-N317 WeakPolarHBondContact CD2-OD1 3.26Å; Q312-N317 PolarHBondContact O-ND2 3.27Å; N314-N317 PolarHBondContact O-N 3.3Å; N314-N317 WeakPolarHBondContact OD1-CB 3.34Å; N314-N317 PolarHBondContact OD1-N 2.95Å; N314-N317 PolarHBondContact OD1-ND2 3.29Å; N314-N317 PolarHBondContact OD1-OD1 2.06Å; Y315-N317 VanDerWaalsContact C-N 3.28Å; Y315-N317 PolarHBondContact O-N 3.39Å; N317-M321 WeakPolarHBondContact O-CG 3.37Å; N317-M321 PolarHBondContact O-N 3.33Å
318	I	47.3	Very low	43.4	Very low	34 Å²	34	77.4 Å²	77.4	17%	0.174	39%	0.388	C	S	.	.	H	α-helix	trans	-77	-39	172.2	-60.8	172.1	0	0	0	110.4	L313 N314 Y315 S316 M321 N322	L313-I318 HydrophobicContact CD2-CD1 3.95Å; L313-I318 HydrophobicContact CD2-CG1 3.49Å; L313-I318 VanDerWaalsContact CD2-CG1 3.49Å; N314-I318 PolarHBondContact O-N 3.23Å; Y315-I318 WeakPolarHBondContact O-CA 3.42Å; Y315-I318 WeakPolarHBondContact O-CB 3.42Å; Y315-I318 PolarHBondContact O-N 3.26Å; S316-I318 VanDerWaalsContact C-N 3.27Å; S316-I318 PolarHBondContact O-N 3.16Å; I318-M321 PolarHBondContact O-N 3.48Å; I318-N322 PolarHBondContact O-N 3.26Å
319	E	46.4	Very low	43.5	Very low	95 Å²	95	74.2 Å²	74.2	44%	0.444	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-49.1	178.9	-164.5	144.9	-124.8	0	0	111.7	Y315 S316 M321 N322 I323	Y315-E319 PolarHBondContact O-N 3.18Å; S316-E319 WeakPolarHBondContact O-CB 3.27Å; S316-E319 PolarHBondContact O-N 2.79Å; S316-E319 VanDerWaalsContact O-N 3.17Å; E319-M321 VanDerWaalsContact C-N 3.29Å; E319-M321 PolarHBondContact O-N 3.34Å; E319-N322 WeakPolarHBondContact O-CA 3.35Å; E319-N322 WeakPolarHBondContact O-CB 3.36Å; E319-N322 PolarHBondContact O-N 2.82Å; E319-I323 HydrophobicContact CG-CD1 4.17Å; E319-I323 WeakPolarHBondContact O-CD1 3.47Å; E319-I323 VanDerWaalsContact O-CG1 3.31Å; E319-I323 WeakPolarHBondContact O-CG1 3.35Å; E319-I323 PolarHBondContact O-N 2.8Å
320	I	47.2	Very low	43.5	Very low	17 Å²	17	68 Å²	68	9%	0.087	35%	0.351	C	S	.	.	H	α-helix	trans	-54.4	-45	172.6	-66.2	161.1	0	0	0	111.1	L302 S316 N322 I323 I324	L302-I320 HydrophobicContact CD2-CG2 3.77Å; S316-I320 WeakPolarHBondContact O-CD1 3.17Å; S316-I320 VanDerWaalsContact O-CG1 3.27Å; S316-I320 WeakPolarHBondContact O-CG1 3.43Å; S316-I320 PolarHBondContact O-N 2.83Å; I320-N322 VanDerWaalsContact C-N 3.34Å; I320-N322 PolarHBondContact O-N 2.84Å; I320-I323 PolarHBondContact O-N 3.13Å; I320-I324 HydrophobicContact CG2-CD1 3.77Å; I320-I324 HydrophobicContact CG2-CG1 4.48Å; I320-I324 VanDerWaalsContact O-CG1 3.31Å; I320-I324 WeakPolarHBondContact O-CG1 3.26Å; I320-I324 PolarHBondContact O-N 2.91Å
321	M	48.9	Very low	43.5	Very low	62 Å²	62	64.8 Å²	64.8	31%	0.305	34%	0.338	S	S	.	.	H	α-helix	trans	-66	-34.1	177.8	-73.7	-68.5	-68.3	0	0	112.7	F249 L253 N317 I318 E319 N325 I375	F249-M321 HydrophobicContact CE1-CE 4.44Å; F249-M321 HydrophobicContact CE1-SD 4.28Å; L253-M321 HydrophobicContact CD1-SD 4.38Å; N317-M321 WeakPolarHBondContact O-CG 3.37Å; N317-M321 PolarHBondContact O-N 3.33Å; I318-M321 PolarHBondContact O-N 3.48Å; E319-M321 VanDerWaalsContact C-N 3.29Å; E319-M321 PolarHBondContact O-N 3.34Å; M321-N325 VanDerWaalsContact O-CB 3.25Å; M321-N325 WeakPolarHBondContact O-CB 3.37Å; M321-N325 PolarHBondContact O-N 3.13Å; M321-I375 HydrophobicContact CE-CD1 3.5Å; M321-I375 VanDerWaalsContact CE-CD1 3.5Å
322	N	46.2	Very low	43.3	Very low	40 Å²	40	65.1 Å²	65.1	21%	0.214	34%	0.336	C	S	.	.	H	α-helix	trans	-68.6	-39.9	172.6	-83.6	-34.2	0	0	0	112.1	I318 E319 I320 N325 Q326	I318-N322 PolarHBondContact O-N 3.26Å; E319-N322 WeakPolarHBondContact O-CA 3.35Å; E319-N322 WeakPolarHBondContact O-CB 3.36Å; E319-N322 PolarHBondContact O-N 2.82Å; I320-N322 VanDerWaalsContact C-N 3.34Å; I320-N322 PolarHBondContact O-N 2.84Å; N322-N325 PolarHBondContact O-N 3.15Å; N322-Q326 WeakPolarHBondContact O-CG 3.14Å; N322-Q326 PolarHBondContact O-N 2.89Å
323	I	48	Very low	43	Very low	35 Å²	35	65.6 Å²	65.6	18%	0.179	34%	0.336	C	S	.	.	H	α-helix	trans	-66.9	-46.1	177.9	-63	156	0	0	0	110.5	L298 E301 E319 I320 N325 Q326 L327	L298-I323 HydrophobicContact CD1-CG2 3.66Å; L298-I323 HydrophobicContact CD2-CG2 3.8Å; L298-I323 HydrophobicContact CG-CG2 3.69Å; E301-I323 VanDerWaalsContact OE2-CD1 3.28Å; E301-I323 WeakPolarHBondContact OE2-CD1 3.45Å; E319-I323 HydrophobicContact CG-CD1 4.17Å; E319-I323 WeakPolarHBondContact O-CD1 3.47Å; E319-I323 VanDerWaalsContact O-CG1 3.31Å; E319-I323 WeakPolarHBondContact O-CG1 3.35Å; E319-I323 PolarHBondContact O-N 2.8Å; I320-I323 PolarHBondContact O-N 3.13Å; I323-N325 VanDerWaalsContact C-N 3.29Å; I323-N325 PolarHBondContact O-N 3.26Å; I323-Q326 PolarHBondContact O-N 3.39Å; I323-Q326 VanDerWaalsContact O-N 3.13Å; I323-L327 PolarHBondContact O-N 3.35Å
324	I	48.1	Very low	42.5	Very low	23 Å²	23	64.3 Å²	64.3	12%	0.118	33%	0.33	C	S	.	.	H	α-helix	trans	-58.2	-41.2	174.1	-69.4	167.3	0	0	0	111.2	I257 I320 L327 L328	I257-I324 HydrophobicContact CD1-CG2 4.03Å; I320-I324 HydrophobicContact CG2-CD1 3.77Å; I320-I324 HydrophobicContact CG2-CG1 4.48Å; I320-I324 VanDerWaalsContact O-CG1 3.31Å; I320-I324 WeakPolarHBondContact O-CG1 3.26Å; I320-I324 PolarHBondContact O-N 2.91Å; I324-L327 PolarHBondContact O-N 3.07Å; I324-L328 HydrophobicContact CG2-CD1 4.47Å; I324-L328 PolarHBondContact O-N 2.92Å
325	N	44.5	Very low	41.8	Very low	75 Å²	75	65.2 Å²	65.2	40%	0.401	34%	0.335	S	S	.	.	H	α-helix	trans	-67.5	-37.5	176.6	-171.8	30.9	0	0	0	112.1	M321 N322 I323 L328 I329	M321-N325 VanDerWaalsContact O-CB 3.25Å; M321-N325 WeakPolarHBondContact O-CB 3.37Å; M321-N325 PolarHBondContact O-N 3.13Å; N322-N325 PolarHBondContact O-N 3.15Å; I323-N325 VanDerWaalsContact C-N 3.29Å; I323-N325 PolarHBondContact O-N 3.26Å; N325-L328 PolarHBondContact O-N 2.98Å; N325-I329 WeakPolarHBondContact O-CD1 3.46Å; N325-I329 VanDerWaalsContact O-CG1 3.29Å; N325-I329 WeakPolarHBondContact O-CG1 3.3Å; N325-I329 PolarHBondContact O-N 3.37Å
326	Q	44.1	Very low	41.2	Very low	127 Å²	127	61.7 Å²	61.7	59%	0.593	33%	0.325	S	S	*	.	H	α-helix	trans	-65	-44.3	173.2	-76.4	-176.7	74.8	0	0	112.1	N322 I323 L328 I329 S330	N322-Q326 WeakPolarHBondContact O-CG 3.14Å; N322-Q326 PolarHBondContact O-N 2.89Å; I323-Q326 PolarHBondContact O-N 3.39Å; I323-Q326 VanDerWaalsContact O-N 3.13Å; Q326-L328 PolarHBondContact O-N 3.32Å; Q326-I329 PolarHBondContact O-N 3.33Å; Q326-S330 PolarHBondContact O-N 3.5Å; Q326-S330 PolarHBondContact O-OG 3.49Å
327	L	42.7	Very low	40.6	Very low	52 Å²	52	65.2 Å²	65.2	27%	0.272	33%	0.334	S	S	.	.	H	α-helix	trans	-56.1	-49.3	172.7	-76.6	-177.7	0	0	0	111.8	M290 L298 I323 I324 I329 S330 S331	M290-L327 HydrophobicContact CE-CD2 3.96Å; L298-L327 HydrophobicContact CD1-CD1 3.64Å; L298-L327 HydrophobicContact CD1-CD2 3.85Å; L298-L327 HydrophobicContact CD1-CG 3.86Å; L298-L327 HydrophobicContact CD2-CD1 3.53Å; L298-L327 HydrophobicContact CD2-CG 4.48Å; L298-L327 HydrophobicContact CG-CD1 4.21Å; I323-L327 PolarHBondContact O-N 3.35Å; I324-L327 PolarHBondContact O-N 3.07Å; L327-I329 VanDerWaalsContact C-N 3.28Å; L327-I329 PolarHBondContact O-N 3.1Å; L327-S330 PolarHBondContact O-N 3.48Å; L327-S331 PolarHBondContact O-N 3.05Å; L327-S331 PolarHBondContact O-OG 3.38Å
328	L	41.1	Very low	39.9	Very low	64 Å²	64	68.8 Å²	68.8	34%	0.335	35%	0.353	S	S	.	.	H	α-helix	trans	-55.9	-41.9	177.3	-103.2	158.7	0	0	0	112.2	I324 N325 Q326 I332	I324-L328 HydrophobicContact CG2-CD1 4.47Å; I324-L328 PolarHBondContact O-N 2.92Å; N325-L328 PolarHBondContact O-N 2.98Å; Q326-L328 PolarHBondContact O-N 3.32Å; L328-I332 HydrophobicContact CD2-CD1 4.27Å; L328-I332 WeakPolarHBondContact O-CB 3.47Å; L328-I332 WeakPolarHBondContact O-CD1 3.1Å; L328-I332 WeakPolarHBondContact O-CG1 3.35Å; L328-I332 PolarHBondContact O-N 3.37Å
329	I	40.1	Very low	39.2	Very low	77 Å²	77	73.3 Å²	73.3	40%	0.395	38%	0.376	S	S	.	.	H	α-helix	trans	-68.4	-37.2	176.6	-69.4	164.8	0	0	0	111.7	N325 Q326 L327 K333	N325-I329 WeakPolarHBondContact O-CD1 3.46Å; N325-I329 VanDerWaalsContact O-CG1 3.29Å; N325-I329 WeakPolarHBondContact O-CG1 3.3Å; N325-I329 PolarHBondContact O-N 3.37Å; Q326-I329 PolarHBondContact O-N 3.33Å; L327-I329 VanDerWaalsContact C-N 3.28Å; L327-I329 PolarHBondContact O-N 3.1Å; I329-K333 HydrophobicContact CG2-CD 4.36Å; I329-K333 VanDerWaalsContact O-CG 3.32Å; I329-K333 WeakPolarHBondContact O-CG 3.18Å; I329-K333 PolarHBondContact O-N 3.13Å
330	S	35.5	Very low	38.4	Very low	50 Å²	50	74.6 Å²	74.6	35%	0.35	39%	0.385	S	S	.	.	H	α-helix	trans	-69.6	-47	178.7	-66.9	0	0	0	0	112.4	Q326 L327 I332 K333 N334	Q326-S330 PolarHBondContact O-N 3.5Å; Q326-S330 PolarHBondContact O-OG 3.49Å; L327-S330 PolarHBondContact O-N 3.48Å; S330-I332 VanDerWaalsContact C-N 3.34Å; S330-I332 PolarHBondContact O-N 3.08Å; S330-K333 WeakPolarHBondContact O-CB 3.13Å; S330-K333 PolarHBondContact O-N 3.21Å; S330-K333 VanDerWaalsContact O-N 3.09Å; S330-N334 PolarHBondContact O-N 3.47Å; S330-N334 VanDerWaalsContact O-N 3.1Å; S330-N334 PolarHBondContact O-OD1 3.36Å
331	S	33.4	Very low	37.6	Very low	52 Å²	52	78.6 Å²	78.6	36%	0.364	41%	0.407	S	S	.	.	H	α-helix	trans	-58.9	-45.4	176.4	-55.3	0	0	0	0	111.7	L327 K333 N334 D335	L327-S331 PolarHBondContact O-N 3.05Å; L327-S331 PolarHBondContact O-OG 3.38Å; S331-K333 PolarHBondContact O-N 2.86Å; S331-N334 PolarHBondContact O-N 3.43Å; S331-D335 PolarHBondContact O-N 2.86Å
332	I	32.7	Very low	36.7	Very low	54 Å²	54	84.5 Å²	84.5	28%	0.277	43%	0.434	S	S	.	.	H	α-helix	trans	-65.5	-24.1	178.5	-66.6	169.6	0	0	0	112.5	L328 S330 N336	L328-I332 HydrophobicContact CD2-CD1 4.27Å; L328-I332 WeakPolarHBondContact O-CB 3.47Å; L328-I332 WeakPolarHBondContact O-CD1 3.1Å; L328-I332 WeakPolarHBondContact O-CG1 3.35Å; L328-I332 PolarHBondContact O-N 3.37Å; S330-I332 VanDerWaalsContact C-N 3.34Å; S330-I332 PolarHBondContact O-N 3.08Å; I332-N336 PolarHBondContact O-ND2 3.42Å
333	K	32.5	Very low	35.9	Very low	134 Å²	134	91.2 Å²	91.2	58%	0.583	47%	0.466	S	S	*	.	H	α-helix	trans	-77.1	-42.7	173.5	-80.1	173.5	177	-179	0	112.4	I329 S330 S331 N336	I329-K333 HydrophobicContact CG2-CD 4.36Å; I329-K333 VanDerWaalsContact O-CG 3.32Å; I329-K333 WeakPolarHBondContact O-CG 3.18Å; I329-K333 PolarHBondContact O-N 3.13Å; S330-K333 WeakPolarHBondContact O-CB 3.13Å; S330-K333 PolarHBondContact O-N 3.21Å; S330-K333 VanDerWaalsContact O-N 3.09Å; S331-K333 PolarHBondContact O-N 2.86Å; K333-N336 PolarHBondContact O-N 3.46Å
334	N	32.4	Very low	34.9	Very low	80 Å²	80	96 Å²	96	43%	0.428	49%	0.491	S	S	.	.	H	α-helix	trans	-69.1	-39.2	-172.5	-68.5	0.4	0	0	0	111.9	S330 S331 N336 H337 I338	S330-N334 PolarHBondContact O-N 3.47Å; S330-N334 VanDerWaalsContact O-N 3.1Å; S330-N334 PolarHBondContact O-OD1 3.36Å; S331-N334 PolarHBondContact O-N 3.43Å; N334-N336 PolarHBondContact O-N 2.8Å; N334-H337 PolarHBondContact O-N 3.09Å; N334-I338 PolarHBondContact O-N 3.19Å
335	D	31.4	Very low	33.8	Very low	91 Å²	91	102.3 Å²	102.3	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-56.1	-25.2	174	-70.8	-10	0	0	0	113.4	S331 I339	S331-D335 PolarHBondContact O-N 2.86Å; D335-I339 WeakPolarHBondContact O-CD1 3.25Å
336	N	30.1	Very low	33	Very low	58 Å²	58	105.6 Å²	105.6	31%	0.31	54%	0.542	S	S	.	.	H	α-helix	trans	-86.2	-13.7	178.9	-83.3	-78.5	0	0	0	114.3	I332 K333 N334 N340 N368	I332-N336 PolarHBondContact O-ND2 3.42Å; K333-N336 PolarHBondContact O-N 3.46Å; N334-N336 PolarHBondContact O-N 2.8Å; N336-N340 PolarHBondContact O-ND2 2.78Å; N336-N368 PolarHBondContact ND2-OD1 3.34Å; N336-N368 PolarHBondContact OD1-ND2 3.36Å; N336-N368 PolarHBondContact OD1-OD1 3.01Å; N336-N368 VanDerWaalsContact OD1-OD1 3.09Å
337	H	32.1	Very low	32	Very low	133 Å²	133	106.7 Å²	106.7	62%	0.616	56%	0.558	S	S	*	*	H	α-helix	trans	-94.2	-34.9	179.5	-111.7	-74.4	0	0	0	113	N334 I339 N340	N334-H337 PolarHBondContact O-N 3.09Å; H337-I339 VanDerWaalsContact C-N 3.31Å; H337-I339 PolarHBondContact O-N 3.26Å; H337-N340 PolarHBondContact O-N 3.16Å
338	I	32.5	Very low	31.2	Very low	92 Å²	92	108.3 Å²	108.3	47%	0.472	58%	0.579	S	S	.	*	H	α-helix	trans	-61.9	-38.8	-178.6	-64.1	167.3	0	0	0	111.4	N334 N340	N334-I338 PolarHBondContact O-N 3.19Å; I338-N340 PolarHBondContact O-N 2.87Å; I338-N340 VanDerWaalsContact O-N 3.15Å
339	I	32.7	Very low	30.4	Very low	128 Å²	128	111.2 Å²	111.2	66%	0.656	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-16.3	-174.1	-62.2	173.9	0	0	0	113.6	D335 H337	D335-I339 WeakPolarHBondContact O-CD1 3.25Å; H337-I339 VanDerWaalsContact C-N 3.31Å; H337-I339 PolarHBondContact O-N 3.26Å
340	N	30.6	Very low	29.7	Very low	122 Å²	122	113.1 Å²	113.1	65%	0.652	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-7.7	-172.8	-68.1	-60	0	0	0	115.2	N336 H337 I338	N336-N340 PolarHBondContact O-ND2 2.78Å; H337-N340 PolarHBondContact O-N 3.16Å; I338-N340 PolarHBondContact O-N 2.87Å; I338-N340 VanDerWaalsContact O-N 3.15Å
341	N	29.8	Very low	29.3	Very low	101 Å²	101	116.4 Å²	116.4	54%	0.54	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.2	-18.6	-171.3	-80.3	11.6	0	0	0	115.3	M343	N341-M343 PolarHBondContact O-N 2.75Å
342	E	30.4	Very low	29	Very low	187 Å²	187	119.7 Å²	119.7	87%	0.874	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	3.3	-176.8	-72.1	-168	129.5	0	0	115.5
343	M	28.9	Very low	28.7	Very low	180 Å²	180	122.6 Å²	122.6	89%	0.887	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	10.4	-172.2	-142.9	177.9	-170.5	0	0	115.6	N341	N341-M343 PolarHBondContact O-N 2.75Å
344	I	26.6	Very low	28.4	Very low	136 Å²	136	123.7 Å²	123.7	70%	0.697	68%	0.684	S	S	*	*	S	Bend	trans	-135.3	98.6	179.7	-49.4	179.8	0	0	0	111.3
345	H	26.6	Very low	28.1	Very low	155 Å²	155	126.8 Å²	126.8	72%	0.718	70%	0.7	S	S	*	*			trans	144	90.4	147.1	-82.7	-69.6	0	0	0	113.3
346	T	26.3	Very low	28	Very low	144 Å²	144	130.2 Å²	130.2	88%	0.883	72%	0.719	S	S	*	*				-170.8	100.7	126.1	17	0	0	0	0	110.1	A348	T346-A348 PolarHBondContact O-N 3.15Å
347	T	23.6	Very low	27.8	Very low	150 Å²	150	133.9 Å²	133.9	92%	0.92	74%	0.738	S	S	*	*			trans	-87.2	98.8	169.4	41.2	0	0	0	0	109.8
348	A	25.5	Very low	27.7	Very low	87 Å²	87	134.7 Å²	134.7	72%	0.719	75%	0.747	S	S	*	*			trans	-142	132.6	164.7	0	0	0	0	0	111.3	T346	T346-A348 PolarHBondContact O-N 3.15Å
349	T	25	Very low	27.4	Very low	125 Å²	125	137.7 Å²	137.7	77%	0.767	76%	0.764	S	S	*	*			trans	-26.9	143.5	159.8	47.6	0	0	0	0	115.3
350	T	25.9	Very low	27.2	Very low	116 Å²	116	137.4 Å²	137.4	71%	0.712	76%	0.764	S	S	*	*			cis	-165.3	170.4	19.8	-5.7	0	0	0	0	113.8
351	T	26.8	Very low	26.9	Very low	119 Å²	119	139 Å²	139	73%	0.73	77%	0.773	S	S	*	*			trans	73	136.3	151.1	42.7	0	0	0	0	122.5
352	T	27.5	Very low	26.8	Very low	121 Å²	121	139.9 Å²	139.9	74%	0.742	78%	0.777	S	S	*	*			trans	64.5	82.4	150.7	49.1	0	0	0	0	121
353	T	25.2	Very low	26.7	Very low	116 Å²	116	137 Å²	137	71%	0.712	77%	0.768	S	S	*	*				30.7	116	118.9	56.9	0	0	0	0	119.6
354	N	27.5	Very low	26.6	Very low	156 Å²	156	134.6 Å²	134.6	83%	0.834	76%	0.758	S	S	*	*				-169.4	157.5	96.6	-106.2	-53.7	0	0	0	114.5
355	N	25.4	Very low	26.6	Very low	146 Å²	146	133.2 Å²	133.2	78%	0.781	75%	0.752	S	S	*	*			trans	-65.8	136.4	178.3	-68.5	-53.6	0	0	0	112.7
356	N	28.9	Very low	26.6	Very low	162 Å²	162	130.1 Å²	130.1	87%	0.866	75%	0.747	S	S	*	*			trans	-164.2	147.5	133.4	-108.5	-57.4	0	0	0	113.8
357	N	25.5	Very low	26.6	Very low	136 Å²	136	127.7 Å²	127.7	73%	0.727	73%	0.728	S	S	*	*			trans	-65.4	146.2	177.4	-63.3	-72.1	0	0	0	112.8
358	N	29.8	Very low	26.6	Very low	149 Å²	149	124.6 Å²	124.6	80%	0.797	71%	0.705	S	S	*	*			trans	-157.6	109.6	137.2	-92.8	-45.4	0	0	0	111.3	N360	N358-N360 PolarHBondContact O-N 3.23Å
359	N	26.1	Very low	26.7	Very low	155 Å²	155	127.8 Å²	127.8	83%	0.829	71%	0.706	S	S	*	*			trans	-64.4	125.6	166.5	-67.1	-14.7	0	0	0	109.6
360	N	28.4	Very low	26.7	Very low	123 Å²	123	127.4 Å²	127.4	66%	0.658	70%	0.698	S	S	*	*			trans	-152.7	20.5	169.4	-103.2	-32.4	0	0	0	115	N358 N362	N358-N360 PolarHBondContact O-N 3.23Å; N360-N362 VanDerWaalsContact C-N 3.33Å; N360-N362 PolarHBondContact O-N 3.3Å; N360-N362 PolarHBondContact O-ND2 2.74Å; N360-N362 VanDerWaalsContact O-ND2 3.09Å
361	N	26	Very low	26.8	Very low	156 Å²	156	128.1 Å²	128.1	83%	0.834	69%	0.692	S	S	*	*			trans	-68.7	91	171.3	-68.6	26.7	0	0	0	109.3	D363	N361-D363 PolarHBondContact O-N 3.49Å
362	N	27.9	Very low	26.8	Very low	118 Å²	118	126.7 Å²	126.7	63%	0.631	68%	0.679	S	S	*	*			trans	-82.2	86.9	173.5	-74.8	-84.7	0	0	0	108.4	N360 L364	N360-N362 VanDerWaalsContact C-N 3.33Å; N360-N362 PolarHBondContact O-N 3.3Å; N360-N362 PolarHBondContact O-ND2 2.74Å; N360-N362 VanDerWaalsContact O-ND2 3.09Å; N362-L364 PolarHBondContact O-N 3.33Å
363	D	27.1	Very low	26.8	Very low	128 Å²	128	125.4 Å²	125.4	68%	0.684	67%	0.666	S	S	*	*			trans	-53.9	103.2	-179.9	-78.8	-32.8	0	0	0	112.4	N361 N365	N361-D363 PolarHBondContact O-N 3.49Å; D363-N365 HydrophobicContact CB-CB 4.43Å; D363-N365 PolarHBondContact O-N 3.31Å
364	L	26.5	Very low	27.1	Very low	128 Å²	128	123.2 Å²	123.2	67%	0.67	65%	0.654	S	S	*	*			trans	-76.7	22.7	174.6	-109.7	156.7	0	0	0	113	N362 C366	N362-L364 PolarHBondContact O-N 3.33Å; L364-C366 PolarHBondContact O-N 2.85Å
365	N	26.9	Very low	27.2	Very low	108 Å²	108	118.6 Å²	118.6	58%	0.578	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	9	179	-94.9	-55.2	0	0	0	115.1	D363	D363-N365 HydrophobicContact CB-CB 4.43Å; D363-N365 PolarHBondContact O-N 3.31Å
366	C	26.1	Very low	27.6	Very low	90 Å²	90	114.1 Å²	114.1	61%	0.608	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-6.6	179.4	70.4	0	0	0	0	114.7	L364	L364-C366 PolarHBondContact O-N 2.85Å
367	L	26.1	Very low	27.9	Very low	92 Å²	92	109 Å²	109	48%	0.482	58%	0.579	S	S	.	*	S	Bend	trans	-95.5	-11.7	176.1	-69.8	172.4	0	0	0	114.3	Q369	L367-Q369 PolarHBondContact O-N 3.49Å
368	N	25.3	Very low	28.4	Very low	85 Å²	85	105.3 Å²	105.3	46%	0.455	56%	0.563	S	S	.	*			trans	-74.3	25.3	178.6	-89.8	-37	0	0	0	115.1	N336	N336-N368 PolarHBondContact ND2-OD1 3.34Å; N336-N368 PolarHBondContact OD1-ND2 3.36Å; N336-N368 PolarHBondContact OD1-OD1 3.01Å; N336-N368 VanDerWaalsContact OD1-OD1 3.09Å
369	Q	26.1	Very low	28.7	Very low	155 Å²	155	98.8 Å²	98.8	72%	0.724	53%	0.528	S	S	*	.	S	Bend	trans	-108.3	115.7	168.2	-65.8	-173.4	-2.7	0	0	108.8	L367 F371	L367-Q369 PolarHBondContact O-N 3.49Å; Q369-F371 PolarHBondContact O-N 3.22Å
370	L	26.7	Very low	29.1	Very low	116 Å²	116	94.3 Å²	94.3	61%	0.607	50%	0.501	S	S	*	.			trans	-52.5	124.8	174.7	-83.4	78.2	0	0	0	110	I372 P522	L370-I372 VanDerWaalsContact C-N 3.27Å; L370-I372 PolarHBondContact O-N 2.86Å; L370-P522 HydrophobicContact CD2-CB 4.37Å; L370-P522 HydrophobicContact CD2-CG 3.64Å
371	F	26.1	Very low	29.5	Very low	132 Å²	132	97.8 Å²	97.8	58%	0.579	51%	0.511	S	S	*	.			trans	-69.2	83.9	171.3	-88.2	-99.1	0	0	0	110.2	Q369 I373	Q369-F371 PolarHBondContact O-N 3.22Å; F371-I373 PolarHBondContact O-N 2.91Å
372	I	28	Very low	29.9	Very low	88 Å²	88	99 Å²	99	45%	0.451	51%	0.514	S	S	.	.			trans	-72.2	96.8	164.3	-57.4	176.3	0	0	0	107	L370 P374 I520	L370-I372 VanDerWaalsContact C-N 3.27Å; L370-I372 PolarHBondContact O-N 2.86Å; I372-P374 VanDerWaalsContact O-CD 3.27Å; I372-P374 WeakPolarHBondContact O-CD 3.47Å; I372-I520 WeakPolarHBondContact CG2-O 3.33Å
373	I	28.2	Very low	30.6	Very low	95 Å²	95	94.9 Å²	94.9	49%	0.487	50%	0.496	S	S	.	.			trans	-79.2	112.3	166.7	-57.9	177.9	0	0	0	107	F371 I375	F371-I373 PolarHBondContact O-N 2.91Å; I373-I375 VanDerWaalsContact C-N 3.29Å; I373-I375 HydrophobicContact CG2-CG1 3.89Å; I373-I375 PolarHBondContact O-N 3.47Å
374	P	29.8	Very low	31.3	Very low	69 Å²	69	92.6 Å²	92.6	45%	0.448	49%	0.488	S	S	.	.			trans	-79.1	80.7	177.3	33.5	-33.6	0	0	0	109.5	I372 P376 F501	I372-P374 VanDerWaalsContact O-CD 3.27Å; I372-P374 WeakPolarHBondContact O-CD 3.47Å; P374-P376 VanDerWaalsContact O-CD 3.23Å; P374-P376 WeakPolarHBondContact O-CD 3.27Å; P374-F501 HydrophobicContact CG-CE1 4.14Å
375	I	30.3	Very low	32.2	Very low	60 Å²	60	92.2 Å²	92.2	31%	0.308	49%	0.487	S	S	.	.			trans	-67.3	113.3	170.7	-55.7	-179.3	0	0	0	107.6	M321 I373 I377 I520	M321-I375 HydrophobicContact CE-CD1 3.5Å; M321-I375 VanDerWaalsContact CE-CD1 3.5Å; I373-I375 VanDerWaalsContact C-N 3.29Å; I373-I375 HydrophobicContact CG2-CG1 3.89Å; I373-I375 PolarHBondContact O-N 3.47Å; I375-I377 HydrophobicContact CG2-CG1 3.99Å; I375-I377 PolarHBondContact O-N 2.92Å; I375-I377 VanDerWaalsContact O-N 3.11Å; I375-I520 HydrophobicContact CB-CD1 4.33Å
376	P	34.4	Very low	33.1	Very low	52 Å²	52	90.5 Å²	90.5	34%	0.338	48%	0.477	S	S	.	.			trans	-89	81.5	-177.2	20.1	-2.9	0	0	0	108.1	P374 P378 I508	P374-P376 VanDerWaalsContact O-CD 3.23Å; P374-P376 WeakPolarHBondContact O-CD 3.27Å; P376-P378 VanDerWaalsContact O-CD 3.24Å; P376-P378 WeakPolarHBondContact O-CD 3.22Å; P376-I508 HydrophobicContact CB-CD1 4.05Å; P376-I508 HydrophobicContact CB-CG2 4.11Å; P376-I508 HydrophobicContact CG-CD1 3.32Å; P376-I508 HydrophobicContact CG-CG1 3.99Å; P376-I508 HydrophobicContact CG-CG2 4.38Å
377	I	35.1	Very low	34	Very low	53 Å²	53	88.8 Å²	88.8	27%	0.272	46%	0.461	S	S	.	.			trans	-66.9	116.4	174.7	-56.2	176.4	0	0	0	107.9	I375 I379 L390	I375-I377 HydrophobicContact CG2-CG1 3.99Å; I375-I377 PolarHBondContact O-N 2.92Å; I375-I377 VanDerWaalsContact O-N 3.11Å; I377-I379 HydrophobicContact CG2-CG1 4.28Å; I377-I379 PolarHBondContact O-N 2.82Å; I377-L390 HydrophobicContact CD1-CD2 4.08Å; I377-L390 HydrophobicContact CG2-CD1 4.32Å
378	P	36.2	Very low	35	Very low	59 Å²	59	89.6 Å²	89.6	38%	0.383	47%	0.466	S	S	.	.			trans	-77.2	88	177.8	32.4	-33.3	0	0	0	109.2	P376 F380 C515	P376-P378 VanDerWaalsContact O-CD 3.24Å; P376-P378 WeakPolarHBondContact O-CD 3.22Å; P378-F380 HydrophobicContact CB-CD2 4.3Å; P378-F380 HydrophobicContact CB-CE2 3.66Å; P378-F380 HydrophobicContact CB-CZ 4.02Å; P378-F380 HydrophobicContact CG-CE2 3.8Å; P378-F380 HydrophobicContact CG-CZ 4.42Å; P378-F380 WeakPolarHBondContact O-CD2 3.31Å; P378-F380 WeakPolarHBondContact O-CE2 3.42Å; P378-F380 PolarHBondContact O-N 3.37Å; P378-C515 HydrophobicContact CB-CB 4.23Å
379	I	35.6	Very low	36	Very low	12 Å²	12	88.9 Å²	88.9	6%	0.062	46%	0.462	C	S	.	.	B	Isolated β-bridge	trans	-71.8	99.3	170.9	-51.8	-178.7	0	0	0	107.9	I377 L387 L390 V518	I377-I379 HydrophobicContact CG2-CG1 4.28Å; I377-I379 PolarHBondContact O-N 2.82Å; I379-L387 HydrophobicContact CD1-CD1 3.78Å; I379-L387 HydrophobicContact CG2-CB 4.21Å; I379-L387 HydrophobicContact CG2-CD1 4.46Å; I379-L390 HydrophobicContact CD1-CD1 3.55Å; I379-L390 HydrophobicContact CG1-CD1 3.9Å; I379-V518 HydrophobicContact CD1-CG2 3.52Å; I379-V518 HydrophobicContact CG1-CG2 4.24Å
380	F	35.1	Very low	36.9	Very low	62 Å²	62	82.1 Å²	82.1	27%	0.272	43%	0.43	S	S	.	.			trans	-70.7	145.5	174.7	-68.9	-85.4	0	0	0	111	Y237 P378 M382 A383	Y237-F380 AromaticContact CD2-CD2 3.83Å; Y237-F380 HydrophobicContact CD2-CD2 3.83Å; Y237-F380 AromaticContact CD2-CE2 3.66Å; Y237-F380 HydrophobicContact CD2-CE2 3.66Å; Y237-F380 HydrophobicContact CD2-CZ 4.48Å; Y237-F380 HydrophobicContact CG-CE2 4.41Å; P378-F380 HydrophobicContact CB-CD2 4.3Å; P378-F380 HydrophobicContact CB-CE2 3.66Å; P378-F380 HydrophobicContact CB-CZ 4.02Å; P378-F380 HydrophobicContact CG-CE2 3.8Å; P378-F380 HydrophobicContact CG-CZ 4.42Å; P378-F380 WeakPolarHBondContact O-CD2 3.31Å; P378-F380 WeakPolarHBondContact O-CE2 3.42Å; P378-F380 PolarHBondContact O-N 3.37Å; F380-M382 PolarHBondContact O-N 2.98Å; F380-A383 PolarHBondContact O-N 3.39Å
381	K	36.5	Very low	38	Very low	196 Å²	196	80.5 Å²	80.5	85%	0.852	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-12.2	-177.5	-159.6	-178.6	178.8	-170.3	0	114.2
382	M	34.4	Very low	39.1	Very low	182 Å²	182	82 Å²	82	90%	0.897	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.2	-179	-65.3	163.1	69.6	0	0	113.9	F380 P384	F380-M382 PolarHBondContact O-N 2.98Å; M382-P384 WeakPolarHBondContact O-CD 3.25Å
383	A	41.7	Very low	39.6	Very low	31 Å²	31	82.5 Å²	82.5	26%	0.256	43%	0.425	S	S	.	.			trans	-117.5	62.9	-174	0	0	0	0	0	113.6	F380 N385 L386 L387	F380-A383 PolarHBondContact O-N 3.39Å; A383-N385 VanDerWaalsContact C-N 3.26Å; A383-N385 PolarHBondContact O-N 2.98Å; A383-L386 HydrophobicContact CB-CB 4.28Å; A383-L386 HydrophobicContact CB-CD1 4.24Å; A383-L386 PolarHBondContact O-N 3.45Å; A383-L387 PolarHBondContact O-N 3.02Å
384	P	43	Very low	39.9	Very low	79 Å²	79	80.1 Å²	80.1	51%	0.513	42%	0.424	S	S	.	.	H	α-helix	trans	-63.3	-29.9	-177.4	27.3	-35.2	0	0	0	113.2	M382 L386 L387 N388	M382-P384 WeakPolarHBondContact O-CD 3.25Å; P384-L386 VanDerWaalsContact C-N 3.35Å; P384-L386 PolarHBondContact O-N 3.07Å; P384-L387 WeakPolarHBondContact O-CB 3.34Å; P384-L387 PolarHBondContact O-N 2.93Å; P384-L387 VanDerWaalsContact O-N 3.16Å; P384-N388 PolarHBondContact O-N 3.31Å
385	N	45.3	Very low	40.3	Very low	121 Å²	121	79 Å²	79	65%	0.647	41%	0.411	S	S	*	.	H	α-helix	trans	-64.4	-39.8	178.6	-63.5	-3.6	0	0	0	111.6	A383 L387 N388 I389	A383-N385 VanDerWaalsContact C-N 3.26Å; A383-N385 PolarHBondContact O-N 2.98Å; N385-L387 VanDerWaalsContact C-N 3.35Å; N385-N388 PolarHBondContact O-N 3.32Å; N385-I389 VanDerWaalsContact O-CG1 3.31Å; N385-I389 WeakPolarHBondContact O-CG1 3.36Å; N385-I389 PolarHBondContact O-N 3.46Å
386	L	44.4	Very low	40.7	Very low	72 Å²	72	80.7 Å²	80.7	38%	0.377	42%	0.418	S	S	.	.	H	α-helix	trans	-64.9	-37.7	173.1	-96.7	159.9	0	0	0	111.9	A383 P384 I389 L390	A383-L386 HydrophobicContact CB-CB 4.28Å; A383-L386 HydrophobicContact CB-CD1 4.24Å; A383-L386 PolarHBondContact O-N 3.45Å; P384-L386 VanDerWaalsContact C-N 3.35Å; P384-L386 PolarHBondContact O-N 3.07Å; L386-I389 PolarHBondContact O-N 2.84Å; L386-L390 VanDerWaalsContact O-CB 3.28Å; L386-L390 WeakPolarHBondContact O-CB 3.21Å; L386-L390 WeakPolarHBondContact O-CD1 3.33Å; L386-L390 VanDerWaalsContact O-CG 3.24Å; L386-L390 WeakPolarHBondContact O-CG 3.29Å; L386-L390 PolarHBondContact O-N 3.18Å
387	L	46.3	Very low	40.7	Very low	53 Å²	53	78.4 Å²	78.4	28%	0.277	40%	0.403	S	S	.	.	H	α-helix	trans	-65.2	-38.8	173.9	-177.2	63	0	0	0	112	I379 A383 P384 N385 H391	I379-L387 HydrophobicContact CD1-CD1 3.78Å; I379-L387 HydrophobicContact CG2-CB 4.21Å; I379-L387 HydrophobicContact CG2-CD1 4.46Å; A383-L387 PolarHBondContact O-N 3.02Å; P384-L387 WeakPolarHBondContact O-CB 3.34Å; P384-L387 PolarHBondContact O-N 2.93Å; P384-L387 VanDerWaalsContact O-N 3.16Å; N385-L387 VanDerWaalsContact C-N 3.35Å; L387-H391 WeakPolarHBondContact O-CB 3.5Å; L387-H391 PolarHBondContact O-N 3.13Å
388	N	46.5	Very low	40.7	Very low	110 Å²	110	80.2 Å²	80.2	59%	0.588	41%	0.411	S	S	*	.	H	α-helix	trans	-65.7	-45.8	175.1	-78.3	-14	0	0	0	112.2	P384 N385 L390 H391 H392	P384-N388 PolarHBondContact O-N 3.31Å; N385-N388 PolarHBondContact O-N 3.32Å; N388-L390 PolarHBondContact O-N 3.16Å; N388-H391 PolarHBondContact O-N 3.45Å; N388-H392 PolarHBondContact O-N 3.26Å
389	I	46.9	Very low	40.5	Very low	69 Å²	69	82.2 Å²	82.2	35%	0.354	42%	0.419	S	S	.	.	H	α-helix	trans	-58.3	-48.9	174.8	-68.7	163.5	0	0	0	109.9	N385 L386 H391 H392 Y393	N385-I389 VanDerWaalsContact O-CG1 3.31Å; N385-I389 WeakPolarHBondContact O-CG1 3.36Å; N385-I389 PolarHBondContact O-N 3.46Å; L386-I389 PolarHBondContact O-N 2.84Å; I389-H391 VanDerWaalsContact C-N 3.34Å; I389-H391 PolarHBondContact O-N 3.07Å; I389-H392 WeakPolarHBondContact O-CB 3.19Å; I389-H392 PolarHBondContact O-N 2.88Å; I389-Y393 HydrophobicContact CG2-CD2 4.02Å; I389-Y393 HydrophobicContact CG2-CE2 3.95Å; I389-Y393 VanDerWaalsContact O-CD2 3.29Å; I389-Y393 WeakPolarHBondContact O-CD2 3.44Å; I389-Y393 PolarHBondContact O-N 3.5Å; I389-Y393 VanDerWaalsContact O-N 3.13Å
390	L	45.5	Very low	40.2	Very low	13 Å²	13	84.4 Å²	84.4	7%	0.068	44%	0.436	C	S	.	.	H	α-helix	trans	-61.6	-40.3	178	-75.1	169.8	0	0	0	111.9	I377 I379 L386 N388 H392 Y393 G394 Y395	I377-L390 HydrophobicContact CD1-CD2 4.08Å; I377-L390 HydrophobicContact CG2-CD1 4.32Å; I379-L390 HydrophobicContact CD1-CD1 3.55Å; I379-L390 HydrophobicContact CG1-CD1 3.9Å; L386-L390 VanDerWaalsContact O-CB 3.28Å; L386-L390 WeakPolarHBondContact O-CB 3.21Å; L386-L390 WeakPolarHBondContact O-CD1 3.33Å; L386-L390 VanDerWaalsContact O-CG 3.24Å; L386-L390 WeakPolarHBondContact O-CG 3.29Å; L386-L390 PolarHBondContact O-N 3.18Å; N388-L390 PolarHBondContact O-N 3.16Å; L390-H392 VanDerWaalsContact C-N 3.33Å; L390-H392 PolarHBondContact O-N 2.82Å; L390-Y393 CarbonylContact O-C 3.44Å; L390-Y393 PolarHBondContact O-N 2.94Å; L390-G394 PolarHBondContact O-N 2.87Å; L390-Y395 CarbonylContact C-O 3.46Å; L390-Y395 HydrophobicContact CD2-CD2 3.75Å; L390-Y395 HydrophobicContact CD2-CE2 4.37Å; L390-Y395 HydrophobicContact CD2-CG 4.03Å; L390-Y395 WeakPolarHBondContact O-CA 3.48Å; L390-Y395 WeakPolarHBondContact O-CB 3.16Å; L390-Y395 WeakPolarHBondContact O-CD2 3.44Å; L390-Y395 PolarHBondContact O-N 3.34Å
391	H	49.7	Very low	39.8	Very low	83 Å²	83	85.5 Å²	85.5	38%	0.384	45%	0.45	S	S	.	.	H	α-helix	trans	-62.5	-36.8	172.1	-106.3	-119.1	0	0	0	113.2	L387 N388 I389 Y393 G394 Y395 H396	L387-H391 WeakPolarHBondContact O-CB 3.5Å; L387-H391 PolarHBondContact O-N 3.13Å; N388-H391 PolarHBondContact O-N 3.45Å; I389-H391 VanDerWaalsContact C-N 3.34Å; I389-H391 PolarHBondContact O-N 3.07Å; H391-Y393 VanDerWaalsContact C-N 3.33Å; H391-Y393 PolarHBondContact O-N 2.91Å; H391-G394 PolarHBondContact O-N 3.14Å; H391-G394 VanDerWaalsContact O-N 3.08Å; H391-Y395 PolarHBondContact CD2-O 3.41Å; H391-Y395 VanDerWaalsContact CD2-O 3.28Å; H391-H396 AromaticContact CD2-ND1 3.51Å; H391-H396 AromaticContact CE1-CE1 3.76Å; H391-H396 AromaticContact CE1-ND1 3.26Å; H391-H396 PolarHBondContact CE1-ND1 3.12Å; H391-H396 VanDerWaalsContact CE1-ND1 3.26Å; H391-H396 AromaticContact CG-ND1 3.85Å; H391-H396 AromaticContact ND1-CE1 3.88Å; H391-H396 AromaticContact ND1-ND1 3.7Å; H391-H396 AromaticContact NE2-CE1 3.99Å; H391-H396 AromaticContact NE2-ND1 3.09Å; H391-H396 PolarHBondContact NE2-ND1 2.88Å
392	H	47.4	Very low	39.3	Very low	164 Å²	164	84.7 Å²	84.7	76%	0.759	45%	0.446	S	S	*	.	H	α-helix	trans	-63.9	-37.8	177.8	-160.2	91.8	0	0	0	111.9	N388 I389 L390 G394	N388-H392 PolarHBondContact O-N 3.26Å; I389-H392 WeakPolarHBondContact O-CB 3.19Å; I389-H392 PolarHBondContact O-N 2.88Å; L390-H392 VanDerWaalsContact C-N 3.33Å; L390-H392 PolarHBondContact O-N 2.82Å; H392-G394 VanDerWaalsContact C-N 3.31Å; H392-G394 PolarHBondContact O-N 3.37Å
393	Y	39	Very low	39	Very low	97 Å²	97	85.2 Å²	85.2	38%	0.38	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	10.6	172.6	-65.3	-76	0	0	0	114.3	Y315 I389 L390 H391	Y315-Y393 PolarHBondContact OH-OH 2.95Å; Y315-Y393 VanDerWaalsContact OH-OH 3.07Å; I389-Y393 HydrophobicContact CG2-CD2 4.02Å; I389-Y393 HydrophobicContact CG2-CE2 3.95Å; I389-Y393 VanDerWaalsContact O-CD2 3.29Å; I389-Y393 WeakPolarHBondContact O-CD2 3.44Å; I389-Y393 PolarHBondContact O-N 3.5Å; I389-Y393 VanDerWaalsContact O-N 3.13Å; L390-Y393 CarbonylContact O-C 3.44Å; L390-Y393 PolarHBondContact O-N 2.94Å; H391-Y393 VanDerWaalsContact C-N 3.33Å; H391-Y393 PolarHBondContact O-N 2.91Å
394	G	34.9	Very low	38.2	Very low	46 Å²	46	90.1 Å²	90.1	47%	0.474	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	14.2	173.3	0	0	0	0	0	116.2	L390 H391 H392	L390-G394 PolarHBondContact O-N 2.87Å; H391-G394 PolarHBondContact O-N 3.14Å; H391-G394 VanDerWaalsContact O-N 3.08Å; H392-G394 VanDerWaalsContact C-N 3.31Å; H392-G394 PolarHBondContact O-N 3.37Å
395	Y	37.6	Very low	37.3	Very low	44 Å²	44	93.5 Å²	93.5	17%	0.173	48%	0.475	C	S	.	.			trans	-88.6	126.6	175.1	-59.8	-84.1	0	0	0	111.1	L390 H391 V518 I520	L390-Y395 CarbonylContact C-O 3.46Å; L390-Y395 HydrophobicContact CD2-CD2 3.75Å; L390-Y395 HydrophobicContact CD2-CE2 4.37Å; L390-Y395 HydrophobicContact CD2-CG 4.03Å; L390-Y395 WeakPolarHBondContact O-CA 3.48Å; L390-Y395 WeakPolarHBondContact O-CB 3.16Å; L390-Y395 WeakPolarHBondContact O-CD2 3.44Å; L390-Y395 PolarHBondContact O-N 3.34Å; H391-Y395 PolarHBondContact CD2-O 3.41Å; H391-Y395 VanDerWaalsContact CD2-O 3.28Å; Y395-V518 HydrophobicContact CD1-CG1 4.3Å; Y395-I520 HydrophobicContact CD1-CG1 4.01Å; Y395-I520 HydrophobicContact CD1-CG2 4.47Å; Y395-I520 HydrophobicContact CE1-CB 4.48Å; Y395-I520 HydrophobicContact CE1-CD1 4.01Å; Y395-I520 HydrophobicContact CE1-CG1 3.88Å; Y395-I520 HydrophobicContact CE1-CG2 3.98Å
396	H	38.3	Very low	36.3	Very low	96 Å²	96	93.5 Å²	93.5	44%	0.444	48%	0.475	S	S	.	.			trans	-121.1	142.7	-176.8	-59.1	-45.6	0	0	0	112.8	H391	H391-H396 AromaticContact CD2-ND1 3.51Å; H391-H396 AromaticContact CE1-CE1 3.76Å; H391-H396 AromaticContact CE1-ND1 3.26Å; H391-H396 PolarHBondContact CE1-ND1 3.12Å; H391-H396 VanDerWaalsContact CE1-ND1 3.26Å; H391-H396 AromaticContact CG-ND1 3.85Å; H391-H396 AromaticContact ND1-CE1 3.88Å; H391-H396 AromaticContact ND1-ND1 3.7Å; H391-H396 AromaticContact NE2-CE1 3.99Å; H391-H396 AromaticContact NE2-ND1 3.09Å; H391-H396 PolarHBondContact NE2-ND1 2.88Å
397	S	35.1	Very low	35.5	Very low	4 Å²	4	96.4 Å²	96.4	3%	0.028	49%	0.491	C	S	.	.	B	Isolated β-bridge	trans	-85.4	141.3	-177.2	97.5	0	0	0	0	112	N399 S400 Y516	S397-N399 VanDerWaalsContact C-N 3.29Å; S397-N399 PolarHBondContact O-N 3.36Å; S397-S400 WeakPolarHBondContact O-CB 3.27Å; S397-S400 PolarHBondContact O-N 3.41Å; S397-S400 VanDerWaalsContact O-N 3.15Å; S397-S400 PolarHBondContact O-OG 2.99Å; S397-S400 PolarHBondContact OG-N 2.88Å; S397-S400 PolarHBondContact OG-OG 2.81Å; S397-Y516 WeakPolarHBondContact OG-CD1 3.33Å
398	M	35	Very low	34.5	Very low	91 Å²	91	102 Å²	102	45%	0.448	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-60.1	-34.9	-178.6	-85.7	-176.4	93.6	0	0	113.8	S400 C401 T517	M398-S400 VanDerWaalsContact C-N 3.28Å; M398-S400 PolarHBondContact O-N 3.21Å; M398-C401 WeakPolarHBondContact O-CB 3.46Å; M398-C401 PolarHBondContact O-N 3.35Å; M398-T517 VanDerWaalsContact CB-O 3.29Å; M398-T517 WeakPolarHBondContact CB-O 3.45Å; M398-T517 WeakPolarHBondContact CG-O 3.37Å; M398-T517 PolarHBondContact N-O 3.21Å; M398-T517 PolarHBondContact SD-OG1 3.28Å
399	N	32.1	Very low	33.4	Very low	101 Å²	101	105 Å²	105	54%	0.54	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-85.6	-0.3	-177.3	-35.9	-34.3	0	0	0	112.7	S397 Y516	S397-N399 VanDerWaalsContact C-N 3.29Å; S397-N399 PolarHBondContact O-N 3.36Å; N399-Y516 HydrophobicContact CB-CD1 3.74Å; N399-Y516 HydrophobicContact CB-CE1 3.55Å; N399-Y516 VanDerWaalsContact ND2-CD1 3.32Å; N399-Y516 WeakPolarHBondContact ND2-CD1 3.45Å
400	S	30	Very low	32.4	Very low	59 Å²	59	110.1 Å²	110.1	41%	0.413	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-66.9	-24.8	162.3	-57.8	0	0	0	0	111.2	S397 M398	S397-S400 WeakPolarHBondContact O-CB 3.27Å; S397-S400 PolarHBondContact O-N 3.41Å; S397-S400 VanDerWaalsContact O-N 3.15Å; S397-S400 PolarHBondContact O-OG 2.99Å; S397-S400 PolarHBondContact OG-N 2.88Å; S397-S400 PolarHBondContact OG-OG 2.81Å; M398-S400 VanDerWaalsContact C-N 3.28Å; M398-S400 PolarHBondContact O-N 3.21Å
401	C	25.7	Very low	31.4	Very low	84 Å²	84	116.3 Å²	116.3	57%	0.568	58%	0.584	S	S	*	*	S	Bend	trans	-77.7	119.1	166.5	-70.9	0	0	0	0	109.8	M398 Y403	M398-C401 WeakPolarHBondContact O-CB 3.46Å; M398-C401 PolarHBondContact O-N 3.35Å; C401-Y403 VanDerWaalsContact C-N 3.26Å; C401-Y403 PolarHBondContact O-N 3.4Å
402	K	27.5	Very low	30.1	Very low	180 Å²	180	118.8 Å²	118.8	78%	0.783	60%	0.6	S	S	*	*			trans	-65.9	83.1	168	-73.8	-174.6	175.1	-179.5	0	110.6	N404	K402-N404 PolarHBondContact O-N 3.45Å
403	Y	27.2	Very low	29.1	Very low	192 Å²	192	117 Å²	117	75%	0.753	60%	0.596	S	S	*	*			trans	-64.5	98.5	164.2	-103.1	-82.6	0	0	0	108.6	C401 N405	C401-Y403 VanDerWaalsContact C-N 3.26Å; C401-Y403 PolarHBondContact O-N 3.4Å; Y403-N405 PolarHBondContact O-N 3.09Å
404	N	24.8	Very low	28.5	Very low	134 Å²	134	121.4 Å²	121.4	72%	0.717	62%	0.617	S	S	*	*			trans	-69.9	126.3	-176.3	-164.1	4.8	0	0	0	109.9	K402 N406	K402-N404 PolarHBondContact O-N 3.45Å; N404-N406 PolarHBondContact O-N 3.31Å
405	N	24.5	Very low	28.1	Very low	150 Å²	150	126.2 Å²	126.2	80%	0.802	63%	0.632	S	S	*	*			trans	-69.8	88.7	-170.6	-118.9	-9.2	0	0	0	110.8	Y403	Y403-N405 PolarHBondContact O-N 3.09Å
406	N	25	Very low	27.5	Very low	122 Å²	122	128.7 Å²	128.7	65%	0.652	66%	0.661	S	S	*	*			trans	-149.1	65.9	-177.6	-96.8	-54.6	0	0	0	112.1	N404	N404-N406 PolarHBondContact O-N 3.31Å
407	N	26.8	Very low	26.8	Very low	133 Å²	133	132.4 Å²	132.4	71%	0.711	68%	0.681	S	S	*	*				177.2	100.6	124.1	-94.9	-62.1	0	0	0	110.6	K409	N407-K409 VanDerWaalsContact C-N 3.29Å; N407-K409 PolarHBondContact O-N 2.75Å
408	N	24.6	Very low	26.3	Very low	169 Å²	169	138.4 Å²	138.4	90%	0.904	72%	0.718	S	S	*	*			trans	-68.7	89.6	159.4	-79.7	-19.7	0	0	0	108.7
409	K	24.9	Very low	25.9	Very low	173 Å²	173	142 Å²	142	75%	0.752	73%	0.734	S	S	*	*			trans	-121.6	110	164.6	-77.1	-165.3	172.3	-174.6	0	109.9	N407 L411	N407-K409 VanDerWaalsContact C-N 3.29Å; N407-K409 PolarHBondContact O-N 2.75Å; K409-L411 PolarHBondContact O-N 3.47Å
410	Q	24	Very low	25.6	Very low	177 Å²	177	143.7 Å²	143.7	83%	0.827	75%	0.747	S	S	*	*			trans	-52.8	124.7	171.6	-63.2	160.4	-19.7	0	0	109.2
411	L	24.5	Very low	25.5	Very low	143 Å²	143	146.1 Å²	146.1	75%	0.749	76%	0.755	S	S	*	*			trans	-118.9	94.3	167.6	-143.4	78.8	0	0	0	108.3	K409 N413	K409-L411 PolarHBondContact O-N 3.47Å; L411-N413 VanDerWaalsContact C-N 3.26Å; L411-N413 PolarHBondContact O-N 3.04Å
412	N	23.9	Very low	25.6	Very low	135 Å²	135	147.2 Å²	147.2	72%	0.722	76%	0.755	S	S	*	*			trans	-74.1	74.8	-177.3	-72.9	-23.7	0	0	0	110.9	K414	N412-K414 VanDerWaalsContact C-N 3.29Å; N412-K414 PolarHBondContact O-N 3.15Å
413	N	26.5	Very low	25.7	Very low	127 Å²	127	144.2 Å²	144.2	68%	0.679	75%	0.747	S	S	*	*			trans	-74.1	77.6	177.5	-74.2	0.2	0	0	0	111.5	L411	L411-N413 VanDerWaalsContact C-N 3.26Å; L411-N413 PolarHBondContact O-N 3.04Å
414	K	25.5	Very low	25.8	Very low	189 Å²	189	140.9 Å²	140.9	82%	0.822	74%	0.742	S	S	*	*			trans	-85.5	-13.8	165.9	-83.2	-171.3	170.7	-176	0	113.2	N412 A416	N412-K414 VanDerWaalsContact C-N 3.29Å; N412-K414 PolarHBondContact O-N 3.15Å; K414-A416 VanDerWaalsContact C-N 3.34Å; K414-A416 PolarHBondContact O-N 3.27Å
415	D	26	Very low	26.1	Very low	148 Å²	148	141.3 Å²	141.3	79%	0.791	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	24.9	-164	-49.9	-48.2	0	0	0	115.1
416	A	25.7	Very low	26.4	Very low	95 Å²	95	138 Å²	138	79%	0.785	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	5.9	-171.2	0	0	0	0	0	115.2	K414	K414-A416 VanDerWaalsContact C-N 3.34Å; K414-A416 PolarHBondContact O-N 3.27Å
417	M	24.8	Very low	26.7	Very low	175 Å²	175	136.8 Å²	136.8	86%	0.862	71%	0.712	S	S	*	*			trans	-119.4	18.8	-165.7	-154	166.6	-178.6	0	0	115.5
418	T	24.1	Very low	26.9	Very low	129 Å²	129	135.8 Å²	135.8	79%	0.791	71%	0.707	S	S	*	*			trans	-124.8	48.1	-174.8	37.5	0	0	0	0	114.1
419	Q	26.4	Very low	27.2	Very low	168 Å²	168	133.6 Å²	133.6	79%	0.785	69%	0.692	S	S	*	*			trans	-130.3	56.6	162.1	-72.5	-162.3	-2.4	0	0	112.3	I421	Q419-I421 PolarHBondContact O-N 3.27Å
420	T	25.7	Very low	27.5	Very low	135 Å²	135	131.4 Å²	131.4	83%	0.828	68%	0.68	S	S	*	*			trans	-73.2	70	168.3	-41.4	0	0	0	0	109.9	N422	T420-N422 PolarHBondContact O-N 2.81Å
421	I	27	Very low	28	Very low	111 Å²	111	130.1 Å²	130.1	57%	0.569	67%	0.671	S	S	*	*			trans	-61.4	128.7	-178.8	-64.9	175.8	0	0	0	109.2	Q419 L423 I426	Q419-I421 PolarHBondContact O-N 3.27Å; I421-L423 VanDerWaalsContact C-N 3.31Å; I421-L423 PolarHBondContact O-N 3.23Å; I421-I426 HydrophobicContact CG2-CD1 4.43Å
422	N	28.1	Very low	28.3	Very low	107 Å²	107	130.7 Å²	130.7	57%	0.572	67%	0.67	S	S	*	*			trans	-76	76.3	-167.1	-165.6	-18.9	0	0	0	112.4	T420 N424 K425	T420-N422 PolarHBondContact O-N 2.81Å; N422-N424 PolarHBondContact O-N 2.96Å; N422-N424 VanDerWaalsContact O-N 3.11Å; N422-K425 PolarHBondContact O-N 2.86Å
423	L	30	Very low	28.9	Very low	117 Å²	117	127.9 Å²	127.9	61%	0.613	66%	0.658	S	S	*	*	H	α-helix	trans	-50.9	-31.8	-178.4	-84.3	141.1	0	0	0	114	I421 K425 I426 N427	I421-L423 VanDerWaalsContact C-N 3.31Å; I421-L423 PolarHBondContact O-N 3.23Å; L423-K425 VanDerWaalsContact C-N 3.29Å; L423-K425 PolarHBondContact O-N 3.18Å; L423-I426 PolarHBondContact O-N 2.75Å; L423-N427 PolarHBondContact O-N 3.39Å
424	N	29.3	Very low	29.4	Very low	122 Å²	122	126 Å²	126	65%	0.652	65%	0.647	S	S	*	*	H	α-helix	trans	-68.8	-25.6	-179.4	-68.7	-5.2	0	0	0	113	N422	N422-N424 PolarHBondContact O-N 2.96Å; N422-N424 VanDerWaalsContact O-N 3.11Å
425	K	30.3	Very low	29.9	Very low	143 Å²	143	123.4 Å²	123.4	62%	0.622	64%	0.638	S	S	*	*	H	α-helix	trans	-74.6	-43.5	176.4	-129	-179.2	-178.7	-172	0	111.8	N422 L423 N427 N428	N422-K425 PolarHBondContact O-N 2.86Å; L423-K425 VanDerWaalsContact C-N 3.29Å; L423-K425 PolarHBondContact O-N 3.18Å; K425-N427 VanDerWaalsContact C-N 3.34Å; K425-N427 PolarHBondContact O-N 3.36Å; K425-N428 PolarHBondContact O-N 3.17Å
426	I	31.2	Very low	30.2	Very low	80 Å²	80	123.4 Å²	123.4	41%	0.41	63%	0.632	S	S	.	*	H	α-helix	trans	-63.8	-38.2	-178.6	-59.8	172.2	0	0	0	111.4	I421 L423 N428 Y430	I421-I426 HydrophobicContact CG2-CD1 4.43Å; L423-I426 PolarHBondContact O-N 2.75Å; I426-N428 VanDerWaalsContact C-N 3.3Å; I426-N428 PolarHBondContact O-N 2.83Å; I426-Y430 HydrophobicContact CG2-CD2 4Å; I426-Y430 HydrophobicContact CG2-CE2 4.16Å; I426-Y430 WeakPolarHBondContact O-CD2 3.43Å; I426-Y430 PolarHBondContact O-N 3.23Å
427	N	30.9	Very low	30.9	Very low	96 Å²	96	124.1 Å²	124.1	51%	0.513	62%	0.622	S	S	.	*	H	α-helix	trans	-68.6	-23.1	-177.7	-77.8	-22.2	0	0	0	114.5	L423 K425	L423-N427 PolarHBondContact O-N 3.39Å; K425-N427 VanDerWaalsContact C-N 3.34Å; K425-N427 PolarHBondContact O-N 3.36Å
428	N	31	Very low	31.5	Very low	112 Å²	112	122.6 Å²	122.6	60%	0.599	61%	0.611	S	S	*	*	H	α-helix	trans	-84.1	-44.8	-179.1	-74.1	-5.8	0	0	0	112.1	K425 I426 Y430 K431	K425-N428 PolarHBondContact O-N 3.17Å; I426-N428 VanDerWaalsContact C-N 3.3Å; I426-N428 PolarHBondContact O-N 2.83Å; N428-Y430 PolarHBondContact O-N 2.8Å; N428-K431 PolarHBondContact O-N 3.15Å; N428-K431 VanDerWaalsContact O-N 3.09Å
429	E	32.4	Very low	32.4	Very low	124 Å²	124	121 Å²	121	58%	0.579	60%	0.601	S	S	*	*	H	α-helix	trans	-61.7	-33.4	177.3	-67.4	171.6	179.6	0	0	112	K431 T433	E429-K431 VanDerWaalsContact C-N 3.34Å; E429-K431 PolarHBondContact O-N 3.37Å; E429-T433 WeakPolarHBondContact O-CG2 3.34Å; E429-T433 PolarHBondContact O-OG1 2.98Å
430	Y	30.5	Very low	33.3	Very low	127 Å²	127	118.8 Å²	118.8	50%	0.498	59%	0.591	S	S	.	*	H	α-helix	trans	-73.2	-15.1	176	-95.4	-91.5	0	0	0	115.1	I426 N428 N434	I426-Y430 HydrophobicContact CG2-CD2 4Å; I426-Y430 HydrophobicContact CG2-CE2 4.16Å; I426-Y430 WeakPolarHBondContact O-CD2 3.43Å; I426-Y430 PolarHBondContact O-N 3.23Å; N428-Y430 PolarHBondContact O-N 2.8Å; Y430-N434 PolarHBondContact O-ND2 3.31Å
431	K	33.4	Very low	33.8	Very low	150 Å²	150	117.8 Å²	117.8	65%	0.652	58%	0.58	S	S	*	*	H	α-helix	trans	-80.8	-59.3	175.2	-84.8	-172.2	170.5	-173.2	0	111.5	N428 E429 T433 N434 E435	N428-K431 PolarHBondContact O-N 3.15Å; N428-K431 VanDerWaalsContact O-N 3.09Å; E429-K431 VanDerWaalsContact C-N 3.34Å; E429-K431 PolarHBondContact O-N 3.37Å; K431-T433 VanDerWaalsContact C-N 3.26Å; K431-T433 PolarHBondContact O-N 3.32Å; K431-N434 PolarHBondContact O-N 3.38Å; K431-E435 PolarHBondContact O-N 2.93Å
432	Q	32.7	Very low	34.5	Very low	154 Å²	154	116.9 Å²	116.9	72%	0.72	58%	0.575	S	S	*	*	H	α-helix	trans	-56.7	-39.3	-176.3	-71.1	-179.9	-29.7	0	0	112.5	N434 F436	Q432-N434 VanDerWaalsContact C-N 3.31Å; Q432-N434 PolarHBondContact O-N 3.3Å; Q432-F436 PolarHBondContact O-N 2.94Å
433	T	35	Very low	35.4	Very low	77 Å²	77	117.8 Å²	117.8	47%	0.472	58%	0.576	S	S	.	*	H	α-helix	trans	-69.9	-19.8	179.4	50.1	0	0	0	0	114.7	E429 K431 N437	E429-T433 WeakPolarHBondContact O-CG2 3.34Å; E429-T433 PolarHBondContact O-OG1 2.98Å; K431-T433 VanDerWaalsContact C-N 3.26Å; K431-T433 PolarHBondContact O-N 3.32Å; T433-N437 PolarHBondContact O-ND2 3.5Å
434	N	36.7	Very low	35.8	Very low	86 Å²	86	120.3 Å²	120.3	46%	0.46	58%	0.578	S	S	.	*	H	α-helix	trans	-94.9	-20.1	178.2	-81.8	-78.7	0	0	0	113.9	Y430 K431 Q432	Y430-N434 PolarHBondContact O-ND2 3.31Å; K431-N434 PolarHBondContact O-N 3.38Å; Q432-N434 VanDerWaalsContact C-N 3.31Å; Q432-N434 PolarHBondContact O-N 3.3Å
435	E	36.6	Very low	36.1	Very low	135 Å²	135	118.8 Å²	118.8	63%	0.631	57%	0.57	S	S	*	*	H	α-helix	trans	-80.3	-46.7	176	-70.4	179	148.6	0	0	111.2	K431 N437 K438 T439	K431-E435 PolarHBondContact O-N 2.93Å; E435-N437 PolarHBondContact O-N 2.85Å; E435-K438 WeakPolarHBondContact O-CB 3.2Å; E435-K438 PolarHBondContact O-N 2.95Å; E435-T439 PolarHBondContact O-N 3.32Å; E435-T439 VanDerWaalsContact O-N 3.1Å; E435-T439 PolarHBondContact O-OG1 3.15Å
436	F	32.9	Very low	36.6	Very low	148 Å²	148	116.1 Å²	116.1	65%	0.649	56%	0.562	S	S	*	*	H	α-helix	trans	-59.5	-43.8	-179.2	-147.2	-82.7	0	0	0	112.8	Q432 K438 T439 E440	Q432-F436 PolarHBondContact O-N 2.94Å; F436-K438 PolarHBondContact O-N 3.27Å; F436-T439 PolarHBondContact O-N 2.92Å; F436-T439 PolarHBondContact O-OG1 3.16Å; F436-T439 VanDerWaalsContact O-OG1 3.13Å; F436-E440 PolarHBondContact O-N 3.36Å
437	N	39.3	Very low	37.1	Very low	110 Å²	110	118.8 Å²	118.8	59%	0.588	57%	0.571	S	S	*	*	H	α-helix	trans	-68.6	-19.6	176.1	-77.5	-71	0	0	0	113.5	T433 E435 L441	T433-N437 PolarHBondContact O-ND2 3.5Å; E435-N437 PolarHBondContact O-N 2.85Å; N437-L441 WeakPolarHBondContact O-CB 3.29Å
438	K	38.8	Very low	37.4	Very low	144 Å²	144	118.3 Å²	118.3	63%	0.626	57%	0.568	S	S	*	*	H	α-helix	trans	-82.9	-43.4	176.3	-96.4	-174.2	170.4	-170.1	0	112	E435 F436 L441 I442	E435-K438 WeakPolarHBondContact O-CB 3.2Å; E435-K438 PolarHBondContact O-N 2.95Å; F436-K438 PolarHBondContact O-N 3.27Å; K438-L441 PolarHBondContact O-N 3.46Å; K438-I442 WeakPolarHBondContact O-CB 3.42Å; K438-I442 WeakPolarHBondContact O-CD1 3.47Å; K438-I442 VanDerWaalsContact O-CG1 3.26Å; K438-I442 WeakPolarHBondContact O-CG1 3.5Å; K438-I442 PolarHBondContact O-N 3.11Å
439	T	42.9	Very low	37.5	Very low	94 Å²	94	118.3 Å²	118.3	58%	0.577	57%	0.568	S	S	*	*	H	α-helix	trans	-66.3	-42.2	-179.3	42	0	0	0	0	111.8	E435 F436 H443	E435-T439 PolarHBondContact O-N 3.32Å; E435-T439 VanDerWaalsContact O-N 3.1Å; E435-T439 PolarHBondContact O-OG1 3.15Å; F436-T439 PolarHBondContact O-N 2.92Å; F436-T439 PolarHBondContact O-OG1 3.16Å; F436-T439 VanDerWaalsContact O-OG1 3.13Å; T439-H443 VanDerWaalsContact O-CB 3.23Å; T439-H443 WeakPolarHBondContact O-CB 3.28Å; T439-H443 PolarHBondContact O-N 2.95Å
440	E	44	Very low	37.5	Very low	123 Å²	123	120.2 Å²	120.2	58%	0.575	58%	0.577	S	S	*	*	H	α-helix	trans	-60.8	-46.7	172.9	-80.8	-165.3	119.5	0	0	112.3	F436 I442 H443 Y444	F436-E440 PolarHBondContact O-N 3.36Å; E440-I442 PolarHBondContact O-N 3.12Å; E440-H443 PolarHBondContact O-N 2.87Å; E440-Y444 WeakPolarHBondContact O-CB 3.49Å; E440-Y444 PolarHBondContact O-N 3.38Å
441	L	37.9	Very low	37.6	Very low	114 Å²	114	122.5 Å²	122.5	60%	0.597	59%	0.59	S	S	*	*	H	α-helix	trans	-64.9	-41	-177.8	-166.4	75.4	0	0	0	112.4	N437 K438 Y444 L445	N437-L441 WeakPolarHBondContact O-CB 3.29Å; K438-L441 PolarHBondContact O-N 3.46Å; L441-Y444 PolarHBondContact O-N 3.24Å; L441-L445 HydrophobicContact CG-CD1 4.35Å; L441-L445 WeakPolarHBondContact O-CG 3.23Å; L441-L445 PolarHBondContact O-N 2.96Å
442	I	40.8	Very low	37.4	Very low	91 Å²	91	119 Å²	119	47%	0.467	59%	0.588	S	S	.	*	H	α-helix	trans	-68.1	-41.7	177.1	-68.5	166.1	0	0	0	110.6	K438 E440 Y444 L445 N446	K438-I442 WeakPolarHBondContact O-CB 3.42Å; K438-I442 WeakPolarHBondContact O-CD1 3.47Å; K438-I442 VanDerWaalsContact O-CG1 3.26Å; K438-I442 WeakPolarHBondContact O-CG1 3.5Å; K438-I442 PolarHBondContact O-N 3.11Å; E440-I442 PolarHBondContact O-N 3.12Å; I442-Y444 VanDerWaalsContact C-N 3.31Å; I442-Y444 PolarHBondContact O-N 2.86Å; I442-L445 PolarHBondContact O-N 3.4Å; I442-N446 WeakPolarHBondContact O-CB 3.4Å; I442-N446 PolarHBondContact O-N 3.4Å; I442-N446 PolarHBondContact O-OD1 3.35Å
443	H	46	Very low	37.1	Very low	127 Å²	127	120 Å²	120	59%	0.588	60%	0.598	S	S	*	*	H	α-helix	trans	-63.1	-37.4	175.2	-176.5	-107.4	0	0	0	111.8	T439 E440 K447	T439-H443 VanDerWaalsContact O-CB 3.23Å; T439-H443 WeakPolarHBondContact O-CB 3.28Å; T439-H443 PolarHBondContact O-N 2.95Å; E440-H443 PolarHBondContact O-N 2.87Å; H443-K447 WeakPolarHBondContact O-CB 3.36Å; H443-K447 PolarHBondContact O-N 3.29Å; H443-K447 VanDerWaalsContact O-N 3.11Å
444	Y	39.3	Very low	36.7	Very low	169 Å²	169	122.5 Å²	122.5	66%	0.663	61%	0.608	S	S	*	*	H	α-helix	trans	-70	-35.5	175.7	-148.3	-82.7	0	0	0	112.9	E440 L441 I442 N448	E440-Y444 WeakPolarHBondContact O-CB 3.49Å; E440-Y444 PolarHBondContact O-N 3.38Å; L441-Y444 PolarHBondContact O-N 3.24Å; I442-Y444 VanDerWaalsContact C-N 3.31Å; I442-Y444 PolarHBondContact O-N 2.86Å; Y444-N448 WeakPolarHBondContact CD1-ND2 3.23Å; Y444-N448 WeakPolarHBondContact CE1-ND2 3.39Å; Y444-N448 PolarHBondContact O-ND2 3.25Å
445	L	36	Very low	36.3	Very low	91 Å²	91	122.9 Å²	122.9	48%	0.476	61%	0.61	S	S	.	*	H	α-helix	trans	-69.5	-50.7	174.9	-75.2	165.3	0	0	0	111.4	L441 I442 K447 N448 N449	L441-L445 HydrophobicContact CG-CD1 4.35Å; L441-L445 WeakPolarHBondContact O-CG 3.23Å; L441-L445 PolarHBondContact O-N 2.96Å; I442-L445 PolarHBondContact O-N 3.4Å; L445-K447 PolarHBondContact O-N 2.85Å; L445-N448 PolarHBondContact O-N 3.32Å; L445-N449 WeakPolarHBondContact O-CB 3.48Å; L445-N449 PolarHBondContact O-N 2.82Å; L445-N449 PolarHBondContact O-OD1 3.38Å
446	N	40.8	Very low	35.8	Very low	86 Å²	86	122.5 Å²	122.5	46%	0.46	62%	0.622	S	S	.	*	H	α-helix	trans	-60.8	-44.6	-178.9	-68.7	6.1	0	0	0	111.6	I442 N448 N449 E450	I442-N446 WeakPolarHBondContact O-CB 3.4Å; I442-N446 PolarHBondContact O-N 3.4Å; I442-N446 PolarHBondContact O-OD1 3.35Å; N446-N448 PolarHBondContact O-N 3.43Å; N446-N448 VanDerWaalsContact O-N 3.12Å; N446-N449 PolarHBondContact O-N 3.44Å; N446-E450 PolarHBondContact O-N 3.03Å; N446-E450 VanDerWaalsContact O-N 3.1Å
447	K	40.7	Very low	35.5	Very low	137 Å²	137	119.3 Å²	119.3	60%	0.596	62%	0.618	S	S	*	*	H	α-helix	trans	-63.4	-17.9	179.7	-169.7	169.7	-175.8	173.9	0	114.5	H443 L445	H443-K447 WeakPolarHBondContact O-CB 3.36Å; H443-K447 PolarHBondContact O-N 3.29Å; H443-K447 VanDerWaalsContact O-N 3.11Å; L445-K447 PolarHBondContact O-N 2.85Å
448	N	38.3	Very low	34.9	Very low	86 Å²	86	117.6 Å²	117.6	46%	0.46	61%	0.612	S	S	.	*	H	α-helix	trans	-98.3	-36.3	173.5	-68.7	-30.3	0	0	0	112.3	Y444 L445 N446 E450 K451	Y444-N448 WeakPolarHBondContact CD1-ND2 3.23Å; Y444-N448 WeakPolarHBondContact CE1-ND2 3.39Å; Y444-N448 PolarHBondContact O-ND2 3.25Å; L445-N448 PolarHBondContact O-N 3.32Å; N446-N448 PolarHBondContact O-N 3.43Å; N446-N448 VanDerWaalsContact O-N 3.12Å; N448-E450 VanDerWaalsContact C-N 3.3Å; N448-E450 PolarHBondContact O-N 3.11Å; N448-K451 PolarHBondContact O-N 2.86Å; N448-K451 VanDerWaalsContact O-N 3.16Å
449	N	32.5	Very low	34.4	Very low	111 Å²	111	118.7 Å²	118.7	59%	0.594	62%	0.624	S	S	*	*	H	α-helix	trans	-64.7	-32.9	178.7	-70.3	-9.4	0	0	0	112.5	L445 N446 K451	L445-N449 WeakPolarHBondContact O-CB 3.48Å; L445-N449 PolarHBondContact O-N 2.82Å; L445-N449 PolarHBondContact O-OD1 3.38Å; N446-N449 PolarHBondContact O-N 3.44Å; N449-K451 PolarHBondContact O-N 3.34Å
450	E	33	Very low	34	Very low	165 Å²	165	121 Å²	121	77%	0.771	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	6.3	175.9	-67.3	177.2	168.5	0	0	114	N446 N448	N446-E450 PolarHBondContact O-N 3.03Å; N446-E450 VanDerWaalsContact O-N 3.1Å; N448-E450 VanDerWaalsContact C-N 3.3Å; N448-E450 PolarHBondContact O-N 3.11Å
451	K	31.3	Very low	33.5	Very low	175 Å²	175	124.9 Å²	124.9	76%	0.761	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	8.4	-173.6	-77.8	-161.5	169.8	-164.1	0	116.8	N448 N449	N448-K451 PolarHBondContact O-N 2.86Å; N448-K451 VanDerWaalsContact O-N 3.16Å; N449-K451 PolarHBondContact O-N 3.34Å
452	A	29.5	Very low	33.3	Very low	75 Å²	75	125.6 Å²	125.6	62%	0.62	65%	0.65	S	S	*	*			trans	-133.6	38.8	-177.8	0	0	0	0	0	113.3	D454	A452-D454 VanDerWaalsContact C-N 3.29Å
453	L	27.2	Very low	33	Very low	177 Å²	177	124.9 Å²	124.9	93%	0.927	65%	0.652	S	S	*	*	S	Bend	trans	-98.2	30.1	169	-114.4	168.7	0	0	0	112
454	D	27	Very low	32.8	Very low	129 Å²	129	124.2 Å²	124.2	69%	0.69	66%	0.659	S	S	*	*			trans	-160.3	-163.3	173.4	-156.9	-26.4	0	0	0	107	A452	A452-D454 VanDerWaalsContact C-N 3.29Å
455	L	27.5	Very low	32.6	Very low	94 Å²	94	124.3 Å²	124.3	49%	0.492	66%	0.659	S	S	.	*			trans	85.7	48.5	173.4	-47.1	-177.9	0	0	0	116.5	S457 T458	L455-S457 PolarHBondContact O-N 3.39Å; L455-S457 VanDerWaalsContact O-N 3.09Å; L455-T458 HydrophobicContact CD2-CG2 3.81Å
456	S	26.8	Very low	32.6	Very low	127 Å²	127	125.8 Å²	125.8	89%	0.888	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	15.1	151.2	56.6	0	0	0	0	113.4
457	S	26	Very low	32.9	Very low	81 Å²	81	125.5 Å²	125.5	57%	0.566	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.3	5	-150.9	55	0	0	0	0	117	L455	L455-S457 PolarHBondContact O-N 3.39Å; L455-S457 VanDerWaalsContact O-N 3.09Å
458	T	27.6	Very low	33	Very low	74 Å²	74	127.1 Å²	127.1	45%	0.454	67%	0.672	S	S	.	*			trans	-116.3	107	179.2	47.4	0	0	0	0	115.2	L455 L460	L455-T458 HydrophobicContact CD2-CG2 3.81Å; T458-L460 PolarHBondContact O-N 3.23Å
459	N	27.8	Very low	33.3	Very low	167 Å²	167	128.6 Å²	128.6	89%	0.893	68%	0.677	S	S	*	*			trans	-74.9	49.1	173.4	-85.6	-58.6	0	0	0	114	K461	N459-K461 PolarHBondContact O-N 2.89Å; N459-K461 VanDerWaalsContact O-N 3.1Å
460	L	34.6	Very low	33.7	Very low	143 Å²	143	126.4 Å²	126.4	75%	0.749	67%	0.669	S	S	*	*			trans	-78.9	92.9	178.2	-89.8	161.9	0	0	0	111.5	T458 I462	T458-L460 PolarHBondContact O-N 3.23Å; L460-I462 PolarHBondContact O-N 2.94Å
461	K	32.4	Very low	34.3	Very low	203 Å²	203	124.4 Å²	124.4	88%	0.883	66%	0.658	S	S	*	*			trans	-65.5	89.7	174.1	-69.9	-176.6	178.3	175.5	0	111.5	N459	N459-K461 PolarHBondContact O-N 2.89Å; N459-K461 VanDerWaalsContact O-N 3.1Å
462	I	35.1	Very low	35.2	Very low	129 Å²	129	123.7 Å²	123.7	66%	0.662	66%	0.655	S	S	*	*			trans	-59.1	127.8	171.9	-63.4	170.6	0	0	0	109.4	L460	L460-I462 PolarHBondContact O-N 2.94Å
463	P	33.9	Very low	36.2	Very low	76 Å²	76	125.8 Å²	125.8	49%	0.494	65%	0.652	S	S	.	*			trans	-60	130.1	-177.7	-26.7	35.2	0	0	0	112.7	Y465	P463-Y465 PolarHBondContact O-N 3.34Å
464	P	40.5	Very low	37	Very low	113 Å²	113	121.6 Å²	121.6	73%	0.734	63%	0.63	S	S	*	*	H	α-helix	trans	-67.1	-9.4	-174.1	26.4	-35.3	0	0	0	114.3
465	Y	37.1	Very low	38	Very low	171 Å²	171	122.3 Å²	122.3	67%	0.671	63%	0.627	S	S	*	*	H	α-helix	trans	-78.1	-47.9	-178.6	-163.8	-104	0	0	0	113.2	P463 N467	P463-Y465 PolarHBondContact O-N 3.34Å; Y465-N467 VanDerWaalsContact C-N 3.31Å; Y465-N467 PolarHBondContact O-N 2.85Å
466	L	35.4	Very low	39.3	Very low	122 Å²	122	124 Å²	124	64%	0.639	63%	0.632	S	S	*	*	H	α-helix	trans	-61.7	-41	179.7	-86.9	79.4	0	0	0	111.5	K468 Q469 C470	L466-K468 VanDerWaalsContact C-N 3.33Å; L466-K468 PolarHBondContact O-N 3.39Å; L466-Q469 PolarHBondContact O-N 3.3Å; L466-C470 PolarHBondContact O-N 3.39Å; L466-C470 VanDerWaalsContact O-N 3.09Å
467	N	46.2	Very low	40.2	Very low	81 Å²	81	124 Å²	124	43%	0.433	62%	0.619	S	S	.	*	H	α-helix	trans	-62	-39.5	-172	-148.6	-6	0	0	0	111.8	Y465 F471	Y465-N467 VanDerWaalsContact C-N 3.31Å; Y465-N467 PolarHBondContact O-N 2.85Å; N467-F471 WeakPolarHBondContact O-CB 3.32Å; N467-F471 PolarHBondContact O-N 2.86Å; N467-F471 WeakPolarHBondContact OD1-CD2 3.31Å; N467-F471 VanDerWaalsContact OD1-CE2 3.28Å; N467-F471 WeakPolarHBondContact OD1-CE2 3.41Å
468	K	43.8	Very low	41.4	Very low	170 Å²	170	123.3 Å²	123.3	74%	0.739	61%	0.613	S	S	*	*	H	α-helix	trans	-70.5	-34.5	-179.7	-80.5	-177	176.5	175.8	0	114.5	L466 K472	L466-K468 VanDerWaalsContact C-N 3.33Å; L466-K468 PolarHBondContact O-N 3.39Å; K468-K472 PolarHBondContact O-N 3.16Å
469	Q	43.9	Very low	42.6	Very low	118 Å²	118	126.6 Å²	126.6	55%	0.551	62%	0.621	S	S	*	*	H	α-helix	trans	-75.4	-44.2	175.4	-78.3	-169.5	-17.1	0	0	111.5	L466 K472 Q473	L466-Q469 PolarHBondContact O-N 3.3Å; Q469-K472 PolarHBondContact O-N 3.34Å; Q469-K472 VanDerWaalsContact O-N 3.17Å; Q469-Q473 PolarHBondContact O-N 3.17Å
470	C	41.4	Very low	43.6	Very low	65 Å²	65	122.9 Å²	122.9	44%	0.439	60%	0.602	S	S	.	*	H	α-helix	trans	-62.3	-45.9	179.2	-165.5	0	0	0	0	111.8	L466 K472 Q473 L474	L466-C470 PolarHBondContact O-N 3.39Å; L466-C470 VanDerWaalsContact O-N 3.09Å; C470-K472 VanDerWaalsContact C-N 3.31Å; C470-K472 PolarHBondContact O-N 2.85Å; C470-Q473 PolarHBondContact O-N 3.41Å; C470-L474 WeakPolarHBondContact O-CB 3.45Å; C470-L474 WeakPolarHBondContact O-CG 3.23Å; C470-L474 PolarHBondContact O-N 3.15Å
471	F	45.8	Very low	44.3	Very low	123 Å²	123	123.3 Å²	123.3	54%	0.539	59%	0.594	S	S	.	*	H	α-helix	trans	-62	-33	174.1	-98.1	-94.4	0	0	0	113.8	N467 K475	N467-F471 WeakPolarHBondContact O-CB 3.32Å; N467-F471 PolarHBondContact O-N 2.86Å; N467-F471 WeakPolarHBondContact OD1-CD2 3.31Å; N467-F471 VanDerWaalsContact OD1-CE2 3.28Å; N467-F471 WeakPolarHBondContact OD1-CE2 3.41Å; F471-K475 WeakPolarHBondContact O-CB 3.49Å; F471-K475 WeakPolarHBondContact O-CG 3.23Å; F471-K475 PolarHBondContact O-N 3.45Å
472	K	49.7	Very low	45.4	Very low	160 Å²	160	120.7 Å²	120.7	70%	0.696	58%	0.583	S	S	*	*	H	α-helix	trans	-65.3	-47.6	173.5	-89.2	-171.5	172.1	-173.7	0	111	K468 Q469 C470 K475 Q476	K468-K472 PolarHBondContact O-N 3.16Å; Q469-K472 PolarHBondContact O-N 3.34Å; Q469-K472 VanDerWaalsContact O-N 3.17Å; C470-K472 VanDerWaalsContact C-N 3.31Å; C470-K472 PolarHBondContact O-N 2.85Å; K472-K475 PolarHBondContact O-N 3.3Å; K472-Q476 WeakPolarHBondContact O-CB 3.49Å; K472-Q476 PolarHBondContact O-N 3.02Å
473	Q	49.7	Very low	46.3	Very low	118 Å²	118	120.9 Å²	120.9	55%	0.551	58%	0.576	S	S	*	*	H	α-helix	trans	-62.9	-44.6	178.3	-71.5	178.1	-14.3	0	0	111.8	Q469 C470 K475 Q476 Q477	Q469-Q473 PolarHBondContact O-N 3.17Å; C470-Q473 PolarHBondContact O-N 3.41Å; Q473-K475 PolarHBondContact O-N 2.96Å; Q473-Q476 PolarHBondContact O-N 2.96Å; Q473-Q476 VanDerWaalsContact O-N 3.15Å; Q473-Q477 WeakPolarHBondContact O-CB 3.24Å; Q473-Q477 WeakPolarHBondContact O-CG 3.28Å; Q473-Q477 PolarHBondContact O-N 3.31Å
474	L	44.7	Very low	47.2	Very low	89 Å²	89	122.2 Å²	122.2	47%	0.466	58%	0.576	S	S	.	*	H	α-helix	trans	-64	-39.7	176.6	-72.5	165.9	0	0	0	112.8	C470 Q476 S478	C470-L474 WeakPolarHBondContact O-CB 3.45Å; C470-L474 WeakPolarHBondContact O-CG 3.23Å; C470-L474 PolarHBondContact O-N 3.15Å; L474-Q476 VanDerWaalsContact C-N 3.34Å; L474-S478 WeakPolarHBondContact O-CB 3.01Å; L474-S478 PolarHBondContact O-N 3.14Å; L474-S478 PolarHBondContact O-OG 3.04Å
475	K	48.5	Very low	47.6	Very low	144 Å²	144	119.9 Å²	119.9	63%	0.626	56%	0.558	S	S	*	*	H	α-helix	trans	-64.3	-37.9	171.6	-79.7	-170.5	173.7	-170.5	0	112	F471 K472 Q473 S478 F479	F471-K475 WeakPolarHBondContact O-CB 3.49Å; F471-K475 WeakPolarHBondContact O-CG 3.23Å; F471-K475 PolarHBondContact O-N 3.45Å; K472-K475 PolarHBondContact O-N 3.3Å; Q473-K475 PolarHBondContact O-N 2.96Å; K475-S478 WeakPolarHBondContact CA-OG 2.97Å; K475-S478 PolarHBondContact O-OG 3.34Å; K475-F479 VanDerWaalsContact O-CB 3.29Å; K475-F479 WeakPolarHBondContact O-CB 3.17Å; K475-F479 PolarHBondContact O-N 3.28Å
476	Q	53.4	Low	48.3	Very low	130 Å²	130	117.2 Å²	117.2	61%	0.607	55%	0.551	S	S	*	*	H	α-helix	trans	-73.6	-38.4	-179.8	-159.1	166.7	14.7	0	0	112.4	K472 Q473 L474 N480	K472-Q476 WeakPolarHBondContact O-CB 3.49Å; K472-Q476 PolarHBondContact O-N 3.02Å; Q473-Q476 PolarHBondContact O-N 2.96Å; Q473-Q476 VanDerWaalsContact O-N 3.15Å; L474-Q476 VanDerWaalsContact C-N 3.34Å; Q476-N480 WeakPolarHBondContact O-CB 3.3Å; Q476-N480 PolarHBondContact O-N 2.99Å; Q476-N480 PolarHBondContact O-ND2 3.05Å
477	Q	47.5	Very low	49.1	Very low	128 Å²	128	117.3 Å²	117.3	60%	0.598	55%	0.546	S	S	*	.	H	α-helix	trans	-64.4	-48.1	171.7	-75.1	177.7	-14.3	0	0	111.9	Q473 F479 N480 Y481	Q473-Q477 WeakPolarHBondContact O-CB 3.24Å; Q473-Q477 WeakPolarHBondContact O-CG 3.28Å; Q473-Q477 PolarHBondContact O-N 3.31Å; Q477-F479 PolarHBondContact O-N 3.26Å; Q477-N480 PolarHBondContact O-N 3.06Å; Q477-Y481 WeakPolarHBondContact O-CB 3.43Å; Q477-Y481 PolarHBondContact O-N 3.03Å
478	S	50.3	Low	49.2	Very low	65 Å²	65	119.6 Å²	119.6	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-66.9	-33.7	179	54.5	0	0	0	0	113.1	L474 K475 Y481 K482	L474-S478 WeakPolarHBondContact O-CB 3.01Å; L474-S478 PolarHBondContact O-N 3.14Å; L474-S478 PolarHBondContact O-OG 3.04Å; K475-S478 WeakPolarHBondContact CA-OG 2.97Å; K475-S478 PolarHBondContact O-OG 3.34Å; S478-Y481 PolarHBondContact O-N 3.4Å; S478-K482 WeakPolarHBondContact O-CG 3.4Å; S478-K482 PolarHBondContact O-N 2.93Å
479	F	51.8	Low	49.2	Very low	143 Å²	143	116.5 Å²	116.5	63%	0.627	54%	0.543	S	S	*	.	H	α-helix	trans	-63.7	-48.8	169.4	-172.4	-92	0	0	0	111.7	K475 Q477 Y481 K482 Y483	K475-F479 VanDerWaalsContact O-CB 3.29Å; K475-F479 WeakPolarHBondContact O-CB 3.17Å; K475-F479 PolarHBondContact O-N 3.28Å; Q477-F479 PolarHBondContact O-N 3.26Å; F479-Y481 VanDerWaalsContact C-N 3.3Å; F479-Y481 PolarHBondContact O-N 3.36Å; F479-K482 PolarHBondContact O-N 3.29Å; F479-Y483 WeakPolarHBondContact O-CB 3.32Å; F479-Y483 PolarHBondContact O-N 3.37Å
480	N	50.2	Low	49	Very low	90 Å²	90	119.1 Å²	119.1	48%	0.481	55%	0.549	S	S	.	.	H	α-helix	trans	-59.9	-38.8	175.9	-81.4	-21.3	0	0	0	112.3	Q476 Q477 Y483 Q484	Q476-N480 WeakPolarHBondContact O-CB 3.3Å; Q476-N480 PolarHBondContact O-N 2.99Å; Q476-N480 PolarHBondContact O-ND2 3.05Å; Q477-N480 PolarHBondContact O-N 3.06Å; N480-Y483 PolarHBondContact O-N 3.24Å; N480-Q484 WeakPolarHBondContact O-CB 3.43Å; N480-Q484 WeakPolarHBondContact O-CG 3.21Å; N480-Q484 PolarHBondContact O-N 2.94Å
481	Y	49.4	Very low	48.8	Very low	151 Å²	151	119.1 Å²	119.1	59%	0.592	55%	0.55	S	S	*	*	H	α-helix	trans	-67	-43.1	177.1	-168	-100	0	0	0	112.2	Q477 S478 F479 Q484 N485	Q477-Y481 WeakPolarHBondContact O-CB 3.43Å; Q477-Y481 PolarHBondContact O-N 3.03Å; S478-Y481 PolarHBondContact O-N 3.4Å; F479-Y481 VanDerWaalsContact C-N 3.3Å; F479-Y481 PolarHBondContact O-N 3.36Å; Y481-Q484 PolarHBondContact O-N 3.21Å; Y481-N485 WeakPolarHBondContact CE1-ND2 3.44Å; Y481-N485 WeakPolarHBondContact O-CB 3.24Å; Y481-N485 PolarHBondContact O-N 3.14Å
482	K	54.4	Low	48.3	Very low	149 Å²	149	117.8 Å²	117.8	65%	0.648	55%	0.549	S	S	*	.	H	α-helix	trans	-60.1	-45.8	171.5	-77.7	-174.3	175.9	-173.7	0	111.7	S478 F479 N485 Q486	S478-K482 WeakPolarHBondContact O-CG 3.4Å; S478-K482 PolarHBondContact O-N 2.93Å; F479-K482 PolarHBondContact O-N 3.29Å; K482-N485 PolarHBondContact O-N 2.89Å; K482-Q486 WeakPolarHBondContact O-CB 3.08Å; K482-Q486 WeakPolarHBondContact O-CG 3.27Å; K482-Q486 PolarHBondContact O-N 2.97Å
483	Y	54.6	Low	47.8	Very low	132 Å²	132	117 Å²	117	52%	0.518	55%	0.545	S	S	.	.	H	α-helix	trans	-65.2	-42.4	179.3	-175.8	-114.6	0	0	0	112.7	F479 N480 Q486 K487	F479-Y483 WeakPolarHBondContact O-CB 3.32Å; F479-Y483 PolarHBondContact O-N 3.37Å; N480-Y483 PolarHBondContact O-N 3.24Å; Y483-Q486 PolarHBondContact O-N 2.81Å; Y483-K487 VanDerWaalsContact O-CB 3.23Å; Y483-K487 WeakPolarHBondContact O-CB 3.19Å; Y483-K487 PolarHBondContact O-N 2.84Å
484	Q	51.9	Low	47.1	Very low	105 Å²	105	117.5 Å²	117.5	49%	0.491	55%	0.546	S	S	.	.	H	α-helix	trans	-58.5	-47.6	172.6	-75.1	-81.9	21.9	0	0	111.4	N480 Y481 K487 K488	N480-Q484 WeakPolarHBondContact O-CB 3.43Å; N480-Q484 WeakPolarHBondContact O-CG 3.21Å; N480-Q484 PolarHBondContact O-N 2.94Å; Y481-Q484 PolarHBondContact O-N 3.21Å; Q484-K487 PolarHBondContact O-N 3.34Å; Q484-K488 WeakPolarHBondContact O-CB 3.31Å; Q484-K488 PolarHBondContact O-N 2.93Å
485	N	50.5	Low	46.3	Very low	64 Å²	64	118 Å²	118	34%	0.342	55%	0.548	S	S	.	.	H	α-helix	trans	-67.9	-41	179.4	-79.4	-23.2	0	0	0	112.7	Y481 K482 K488 L489	Y481-N485 WeakPolarHBondContact CE1-ND2 3.44Å; Y481-N485 WeakPolarHBondContact O-CB 3.24Å; Y481-N485 PolarHBondContact O-N 3.14Å; K482-N485 PolarHBondContact O-N 2.89Å; N485-K488 PolarHBondContact O-N 2.76Å; N485-L489 WeakPolarHBondContact O-CB 3.3Å; N485-L489 WeakPolarHBondContact O-CG 3.22Å; N485-L489 PolarHBondContact O-N 2.81Å
486	Q	50.7	Low	45.5	Very low	115 Å²	115	113.4 Å²	113.4	54%	0.537	54%	0.535	S	S	.	.	H	α-helix	trans	-60.2	-45.7	171.8	-77	178.6	-16.9	0	0	111.3	K482 Y483 K488 L489 Y490	K482-Q486 WeakPolarHBondContact O-CB 3.08Å; K482-Q486 WeakPolarHBondContact O-CG 3.27Å; K482-Q486 PolarHBondContact O-N 2.97Å; Y483-Q486 PolarHBondContact O-N 2.81Å; Q486-K488 VanDerWaalsContact C-N 3.34Å; Q486-K488 PolarHBondContact O-N 2.87Å; Q486-L489 PolarHBondContact O-N 2.78Å; Q486-Y490 WeakPolarHBondContact O-CB 3.46Å; Q486-Y490 PolarHBondContact O-N 2.86Å
487	K	52.9	Low	44.4	Very low	123 Å²	123	113.1 Å²	113.1	54%	0.535	53%	0.531	S	S	.	.	H	α-helix	trans	-62.7	-38.4	176.6	-170.3	177	-178.1	-178	0	112.1	Y483 Q484 Y490 S491	Y483-K487 VanDerWaalsContact O-CB 3.23Å; Y483-K487 WeakPolarHBondContact O-CB 3.19Å; Y483-K487 PolarHBondContact O-N 2.84Å; Q484-K487 PolarHBondContact O-N 3.34Å; K487-Y490 PolarHBondContact O-N 3.45Å; K487-S491 WeakPolarHBondContact O-CB 3.27Å; K487-S491 PolarHBondContact O-N 2.99Å; K487-S491 PolarHBondContact O-OG 2.73Å
488	K	47.1	Very low	43.5	Very low	129 Å²	129	112.4 Å²	112.4	56%	0.561	53%	0.528	S	S	*	.	H	α-helix	trans	-67.8	-43.2	175	-166.3	173.5	-176.1	175.3	0	111.9	Q484 N485 Q486 S491 N492	Q484-K488 WeakPolarHBondContact O-CB 3.31Å; Q484-K488 PolarHBondContact O-N 2.93Å; N485-K488 PolarHBondContact O-N 2.76Å; Q486-K488 VanDerWaalsContact C-N 3.34Å; Q486-K488 PolarHBondContact O-N 2.87Å; K488-S491 PolarHBondContact O-N 3.27Å; K488-N492 WeakPolarHBondContact O-CB 3.49Å; K488-N492 VanDerWaalsContact O-CG 3.29Å; K488-N492 PolarHBondContact O-N 3.28Å; K488-N492 PolarHBondContact O-OD1 2.91Å
489	L	44.4	Very low	42.5	Very low	105 Å²	105	114.1 Å²	114.1	55%	0.55	53%	0.531	S	S	.	.	H	α-helix	trans	-62	-42	172.7	-75.7	165.4	0	0	0	111.9	N485 Q486 N492 K493	N485-L489 WeakPolarHBondContact O-CB 3.3Å; N485-L489 WeakPolarHBondContact O-CG 3.22Å; N485-L489 PolarHBondContact O-N 2.81Å; Q486-L489 PolarHBondContact O-N 2.78Å; L489-N492 PolarHBondContact O-N 3.15Å; L489-K493 WeakPolarHBondContact O-CB 3.26Å; L489-K493 WeakPolarHBondContact O-CG 3.38Å; L489-K493 PolarHBondContact O-N 2.99Å
490	Y	40.3	Very low	41.4	Very low	173 Å²	173	114.6 Å²	114.6	68%	0.678	53%	0.53	S	S	*	.	H	α-helix	trans	-68.2	-42.3	178.5	-147.9	-88.2	0	0	0	111.6	Q486 K487 K493 K494	Q486-Y490 WeakPolarHBondContact O-CB 3.46Å; Q486-Y490 PolarHBondContact O-N 2.86Å; K487-Y490 PolarHBondContact O-N 3.45Å; Y490-K493 PolarHBondContact O-N 3.45Å; Y490-K494 VanDerWaalsContact O-CB 3.26Å; Y490-K494 WeakPolarHBondContact O-CB 3.39Å; Y490-K494 PolarHBondContact O-N 3.4Å
491	S	36.7	Very low	40.5	Very low	65 Å²	65	115.9 Å²	115.9	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-61.8	-45.1	172	-72.1	0	0	0	0	112	K487 K488 K494 L495	K487-S491 WeakPolarHBondContact O-CB 3.27Å; K487-S491 PolarHBondContact O-N 2.99Å; K487-S491 PolarHBondContact O-OG 2.73Å; K488-S491 PolarHBondContact O-N 3.27Å; S491-K494 PolarHBondContact O-N 2.99Å; S491-L495 VanDerWaalsContact O-CB 3.3Å; S491-L495 WeakPolarHBondContact O-CB 3.41Å; S491-L495 PolarHBondContact O-N 3.31Å
492	N	34.7	Very low	39.5	Very low	96 Å²	96	111.3 Å²	111.3	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-43.1	177.5	-74.8	9.2	0	0	0	111.7	K488 L489 K494 L495 S496	K488-N492 WeakPolarHBondContact O-CB 3.49Å; K488-N492 VanDerWaalsContact O-CG 3.29Å; K488-N492 PolarHBondContact O-N 3.28Å; K488-N492 PolarHBondContact O-OD1 2.91Å; L489-N492 PolarHBondContact O-N 3.15Å; N492-K494 VanDerWaalsContact C-N 3.28Å; N492-K494 PolarHBondContact O-N 3.09Å; N492-L495 PolarHBondContact O-N 3.2Å; N492-S496 WeakPolarHBondContact O-CB 3.28Å; N492-S496 PolarHBondContact O-N 3.5Å; N492-S496 PolarHBondContact O-OG 3.28Å; N492-S496 VanDerWaalsContact O-OG 3.12Å
493	K	39.5	Very low	38.3	Very low	143 Å²	143	105.9 Å²	105.9	62%	0.622	51%	0.507	S	S	*	.	H	α-helix	trans	-65	-28.4	173.5	-75.4	-175.2	176.9	-173.2	0	112.9	L489 Y490 S496 K497	L489-K493 WeakPolarHBondContact O-CB 3.26Å; L489-K493 WeakPolarHBondContact O-CG 3.38Å; L489-K493 PolarHBondContact O-N 2.99Å; Y490-K493 PolarHBondContact O-N 3.45Å; K493-S496 PolarHBondContact O-OG 3.21Å; K493-K497 WeakPolarHBondContact O-CB 3.42Å; K493-K497 WeakPolarHBondContact O-CD 3.33Å; K493-K497 WeakPolarHBondContact O-CG 3.49Å; K493-K497 PolarHBondContact O-N 3.1Å
494	K	34.8	Very low	37.3	Very low	129 Å²	129	103.6 Å²	103.6	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-78	-41.9	174.2	-171.1	178.1	-179.3	-177.2	0	111.6	Y490 S491 N492 Q498	Y490-K494 VanDerWaalsContact O-CB 3.26Å; Y490-K494 WeakPolarHBondContact O-CB 3.39Å; Y490-K494 PolarHBondContact O-N 3.4Å; S491-K494 PolarHBondContact O-N 2.99Å; N492-K494 VanDerWaalsContact C-N 3.28Å; N492-K494 PolarHBondContact O-N 3.09Å; K494-Q498 WeakPolarHBondContact O-CB 3.25Å; K494-Q498 WeakPolarHBondContact O-CG 3.33Å; K494-Q498 PolarHBondContact O-N 3.38Å
495	L	29.4	Very low	36.4	Very low	99 Å²	99	105.9 Å²	105.9	52%	0.518	51%	0.508	S	S	.	.	H	α-helix	trans	-68	-44.7	179.7	-162.7	77.1	0	0	0	111.1	S491 N492 Q498 I499	S491-L495 VanDerWaalsContact O-CB 3.3Å; S491-L495 WeakPolarHBondContact O-CB 3.41Å; S491-L495 PolarHBondContact O-N 3.31Å; N492-L495 PolarHBondContact O-N 3.2Å; L495-Q498 CarbonylContact O-C 3.5Å; L495-Q498 PolarHBondContact O-N 3.02Å; L495-I499 HydrophobicContact CD2-CD1 4.29Å; L495-I499 HydrophobicContact CG-CD1 3.95Å; L495-I499 WeakPolarHBondContact O-CB 3.46Å; L495-I499 VanDerWaalsContact O-CG1 3.27Å; L495-I499 WeakPolarHBondContact O-CG1 3.2Å; L495-I499 PolarHBondContact O-N 3.32Å
496	S	29.9	Very low	35.6	Very low	48 Å²	48	109.3 Å²	109.3	34%	0.336	52%	0.52	S	S	.	.	H	α-helix	trans	-61.6	-46.9	174.7	64.1	0	0	0	0	111.4	N492 K493 Q498 I499 Y500	N492-S496 WeakPolarHBondContact O-CB 3.28Å; N492-S496 PolarHBondContact O-N 3.5Å; N492-S496 PolarHBondContact O-OG 3.28Å; N492-S496 VanDerWaalsContact O-OG 3.12Å; K493-S496 PolarHBondContact O-OG 3.21Å; S496-Q498 VanDerWaalsContact C-N 3.33Å; S496-Q498 PolarHBondContact O-N 2.81Å; S496-I499 PolarHBondContact O-N 2.98Å; S496-I499 VanDerWaalsContact O-N 3.14Å; S496-Y500 WeakPolarHBondContact O-CD2 3.34Å; S496-Y500 PolarHBondContact O-N 3.35Å
497	K	31.6	Very low	34.8	Very low	123 Å²	123	107.1 Å²	107.1	54%	0.535	51%	0.512	S	S	.	.	H	α-helix	trans	-55	-46.2	172.2	-77	178.2	180	-168.8	0	111.8	K493 F501	K493-K497 WeakPolarHBondContact O-CB 3.42Å; K493-K497 WeakPolarHBondContact O-CD 3.33Å; K493-K497 WeakPolarHBondContact O-CG 3.49Å; K493-K497 PolarHBondContact O-N 3.1Å; K497-F501 WeakPolarHBondContact O-CB 3.22Å; K497-F501 WeakPolarHBondContact O-CD2 3.49Å; K497-F501 PolarHBondContact O-N 2.9Å
498	Q	29	Very low	34	Very low	114 Å²	114	103 Å²	103	53%	0.533	50%	0.495	S	S	.	.	H	α-helix	trans	-65.9	-35.8	177.1	-75.6	-176.3	-75.3	0	0	113.1	K494 L495 S496 S502	K494-Q498 WeakPolarHBondContact O-CB 3.25Å; K494-Q498 WeakPolarHBondContact O-CG 3.33Å; K494-Q498 PolarHBondContact O-N 3.38Å; L495-Q498 CarbonylContact O-C 3.5Å; L495-Q498 PolarHBondContact O-N 3.02Å; S496-Q498 VanDerWaalsContact C-N 3.33Å; S496-Q498 PolarHBondContact O-N 2.81Å; Q498-S502 WeakPolarHBondContact O-CB 3.17Å; Q498-S502 PolarHBondContact O-N 3.28Å
499	I	28.6	Very low	33.5	Very low	100 Å²	100	101.2 Å²	101.2	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-69.7	-48.6	177.4	-70.9	164.4	0	0	0	110.7	L495 S496 S502 G503	L495-I499 HydrophobicContact CD2-CD1 4.29Å; L495-I499 HydrophobicContact CG-CD1 3.95Å; L495-I499 WeakPolarHBondContact O-CB 3.46Å; L495-I499 VanDerWaalsContact O-CG1 3.27Å; L495-I499 WeakPolarHBondContact O-CG1 3.2Å; L495-I499 PolarHBondContact O-N 3.32Å; S496-I499 PolarHBondContact O-N 2.98Å; S496-I499 VanDerWaalsContact O-N 3.14Å; I499-S502 PolarHBondContact O-N 3.48Å; I499-G503 PolarHBondContact O-N 3Å
500	Y	29	Very low	33	Very low	154 Å²	154	99.9 Å²	99.9	60%	0.604	49%	0.487	S	S	*	.	H	α-helix	trans	-59.3	-51.3	176.2	-76.6	-63.7	0	0	0	111.5	S496 S502 G503 I504	S496-Y500 WeakPolarHBondContact O-CD2 3.34Å; S496-Y500 PolarHBondContact O-N 3.35Å; Y500-S502 VanDerWaalsContact C-N 3.31Å; Y500-S502 PolarHBondContact O-N 2.93Å; Y500-G503 PolarHBondContact O-N 3.39Å; Y500-I504 VanDerWaalsContact O-CB 3.3Å; Y500-I504 WeakPolarHBondContact O-CB 3.42Å; Y500-I504 WeakPolarHBondContact O-CD1 3.48Å; Y500-I504 VanDerWaalsContact O-CG1 3.23Å; Y500-I504 WeakPolarHBondContact O-CG1 3.4Å; Y500-I504 PolarHBondContact O-N 2.94Å
501	F	30.4	Very low	32.7	Very low	116 Å²	116	94 Å²	94	51%	0.509	47%	0.466	S	S	.	.	H	α-helix	trans	-65.8	-31.2	177.1	-75.2	-60.9	0	0	0	113	P374 K497 Y505	P374-F501 HydrophobicContact CG-CE1 4.14Å; K497-F501 WeakPolarHBondContact O-CB 3.22Å; K497-F501 WeakPolarHBondContact O-CD2 3.49Å; K497-F501 PolarHBondContact O-N 2.9Å; F501-Y505 WeakPolarHBondContact O-CB 3.48Å; F501-Y505 PolarHBondContact O-N 2.86Å
502	S	29.7	Very low	32.7	Very low	56 Å²	56	93.1 Å²	93.1	39%	0.392	46%	0.458	S	S	.	.	H	α-helix	trans	-68.9	-46	174.9	178.1	0	0	0	0	112.3	Q498 I499 Y500 K506	Q498-S502 WeakPolarHBondContact O-CB 3.17Å; Q498-S502 PolarHBondContact O-N 3.28Å; I499-S502 PolarHBondContact O-N 3.48Å; Y500-S502 VanDerWaalsContact C-N 3.31Å; Y500-S502 PolarHBondContact O-N 2.93Å; S502-K506 VanDerWaalsContact O-CB 3.31Å; S502-K506 WeakPolarHBondContact O-CB 3.48Å; S502-K506 VanDerWaalsContact O-CG 3.27Å; S502-K506 WeakPolarHBondContact O-CG 3.38Å; S502-K506 PolarHBondContact O-N 3.32Å
503	G	29.1	Very low	32.8	Very low	34 Å²	34	96.4 Å²	96.4	35%	0.351	47%	0.468	S	S	.	.	H	α-helix	trans	-63.4	-50	177.2	0	0	0	0	0	111.7	I499 Y500 K506 L507	I499-G503 PolarHBondContact O-N 3Å; Y500-G503 PolarHBondContact O-N 3.39Å; G503-K506 PolarHBondContact O-N 2.86Å; G503-L507 PolarHBondContact O-N 3.42Å
504	I	34	Very low	32.5	Very low	85 Å²	85	97.1 Å²	97.1	44%	0.436	47%	0.473	S	S	.	.	H	α-helix	trans	-59.1	-50.4	175.9	-68.2	168.7	0	0	0	110.2	Y500 K506 L507 I508	Y500-I504 VanDerWaalsContact O-CB 3.3Å; Y500-I504 WeakPolarHBondContact O-CB 3.42Å; Y500-I504 WeakPolarHBondContact O-CD1 3.48Å; Y500-I504 VanDerWaalsContact O-CG1 3.23Å; Y500-I504 WeakPolarHBondContact O-CG1 3.4Å; Y500-I504 PolarHBondContact O-N 2.94Å; I504-K506 VanDerWaalsContact C-N 3.34Å; I504-K506 PolarHBondContact O-N 2.98Å; I504-L507 PolarHBondContact O-N 2.97Å; I504-I508 HydrophobicContact CG2-CD1 3.48Å; I504-I508 VanDerWaalsContact CG2-CD1 3.48Å; I504-I508 HydrophobicContact CG2-CG1 4.4Å; I504-I508 VanDerWaalsContact O-CD1 3.27Å; I504-I508 WeakPolarHBondContact O-CD1 3.39Å; I504-I508 WeakPolarHBondContact O-CG1 3.2Å; I504-I508 PolarHBondContact O-N 3.46Å
505	Y	32.6	Very low	32.4	Very low	152 Å²	152	91.5 Å²	91.5	60%	0.596	45%	0.45	S	S	*	.	H	α-helix	trans	-61.7	-39.2	179.1	-169.3	-89.1	0	0	0	112.2	F501 I508 H509	F501-Y505 WeakPolarHBondContact O-CB 3.48Å; F501-Y505 PolarHBondContact O-N 2.86Å; Y505-I508 PolarHBondContact O-N 3.48Å; Y505-H509 HydrophobicContact CD1-CB 4.42Å; Y505-H509 HydrophobicContact CE1-CB 4.33Å; Y505-H509 AromaticContact CE1-CD2 3.68Å; Y505-H509 VanDerWaalsContact O-CB 3.22Å; Y505-H509 WeakPolarHBondContact O-CB 3.48Å; Y505-H509 PolarHBondContact O-N 3.27Å
506	K	33.9	Very low	32.6	Very low	136 Å²	136	90.7 Å²	90.7	59%	0.591	44%	0.441	S	S	*	.	H	α-helix	trans	-68.1	-35.1	176	-76.4	179.4	179.6	-172	0	113.6	S502 G503 I504 P510	S502-K506 VanDerWaalsContact O-CB 3.31Å; S502-K506 WeakPolarHBondContact O-CB 3.48Å; S502-K506 VanDerWaalsContact O-CG 3.27Å; S502-K506 WeakPolarHBondContact O-CG 3.38Å; S502-K506 PolarHBondContact O-N 3.32Å; G503-K506 PolarHBondContact O-N 2.86Å; I504-K506 VanDerWaalsContact C-N 3.34Å; I504-K506 PolarHBondContact O-N 2.98Å; K506-P510 VanDerWaalsContact O-CD 3.25Å; K506-P510 WeakPolarHBondContact O-CD 3.41Å
507	L	33.1	Very low	32.8	Very low	70 Å²	70	90.6 Å²	90.6	37%	0.366	44%	0.438	S	S	.	.	H	α-helix	trans	-64.1	-43.2	172.7	-89.3	159.6	0	0	0	111.5	G503 I504	G503-L507 PolarHBondContact O-N 3.42Å; I504-L507 PolarHBondContact O-N 2.97Å
508	I	35.7	Very low	32.8	Very low	36 Å²	36	85.3 Å²	85.3	19%	0.185	42%	0.416	C	S	.	.	H	α-helix	trans	-86.2	-24.5	-176.3	-38	144.2	0	0	0	112.1	P376 I504 Y505 P510 I511 T512	P376-I508 HydrophobicContact CB-CD1 4.05Å; P376-I508 HydrophobicContact CB-CG2 4.11Å; P376-I508 HydrophobicContact CG-CD1 3.32Å; P376-I508 HydrophobicContact CG-CG1 3.99Å; P376-I508 HydrophobicContact CG-CG2 4.38Å; I504-I508 HydrophobicContact CG2-CD1 3.48Å; I504-I508 VanDerWaalsContact CG2-CD1 3.48Å; I504-I508 HydrophobicContact CG2-CG1 4.4Å; I504-I508 VanDerWaalsContact O-CD1 3.27Å; I504-I508 WeakPolarHBondContact O-CD1 3.39Å; I504-I508 WeakPolarHBondContact O-CG1 3.2Å; I504-I508 PolarHBondContact O-N 3.46Å; Y505-I508 PolarHBondContact O-N 3.48Å; I508-P510 VanDerWaalsContact C-CD 3.49Å; I508-I511 HydrophobicContact CG2-CB 4.29Å; I508-I511 CarbonylContact O-C 3.56Å; I508-I511 VanDerWaalsContact O-CA 3.3Å; I508-I511 WeakPolarHBondContact O-CA 3.49Å; I508-I511 WeakPolarHBondContact O-CB 3.27Å; I508-I511 PolarHBondContact O-N 3.17Å; I508-T512 HydrophobicContact CB-CG2 4.26Å; I508-T512 HydrophobicContact CG2-CG2 3.57Å; I508-T512 WeakPolarHBondContact O-CG2 3.39Å; I508-T512 PolarHBondContact O-N 3.32Å
509	H	37.1	Very low	33.1	Very low	91 Å²	91	86.4 Å²	86.4	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-57.1	-36.5	-173.4	-165.9	-1.1	0	0	0	115.2	Y505 I511 T512	Y505-H509 HydrophobicContact CD1-CB 4.42Å; Y505-H509 HydrophobicContact CE1-CB 4.33Å; Y505-H509 AromaticContact CE1-CD2 3.68Å; Y505-H509 VanDerWaalsContact O-CB 3.22Å; Y505-H509 WeakPolarHBondContact O-CB 3.48Å; Y505-H509 PolarHBondContact O-N 3.27Å; H509-I511 VanDerWaalsContact C-N 3.31Å; H509-T512 PolarHBondContact O-OG1 2.92Å
510	P	34.3	Very low	33.2	Very low	78 Å²	78	83.6 Å²	83.6	51%	0.506	41%	0.405	S	S	.	.	H	α-helix	trans	-64.1	-36.5	169.4	-21.7	34.2	0	0	0	112.5	K506 I508	K506-P510 VanDerWaalsContact O-CD 3.25Å; K506-P510 WeakPolarHBondContact O-CD 3.41Å; I508-P510 VanDerWaalsContact C-CD 3.49Å
511	I	33.6	Very low	33.3	Very low	48 Å²	48	82 Å²	82	25%	0.246	41%	0.406	C	S	.	.	H	α-helix	trans	-76.7	-37.3	-177.2	-56.8	170.9	0	0	0	111	I240 I508 H509 K513 H514 C515	I240-I511 HydrophobicContact CD1-CD1 3.91Å; I508-I511 HydrophobicContact CG2-CB 4.29Å; I508-I511 CarbonylContact O-C 3.56Å; I508-I511 VanDerWaalsContact O-CA 3.3Å; I508-I511 WeakPolarHBondContact O-CA 3.49Å; I508-I511 WeakPolarHBondContact O-CB 3.27Å; I508-I511 PolarHBondContact O-N 3.17Å; H509-I511 VanDerWaalsContact C-N 3.31Å; I511-K513 PolarHBondContact O-N 2.94Å; I511-H514 PolarHBondContact O-N 3.44Å; I511-C515 HydrophobicContact CG2-CB 4.41Å; I511-C515 VanDerWaalsContact CG2-SG 3.55Å; I511-C515 WeakPolarHBondContact O-CB 3.41Å; I511-C515 PolarHBondContact O-N 2.8Å; I511-C515 PolarHBondContact O-SG 3.27Å; I511-C515 VanDerWaalsContact O-SG 3.4Å
512	T	36.3	Very low	33.3	Very low	47 Å²	47	79.7 Å²	79.7	29%	0.288	40%	0.402	S	S	.	.	H	α-helix	trans	-67.9	-14.2	176.4	62.2	0	0	0	0	114	I508 H509 H514 T517	I508-T512 HydrophobicContact CB-CG2 4.26Å; I508-T512 HydrophobicContact CG2-CG2 3.57Å; I508-T512 WeakPolarHBondContact O-CG2 3.39Å; I508-T512 PolarHBondContact O-N 3.32Å; H509-T512 PolarHBondContact O-OG1 2.92Å; T512-H514 PolarHBondContact O-N 3.28Å; T512-T517 HydrophobicContact CG2-CG2 3.58Å
513	K	36.8	Very low	33.3	Very low	165 Å²	165	83 Å²	83	72%	0.717	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-24.2	166.9	-81.3	-172.9	170.3	-175.8	0	112.7	I511	I511-K513 PolarHBondContact O-N 2.94Å
514	H	34.5	Very low	33.4	Very low	158 Å²	158	90.4 Å²	90.4	73%	0.731	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	-11.7	-174	-58.3	-77.8	0	0	0	113.6	I511 T512	I511-H514 PolarHBondContact O-N 3.44Å; T512-H514 PolarHBondContact O-N 3.28Å
515	C	31	Very low	33.2	Very low	12 Å²	12	100.6 Å²	100.6	8%	0.081	47%	0.47	C	S	.	.	S	Bend	trans	-111.5	143.6	-179	-62	0	0	0	0	112.4	P378 I511 T517	P378-C515 HydrophobicContact CB-CB 4.23Å; I511-C515 HydrophobicContact CG2-CB 4.41Å; I511-C515 VanDerWaalsContact CG2-SG 3.55Å; I511-C515 WeakPolarHBondContact O-CB 3.41Å; I511-C515 PolarHBondContact O-N 2.8Å; I511-C515 PolarHBondContact O-SG 3.27Å; I511-C515 VanDerWaalsContact O-SG 3.4Å; C515-T517 PolarHBondContact O-N 3.18Å
516	Y	33.5	Very low	33.2	Very low	82 Å²	82	98 Å²	98	32%	0.322	46%	0.463	S	S	.	.	B	Isolated β-bridge	trans	-70.9	112.4	171.1	-75	-109.1	0	0	0	110.4	S397 N399 V518	S397-Y516 WeakPolarHBondContact OG-CD1 3.33Å; N399-Y516 HydrophobicContact CB-CD1 3.74Å; N399-Y516 HydrophobicContact CB-CE1 3.55Å; N399-Y516 VanDerWaalsContact ND2-CD1 3.32Å; N399-Y516 WeakPolarHBondContact ND2-CD1 3.45Å; Y516-V518 PolarHBondContact O-N 3.23Å; Y516-V518 VanDerWaalsContact O-N 3.12Å
517	T	35.1	Very low	33.2	Very low	46 Å²	46	96 Å²	96	28%	0.282	46%	0.456	S	S	.	.			trans	-69.5	107.6	168.2	41	0	0	0	0	110.3	M398 T512 C515	M398-T517 VanDerWaalsContact CB-O 3.29Å; M398-T517 WeakPolarHBondContact CB-O 3.45Å; M398-T517 WeakPolarHBondContact CG-O 3.37Å; M398-T517 PolarHBondContact N-O 3.21Å; M398-T517 PolarHBondContact SD-OG1 3.28Å; T512-T517 HydrophobicContact CG2-CG2 3.58Å; C515-T517 PolarHBondContact O-N 3.18Å
518	V	31.6	Very low	33.2	Very low	12 Å²	12	97.4 Å²	97.4	7%	0.073	46%	0.461	C	S	.	.	B	Isolated β-bridge	trans	-71.8	136.2	160.7	173.4	0	0	0	0	108.3	I379 Y395 Y516	I379-V518 HydrophobicContact CD1-CG2 3.52Å; I379-V518 HydrophobicContact CG1-CG2 4.24Å; Y395-V518 HydrophobicContact CD1-CG1 4.3Å; Y516-V518 PolarHBondContact O-N 3.23Å; Y516-V518 VanDerWaalsContact O-N 3.12Å
519	K	36	Very low	33.1	Very low	136 Å²	136	101.1 Å²	101.1	59%	0.591	48%	0.478	S	S	*	.			trans	-116.1	106.8	171.4	-167.2	170.9	-173	172.9	0	109.4	I521	K519-I521 PolarHBondContact O-N 2.81Å; K519-I521 VanDerWaalsContact O-N 3.16Å
520	I	30.3	Very low	32.8	Very low	41 Å²	41	101.7 Å²	101.7	21%	0.21	48%	0.481	C	S	.	.			trans	-62.7	116	177.6	-50.3	179.3	0	0	0	108.3	I372 I375 Y395	I372-I520 WeakPolarHBondContact CG2-O 3.33Å; I375-I520 HydrophobicContact CB-CD1 4.33Å; Y395-I520 HydrophobicContact CD1-CG1 4.01Å; Y395-I520 HydrophobicContact CD1-CG2 4.47Å; Y395-I520 HydrophobicContact CE1-CB 4.48Å; Y395-I520 HydrophobicContact CE1-CD1 4.01Å; Y395-I520 HydrophobicContact CE1-CG1 3.88Å; Y395-I520 HydrophobicContact CE1-CG2 3.98Å
521	I	31.4	Very low	32.7	Very low	121 Å²	121	103.3 Å²	103.3	62%	0.621	48%	0.48	S	S	*	.			trans	-121.2	104.4	172.3	-61.7	175.7	0	0	0	106.1	K519 I523	K519-I521 PolarHBondContact O-N 2.81Å; K519-I521 VanDerWaalsContact O-N 3.16Å; I521-I523 PolarHBondContact O-N 2.91Å
522	P	29.3	Very low	32.7	Very low	67 Å²	67	107.2 Å²	107.2	44%	0.435	50%	0.496	S	S	.	.			trans	-67.3	106.3	177.5	26.1	-32.5	0	0	0	109.7	L370 K524	L370-P522 HydrophobicContact CD2-CB 4.37Å; L370-P522 HydrophobicContact CD2-CG 3.64Å; P522-K524 PolarHBondContact O-N 2.86Å
523	I	29.7	Very low	32.4	Very low	125 Å²	125	111.8 Å²	111.8	64%	0.641	51%	0.512	S	S	*	.			trans	-73.1	121.1	166.8	-57.2	176.3	0	0	0	106.4	I521 R525	I521-I523 PolarHBondContact O-N 2.91Å; I523-R525 PolarHBondContact O-N 3Å
524	K	31.1	Very low	32	Very low	190 Å²	190	107.4 Å²	107.4	83%	0.826	50%	0.495	S	S	*	.			trans	-64.4	124.8	167.3	-83.6	-164.8	171.7	-166.6	0	108.5	P522	P522-K524 PolarHBondContact O-N 2.86Å
525	R	30.6	Very low	31.8	Very low	299 Å²	299	102.8 Å²	102.8	100%	1.128	47%	0.474	S	S	*	.			trans	-63.1	0	149.9	-68.6	-177.9	176.7	173.4	-1.4	108.7	I523	I523-R525 PolarHBondContact O-N 3Å

Retrieved 525 of 525 residues in 76.9 ms (Link to these results)

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